*HEADER    ELECTRON TRANSPORT                      12-JUL-06   2HNA              
*TITLE     SOLUTION STRUCTURE OF A BACTERIAL APO-FLAVODOXIN                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN MIOC;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: FLAVODOXIN;                                                 
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21A(+)                                 
*KEYWDS    ALPHA-BETA SANDWICH, FLAVODOXIN FOLD                                  
*EXPDTA    NMR, 21 STRUCTURES                                                    
*AUTHOR    Y.HU, C.JIN                                                           
*REVDAT   1   19-SEP-06 2HNA    0                                                

# 2196 atoms read from pdb file sa_1.pdb.
# 5 THR PHI:  (4 ILE C)-(5 THR N)-(5 THR CA)-(5 THR C) -133.5 -73.5
 &rst     iat =    59,    61,    63,    73,
	  r1 = -134.5, r2 = -133.5, r3 = -73.5, r4 = -72.5,
	  rk2 =  50.0, rk3 =  50.0,				&end

# 5 THR PSI:  (5 THR N)-(5 THR CA)-(5 THR C)-(6 LEU N)  93.4 153.4
 &rst     iat =    61,    63,    73,    75,
	  r1 =  92.4, r2 =  93.4, r3 = 153.4, r4 = 154.4,
	&end

# 6 LEU PHI:  (5 THR C)-(6 LEU N)-(6 LEU CA)-(6 LEU C) -127.0 -67.0
 &rst     iat =    73,    75,    77,    92,
	  r1 = -128.0, r2 = -127.0, r3 = -67.0, r4 = -66.0,
	&end

# 6 LEU PSI:  (6 LEU N)-(6 LEU CA)-(6 LEU C)-(7 ILE N)  96.0 156.0
 &rst     iat =    75,    77,    92,    94,
	  r1 =  95.0, r2 =  96.0, r3 = 156.0, r4 = 157.0,
	&end

# 16 GLU PHI:  (15 ALA C)-(16 GLU N)-(16 GLU CA)-(16 GLU C) -95.1 -35.1
 &rst     iat =   197,   199,   201,   212,
	  r1 = -96.1, r2 = -95.1, r3 = -35.1, r4 = -34.1,
	&end

# 16 GLU PSI:  (16 GLU N)-(16 GLU CA)-(16 GLU C)-(17 TYR N) -65.5  -5.5
 &rst     iat =   199,   201,   212,   214,
	  r1 = -66.5, r2 = -65.5, r3 =  -5.5, r4 =  -4.5,
	&end

# 17 TYR PHI:  (16 GLU C)-(17 TYR N)-(17 TYR CA)-(17 TYR C) -94.5 -34.5
 &rst     iat =   212,   214,   216,   233,
	  r1 = -95.5, r2 = -94.5, r3 = -34.5, r4 = -33.5,
	&end

# 17 TYR PSI:  (17 TYR N)-(17 TYR CA)-(17 TYR C)-(18 VAL N) -72.3 -12.3
 &rst     iat =   214,   216,   233,   235,
	  r1 = -73.3, r2 = -72.3, r3 = -12.3, r4 = -11.3,
	&end

# 18 VAL PHI:  (17 TYR C)-(18 VAL N)-(18 VAL CA)-(18 VAL C) -110.0 -35.0
 &rst     iat =   233,   235,   237,   249,
	  r1 = -111.0, r2 = -110.0, r3 = -35.0, r4 = -34.0,
	&end

# 18 VAL PSI:  (18 VAL N)-(18 VAL CA)-(18 VAL C)-(19 ALA N) -71.2 -11.1
 &rst     iat =   235,   237,   249,   251,
	  r1 = -72.2, r2 = -71.2, r3 = -11.1, r4 = -10.1,
	&end

# 19 ALA PHI:  (18 VAL C)-(19 ALA N)-(19 ALA CA)-(19 ALA C) -92.3 -32.3
 &rst     iat =   249,   251,   253,   259,
	  r1 = -93.3, r2 = -92.3, r3 = -32.3, r4 = -31.3,
	&end

# 19 ALA PSI:  (19 ALA N)-(19 ALA CA)-(19 ALA C)-(20 GLU N) -71.6 -11.6
 &rst     iat =   251,   253,   259,   261,
	  r1 = -72.6, r2 = -71.6, r3 = -11.6, r4 = -10.6,
	&end

# 20 GLU PHI:  (19 ALA C)-(20 GLU N)-(20 GLU CA)-(20 GLU C) -93.0 -33.0
 &rst     iat =   259,   261,   263,   274,
	  r1 = -94.0, r2 = -93.0, r3 = -33.0, r4 = -32.0,
	&end

# 20 GLU PSI:  (20 GLU N)-(20 GLU CA)-(20 GLU C)-(21 HIS N) -75.4 -15.4
 &rst     iat =   261,   263,   274,   276,
	  r1 = -76.4, r2 = -75.4, r3 = -15.4, r4 = -14.4,
	&end

# 21 HIS PHI:  (20 GLU C)-(21 HIS N)-(21 HIS CA)-(21 HIS C) -96.2 -36.2
 &rst     iat =   274,   276,   278,   291,
	  r1 = -97.2, r2 = -96.2, r3 = -36.2, r4 = -35.2,
	&end

# 21 HIS PSI:  (21 HIS N)-(21 HIS CA)-(21 HIS C)-(22 LEU N) -70.7 -10.6
 &rst     iat =   276,   278,   291,   293,
	  r1 = -71.7, r2 = -70.7, r3 = -10.6, r4 =  -9.6,
	&end

# 22 LEU PHI:  (21 HIS C)-(22 LEU N)-(22 LEU CA)-(22 LEU C) -92.7 -32.7
 &rst     iat =   291,   293,   295,   310,
	  r1 = -93.7, r2 = -92.7, r3 = -32.7, r4 = -31.7,
	&end

# 22 LEU PSI:  (22 LEU N)-(22 LEU CA)-(22 LEU C)-(23 ALA N) -70.8 -10.8
 &rst     iat =   293,   295,   310,   312,
	  r1 = -71.8, r2 = -70.8, r3 = -10.8, r4 =  -9.8,
	&end

# 23 ALA PHI:  (22 LEU C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -95.9 -35.9
 &rst     iat =   310,   312,   314,   320,
	  r1 = -96.9, r2 = -95.9, r3 = -35.9, r4 = -34.9,
	&end

# 23 ALA PSI:  (23 ALA N)-(23 ALA CA)-(23 ALA C)-(24 GLU N) -74.5 -14.5
 &rst     iat =   312,   314,   320,   322,
	  r1 = -75.5, r2 = -74.5, r3 = -14.5, r4 = -13.5,
	&end

# 24 GLU PHI:  (23 ALA C)-(24 GLU N)-(24 GLU CA)-(24 GLU C) -94.3 -34.3
 &rst     iat =   320,   322,   324,   335,
	  r1 = -95.3, r2 = -94.3, r3 = -34.3, r4 = -33.3,
	&end

# 24 GLU PSI:  (24 GLU N)-(24 GLU CA)-(24 GLU C)-(25 LYS N) -70.2 -10.2
 &rst     iat =   322,   324,   335,   337,
	  r1 = -71.2, r2 = -70.2, r3 = -10.2, r4 =  -9.2,
	&end

# 25 LYS PHI:  (24 GLU C)-(25 LYS N)-(25 LYS CA)-(25 LYS C) -96.9 -36.9
 &rst     iat =   335,   337,   339,   357,
	  r1 = -97.9, r2 = -96.9, r3 = -36.9, r4 = -35.9,
	&end

# 25 LYS PSI:  (25 LYS N)-(25 LYS CA)-(25 LYS C)-(26 LEU N) -68.3  -8.3
 &rst     iat =   337,   339,   357,   359,
	  r1 = -69.3, r2 = -68.3, r3 =  -8.3, r4 =  -7.3,
	&end

# 27 GLU PHI:  (26 LEU C)-(27 GLU N)-(27 GLU CA)-(27 GLU C) -92.9 -32.9
 &rst     iat =   376,   378,   380,   391,
	  r1 = -93.9, r2 = -92.9, r3 = -32.9, r4 = -31.9,
	&end

# 27 GLU PSI:  (27 GLU N)-(27 GLU CA)-(27 GLU C)-(28 GLU N) -65.5  -5.5
 &rst     iat =   378,   380,   391,   393,
	  r1 = -66.5, r2 = -65.5, r3 =  -5.5, r4 =  -4.5,
	&end

# 28 GLU PHI:  (27 GLU C)-(28 GLU N)-(28 GLU CA)-(28 GLU C) -97.8 -37.8
 &rst     iat =   391,   393,   395,   406,
	  r1 = -98.8, r2 = -97.8, r3 = -37.8, r4 = -36.8,
	&end

# 28 GLU PSI:  (28 GLU N)-(28 GLU CA)-(28 GLU C)-(29 ALA N) -55.0   5.0
 &rst     iat =   393,   395,   406,   408,
	  r1 = -56.0, r2 = -55.0, r3 =   5.0, r4 =   6.0,
	&end

# 29 ALA PHI:  (28 GLU C)-(29 ALA N)-(29 ALA CA)-(29 ALA C) -119.1 -59.1
 &rst     iat =   406,   408,   410,   416,
	  r1 = -120.1, r2 = -119.1, r3 = -59.1, r4 = -58.1,
	&end

# 29 ALA PSI:  (29 ALA N)-(29 ALA CA)-(29 ALA C)-(30 GLY N) -26.8  33.2
 &rst     iat =   408,   410,   416,   418,
	  r1 = -27.8, r2 = -26.8, r3 =  33.2, r4 =  34.2,
	&end

# 32 THR PHI:  (31 PHE C)-(32 THR N)-(32 THR CA)-(32 THR C) -141.2 -50.2
 &rst     iat =   443,   445,   447,   457,
	  r1 = -142.2, r2 = -141.2, r3 = -50.2, r4 = -49.2,
	&end

# 32 THR PSI:  (32 THR N)-(32 THR CA)-(32 THR C)-(33 THR N) 121.5 181.5
 &rst     iat =   445,   447,   457,   459,
	  r1 = 120.5, r2 = 121.5, r3 = 181.5, r4 = 182.5,
	&end

# 33 THR PHI:  (32 THR C)-(33 THR N)-(33 THR CA)-(33 THR C) -151.6 -91.6
 &rst     iat =   457,   459,   461,   471,
	  r1 = -152.6, r2 = -151.6, r3 = -91.6, r4 = -90.6,
	&end

# 33 THR PSI:  (33 THR N)-(33 THR CA)-(33 THR C)-(34 GLU N) 117.2 177.2
 &rst     iat =   459,   461,   471,   473,
	  r1 = 116.2, r2 = 117.2, r3 = 177.2, r4 = 178.2,
	&end

# 34 GLU PHI:  (33 THR C)-(34 GLU N)-(34 GLU CA)-(34 GLU C) -162.9 -102.9
 &rst     iat =   471,   473,   475,   486,
	  r1 = -163.9, r2 = -162.9, r3 = -102.9, r4 = -101.9,
	&end

# 34 GLU PSI:  (34 GLU N)-(34 GLU CA)-(34 GLU C)-(35 THR N)  90.9 163.9
 &rst     iat =   473,   475,   486,   488,
	  r1 =  89.9, r2 =  90.9, r3 = 163.9, r4 = 164.9,
	&end

# 49 ILE PHI:  (48 GLY C)-(49 ILE N)-(49 ILE CA)-(49 ILE C) -134.4 -74.4
 &rst     iat =   683,   685,   687,   702,
	  r1 = -135.4, r2 = -134.4, r3 = -74.4, r4 = -73.4,
	&end

# 49 ILE PSI:  (49 ILE N)-(49 ILE CA)-(49 ILE C)-(50 TRP N)  99.8 159.8
 &rst     iat =   685,   687,   702,   704,
	  r1 =  98.8, r2 =  99.8, r3 = 159.8, r4 = 160.8,
	&end

# 50 TRP PHI:  (49 ILE C)-(50 TRP N)-(50 TRP CA)-(50 TRP C) -148.1 -88.1
 &rst     iat =   702,   704,   706,   726,
	  r1 = -149.1, r2 = -148.1, r3 = -88.1, r4 = -87.1,
	&end

# 50 TRP PSI:  (50 TRP N)-(50 TRP CA)-(50 TRP C)-(51 LEU N) 111.7 171.7
 &rst     iat =   704,   706,   726,   728,
	  r1 = 110.7, r2 = 111.7, r3 = 171.7, r4 = 172.7,
	&end

# 51 LEU PHI:  (50 TRP C)-(51 LEU N)-(51 LEU CA)-(51 LEU C) -143.9 -83.9
 &rst     iat =   726,   728,   730,   745,
	  r1 = -144.9, r2 = -143.9, r3 = -83.9, r4 = -82.9,
	&end

# 51 LEU PSI:  (51 LEU N)-(51 LEU CA)-(51 LEU C)-(52 VAL N)  95.9 155.9
 &rst     iat =   728,   730,   745,   747,
	  r1 =  94.9, r2 =  95.9, r3 = 155.9, r4 = 156.9,
	&end

# 52 VAL PHI:  (51 LEU C)-(52 VAL N)-(52 VAL CA)-(52 VAL C) -141.9 -82.0
 &rst     iat =   745,   747,   749,   761,
	  r1 = -142.9, r2 = -141.9, r3 = -82.0, r4 = -81.0,
	&end

# 52 VAL PSI:  (52 VAL N)-(52 VAL CA)-(52 VAL C)-(53 ILE N)  98.4 158.4
 &rst     iat =   747,   749,   761,   763,
	  r1 =  97.4, r2 =  98.4, r3 = 158.4, r4 = 159.4,
	&end

# 69 PHE PHI:  (68 PRO C)-(69 PHE N)-(69 PHE CA)-(69 PHE C) -96.6 -36.6
 &rst     iat =   972,   974,   976,   992,
	  r1 = -97.6, r2 = -96.6, r3 = -36.6, r4 = -35.6,
	&end

# 69 PHE PSI:  (69 PHE N)-(69 PHE CA)-(69 PHE C)-(70 TYR N) -71.2 -11.2
 &rst     iat =   974,   976,   992,   994,
	  r1 = -72.2, r2 = -71.2, r3 = -11.2, r4 = -10.2,
	&end

# 70 TYR PHI:  (69 PHE C)-(70 TYR N)-(70 TYR CA)-(70 TYR C) -94.7 -34.7
 &rst     iat =   992,   994,   996,  1013,
	  r1 = -95.7, r2 = -94.7, r3 = -34.7, r4 = -33.7,
	&end

# 70 TYR PSI:  (70 TYR N)-(70 TYR CA)-(70 TYR C)-(71 GLU N) -70.3 -10.4
 &rst     iat =   994,   996,  1013,  1015,
	  r1 = -71.3, r2 = -70.3, r3 = -10.4, r4 =  -9.4,
	&end

# 71 GLU PHI:  (70 TYR C)-(71 GLU N)-(71 GLU CA)-(71 GLU C) -90.1 -30.1
 &rst     iat =  1013,  1015,  1017,  1028,
	  r1 = -91.1, r2 = -90.1, r3 = -30.1, r4 = -29.1,
	&end

# 71 GLU PSI:  (71 GLU N)-(71 GLU CA)-(71 GLU C)-(72 ALA N) -70.8 -10.8
 &rst     iat =  1015,  1017,  1028,  1030,
	  r1 = -71.8, r2 = -70.8, r3 = -10.8, r4 =  -9.8,
	&end

# 72 ALA PHI:  (71 GLU C)-(72 ALA N)-(72 ALA CA)-(72 ALA C) -92.2 -32.2
 &rst     iat =  1028,  1030,  1032,  1038,
	  r1 = -93.2, r2 = -92.2, r3 = -32.2, r4 = -31.2,
	&end

# 72 ALA PSI:  (72 ALA N)-(72 ALA CA)-(72 ALA C)-(73 LEU N) -70.3 -10.3
 &rst     iat =  1030,  1032,  1038,  1040,
	  r1 = -71.3, r2 = -70.3, r3 = -10.3, r4 =  -9.3,
	&end

# 73 LEU PHI:  (72 ALA C)-(73 LEU N)-(73 LEU CA)-(73 LEU C) -97.8 -37.8
 &rst     iat =  1038,  1040,  1042,  1057,
	  r1 = -98.8, r2 = -97.8, r3 = -37.8, r4 = -36.8,
	&end

# 73 LEU PSI:  (73 LEU N)-(73 LEU CA)-(73 LEU C)-(74 GLN N) -68.0  -8.0
 &rst     iat =  1040,  1042,  1057,  1059,
	  r1 = -69.0, r2 = -68.0, r3 =  -8.0, r4 =  -7.0,
	&end

# 74 GLN PHI:  (73 LEU C)-(74 GLN N)-(74 GLN CA)-(74 GLN C) -92.9 -32.9
 &rst     iat =  1057,  1059,  1061,  1074,
	  r1 = -93.9, r2 = -92.9, r3 = -32.9, r4 = -31.9,
	&end

# 74 GLN PSI:  (74 GLN N)-(74 GLN CA)-(74 GLN C)-(75 GLU N) -68.9  -8.9
 &rst     iat =  1059,  1061,  1074,  1076,
	  r1 = -69.9, r2 = -68.9, r3 =  -8.9, r4 =  -7.9,
	&end

# 83 VAL PHI:  (82 ALA C)-(83 VAL N)-(83 VAL CA)-(83 VAL C) -140.6 -64.6
 &rst     iat =  1194,  1196,  1198,  1210,
	  r1 = -141.6, r2 = -140.6, r3 = -64.6, r4 = -63.6,
	&end

# 83 VAL PSI:  (83 VAL N)-(83 VAL CA)-(83 VAL C)-(84 ARG N)  96.4 156.4
 &rst     iat =  1196,  1198,  1210,  1212,
	  r1 =  95.4, r2 =  96.4, r3 = 156.4, r4 = 157.4,
	&end

# 84 ARG PHI:  (83 VAL C)-(84 ARG N)-(84 ARG CA)-(84 ARG C) -140.8 -80.8
 &rst     iat =  1210,  1212,  1214,  1234,
	  r1 = -141.8, r2 = -140.8, r3 = -80.8, r4 = -79.8,
	&end

# 84 ARG PSI:  (84 ARG N)-(84 ARG CA)-(84 ARG C)-(85 PHE N) 110.7 170.7
 &rst     iat =  1212,  1214,  1234,  1236,
	  r1 = 109.7, r2 = 110.7, r3 = 170.7, r4 = 171.7,
	&end

# 85 PHE PHI:  (84 ARG C)-(85 PHE N)-(85 PHE CA)-(85 PHE C) -154.6 -94.6
 &rst     iat =  1234,  1236,  1238,  1254,
	  r1 = -155.6, r2 = -154.6, r3 = -94.6, r4 = -93.6,
	&end

# 85 PHE PSI:  (85 PHE N)-(85 PHE CA)-(85 PHE C)-(86 GLY N) 119.3 179.3
 &rst     iat =  1236,  1238,  1254,  1256,
	  r1 = 118.3, r2 = 119.3, r3 = 179.3, r4 = 180.3,
	&end

# 87 ALA PHI:  (86 GLY C)-(87 ALA N)-(87 ALA CA)-(87 ALA C) -149.9 -72.9
 &rst     iat =  1261,  1263,  1265,  1271,
	  r1 = -150.9, r2 = -149.9, r3 = -72.9, r4 = -71.9,
	&end

# 87 ALA PSI:  (87 ALA N)-(87 ALA CA)-(87 ALA C)-(88 ILE N)  99.9 159.9
 &rst     iat =  1263,  1265,  1271,  1273,
	  r1 =  98.9, r2 =  99.9, r3 = 159.9, r4 = 160.9,
	&end

# 104 LYS PHI:  (103 ASP C)-(104 LYS N)-(104 LYS CA)-(104 LYS C) -96.7 -36.7
 &rst     iat =  1499,  1501,  1503,  1521,
	  r1 = -97.7, r2 = -96.7, r3 = -36.7, r4 = -35.7,
	&end

# 104 LYS PSI:  (104 LYS N)-(104 LYS CA)-(104 LYS C)-(105 LEU N) -68.4  -8.4
 &rst     iat =  1501,  1503,  1521,  1523,
	  r1 = -69.4, r2 = -68.4, r3 =  -8.4, r4 =  -7.4,
	&end

# 105 LEU PHI:  (104 LYS C)-(105 LEU N)-(105 LEU CA)-(105 LEU C) -95.5 -35.5
 &rst     iat =  1521,  1523,  1525,  1540,
	  r1 = -96.5, r2 = -95.5, r3 = -35.5, r4 = -34.5,
	&end

# 105 LEU PSI:  (105 LEU N)-(105 LEU CA)-(105 LEU C)-(106 GLU N) -67.4  -7.4
 &rst     iat =  1523,  1525,  1540,  1542,
	  r1 = -68.4, r2 = -67.4, r3 =  -7.4, r4 =  -6.4,
	&end

# 106 GLU PHI:  (105 LEU C)-(106 GLU N)-(106 GLU CA)-(106 GLU C) -93.8 -33.8
 &rst     iat =  1540,  1542,  1544,  1555,
	  r1 = -94.8, r2 = -93.8, r3 = -33.8, r4 = -32.8,
	&end

# 106 GLU PSI:  (106 GLU N)-(106 GLU CA)-(106 GLU C)-(107 ALA N) -73.0 -13.0
 &rst     iat =  1542,  1544,  1555,  1557,
	  r1 = -74.0, r2 = -73.0, r3 = -13.0, r4 = -12.0,
	&end

# 107 ALA PHI:  (106 GLU C)-(107 ALA N)-(107 ALA CA)-(107 ALA C) -92.6 -32.6
 &rst     iat =  1555,  1557,  1559,  1565,
	  r1 = -93.6, r2 = -92.6, r3 = -32.6, r4 = -31.6,
	&end

# 107 ALA PSI:  (107 ALA N)-(107 ALA CA)-(107 ALA C)-(108 GLU N) -66.8  -6.8
 &rst     iat =  1557,  1559,  1565,  1567,
	  r1 = -67.8, r2 = -66.8, r3 =  -6.8, r4 =  -5.8,
	&end

# 108 GLU PHI:  (107 ALA C)-(108 GLU N)-(108 GLU CA)-(108 GLU C) -98.4 -38.4
 &rst     iat =  1565,  1567,  1569,  1580,
	  r1 = -99.4, r2 = -98.4, r3 = -38.4, r4 = -37.4,
	&end

# 108 GLU PSI:  (108 GLU N)-(108 GLU CA)-(108 GLU C)-(109 LEU N) -71.3 -11.3
 &rst     iat =  1567,  1569,  1580,  1582,
	  r1 = -72.3, r2 = -71.3, r3 = -11.3, r4 = -10.3,
	&end

# 109 LEU PHI:  (108 GLU C)-(109 LEU N)-(109 LEU CA)-(109 LEU C) -97.6 -37.6
 &rst     iat =  1580,  1582,  1584,  1599,
	  r1 = -98.6, r2 = -97.6, r3 = -37.6, r4 = -36.6,
	&end

# 109 LEU PSI:  (109 LEU N)-(109 LEU CA)-(109 LEU C)-(110 LYS N) -68.7  -8.7
 &rst     iat =  1582,  1584,  1599,  1601,
	  r1 = -69.7, r2 = -68.7, r3 =  -8.7, r4 =  -7.7,
	&end

# 110 LYS PHI:  (109 LEU C)-(110 LYS N)-(110 LYS CA)-(110 LYS C) -94.8 -34.8
 &rst     iat =  1599,  1601,  1603,  1621,
	  r1 = -95.8, r2 = -94.8, r3 = -34.8, r4 = -33.8,
	&end

# 110 LYS PSI:  (110 LYS N)-(110 LYS CA)-(110 LYS C)-(111 ASN N) -64.5  -4.5
 &rst     iat =  1601,  1603,  1621,  1623,
	  r1 = -65.5, r2 = -64.5, r3 =  -4.5, r4 =  -3.5,
	&end

# 111 ASN PHI:  (110 LYS C)-(111 ASN N)-(111 ASN CA)-(111 ASN C) -98.2 -38.2
 &rst     iat =  1621,  1623,  1625,  1635,
	  r1 = -99.2, r2 = -98.2, r3 = -38.2, r4 = -37.2,
	&end

# 111 ASN PSI:  (111 ASN N)-(111 ASN CA)-(111 ASN C)-(112 SER N) -57.7   2.3
 &rst     iat =  1623,  1625,  1635,  1637,
	  r1 = -58.7, r2 = -57.7, r3 =   2.3, r4 =   3.3,
	&end

# 112 SER PHI:  (111 ASN C)-(112 SER N)-(112 SER CA)-(112 SER C) -124.2 -64.2
 &rst     iat =  1635,  1637,  1639,  1646,
	  r1 = -125.2, r2 = -124.2, r3 = -64.2, r4 = -63.2,
	&end

# 112 SER PSI:  (112 SER N)-(112 SER CA)-(112 SER C)-(113 GLY N) -49.3  30.7
 &rst     iat =  1637,  1639,  1646,  1648,
	  r1 = -50.3, r2 = -49.3, r3 =  30.7, r4 =  31.7,
	&end

# 117 THR PHI:  (116 GLN C)-(117 THR N)-(117 THR CA)-(117 THR C) -126.3 -66.3
 &rst     iat =  1702,  1704,  1706,  1716,
	  r1 = -127.3, r2 = -126.3, r3 = -66.3, r4 = -65.3,
	&end

# 117 THR PSI:  (117 THR N)-(117 THR CA)-(117 THR C)-(118 GLY N)  99.5 159.5
 &rst     iat =  1704,  1706,  1716,  1718,
	  r1 =  98.5, r2 =  99.5, r3 = 159.5, r4 = 160.5,
	&end

# 136 GLU PHI:  (135 ALA C)-(136 GLU N)-(136 GLU CA)-(136 GLU C) -95.8 -35.8
 &rst     iat =  1989,  1991,  1993,  2004,
	  r1 = -96.8, r2 = -95.8, r3 = -35.8, r4 = -34.8,
	&end

# 136 GLU PSI:  (136 GLU N)-(136 GLU CA)-(136 GLU C)-(137 GLU N) -76.9 -16.9
 &rst     iat =  1991,  1993,  2004,  2006,
	  r1 = -77.9, r2 = -76.9, r3 = -16.9, r4 = -15.9,
	&end

# 137 GLU PHI:  (136 GLU C)-(137 GLU N)-(137 GLU CA)-(137 GLU C) -96.4 -36.4
 &rst     iat =  2004,  2006,  2008,  2019,
	  r1 = -97.4, r2 = -96.4, r3 = -36.4, r4 = -35.4,
	&end

# 137 GLU PSI:  (137 GLU N)-(137 GLU CA)-(137 GLU C)-(138 TRP N) -71.7 -11.7
 &rst     iat =  2006,  2008,  2019,  2021,
	  r1 = -72.7, r2 = -71.7, r3 = -11.7, r4 = -10.7,
	&end

# 138 TRP PHI:  (137 GLU C)-(138 TRP N)-(138 TRP CA)-(138 TRP C) -94.6 -34.6
 &rst     iat =  2019,  2021,  2023,  2043,
	  r1 = -95.6, r2 = -94.6, r3 = -34.6, r4 = -33.6,
	&end

# 138 TRP PSI:  (138 TRP N)-(138 TRP CA)-(138 TRP C)-(139 LEU N) -69.1  -9.1
 &rst     iat =  2021,  2023,  2043,  2045,
	  r1 = -70.1, r2 = -69.1, r3 =  -9.1, r4 =  -8.1,
	&end

# 139 LEU PHI:  (138 TRP C)-(139 LEU N)-(139 LEU CA)-(139 LEU C) -96.1 -36.1
 &rst     iat =  2043,  2045,  2047,  2062,
	  r1 = -97.1, r2 = -96.1, r3 = -36.1, r4 = -35.1,
	&end

# 139 LEU PSI:  (139 LEU N)-(139 LEU CA)-(139 LEU C)-(140 GLY N) -67.5  -7.5
 &rst     iat =  2045,  2047,  2062,  2064,
	  r1 = -68.5, r2 = -67.5, r3 =  -7.5, r4 =  -6.5,
	&end

# 140 GLY PHI:  (139 LEU C)-(140 GLY N)-(140 GLY CA)-(140 GLY C) -93.6 -33.6
 &rst     iat =  2062,  2064,  2066,  2069,
	  r1 = -94.6, r2 = -93.6, r3 = -33.6, r4 = -32.6,
	&end

# 140 GLY PSI:  (140 GLY N)-(140 GLY CA)-(140 GLY C)-(141 SER N) -70.0 -10.0
 &rst     iat =  2064,  2066,  2069,  2071,
	  r1 = -71.0, r2 = -70.0, r3 = -10.0, r4 =  -9.0,
	&end

# 141 SER PHI:  (140 GLY C)-(141 SER N)-(141 SER CA)-(141 SER C) -96.3 -36.3
 &rst     iat =  2069,  2071,  2073,  2080,
	  r1 = -97.3, r2 = -96.3, r3 = -36.3, r4 = -35.3,
	&end

# 141 SER PSI:  (141 SER N)-(141 SER CA)-(141 SER C)-(142 TRP N) -69.3  -9.4
 &rst     iat =  2071,  2073,  2080,  2082,
	  r1 = -70.3, r2 = -69.3, r3 =  -9.4, r4 =  -8.4,
	&end

# 142 TRP PHI:  (141 SER C)-(142 TRP N)-(142 TRP CA)-(142 TRP C) -95.7 -35.7
 &rst     iat =  2080,  2082,  2084,  2104,
	  r1 = -96.7, r2 = -95.7, r3 = -35.7, r4 = -34.7,
	&end

# 142 TRP PSI:  (142 TRP N)-(142 TRP CA)-(142 TRP C)-(143 VAL N) -70.8 -10.8
 &rst     iat =  2082,  2084,  2104,  2106,
	  r1 = -71.8, r2 = -70.8, r3 = -10.8, r4 =  -9.8,
	&end

# 143 VAL PHI:  (142 TRP C)-(143 VAL N)-(143 VAL CA)-(143 VAL C) -98.1 -38.1
 &rst     iat =  2104,  2106,  2108,  2120,
	  r1 = -99.1, r2 = -98.1, r3 = -38.1, r4 = -37.1,
	&end

# 143 VAL PSI:  (143 VAL N)-(143 VAL CA)-(143 VAL C)-(144 ASN N) -63.1  -3.1
 &rst     iat =  2106,  2108,  2120,  2122,
	  r1 = -64.1, r2 = -63.1, r3 =  -3.1, r4 =  -2.1,
	&end

# 145 LEU PHI:  (144 ASN C)-(145 LEU N)-(145 LEU CA)-(145 LEU C) -97.2 -37.2
 &rst     iat =  2134,  2136,  2138,  2153,
	  r1 = -98.2, r2 = -97.2, r3 = -37.2, r4 = -36.2,
	&end

# 145 LEU PSI:  (145 LEU N)-(145 LEU CA)-(145 LEU C)-(146 LEU N) -53.9   6.1
 &rst     iat =  2136,  2138,  2153,  2155,
	  r1 = -54.9, r2 = -53.9, r3 =   6.1, r4 =   7.1,
	&end

#
#    0 AMB  20-2:13      68 PRO  HA          2.80    (#     13:20  Single Ambig)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1, 971, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1= 968, 969,1020,1021,
 &end
#
#    0 AMB  20-2:14       0 AMB  20-1:14     4.80    (#     14:20  Double Ambig)
 &rst
  ixpk= 14, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.72, r4= 9.22,
 igr1= 940, 941, 942, 944, 945, 946,1306,1307,1308,
 igr2= 787, 788, 787, 788,
 &end
#
#    0 AMB  20-2:16      54 SER  HB-         4.80    (#     16:20  Single Ambig)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
 igr1= 940, 941, 942, 944, 945, 946,1306,1307,1308,
 igr2= 787, 788,
 &end
#
#    0 AMB  20-2:56      52 VAL  HA          4.00    (#     56:20  Single Ambig)
 &rst
  ixpk= 56, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 754, 755, 756, 758, 759, 760, 105, 106,
 &end
#
#    0 AMB  20-2:60       0 AMB  20-1:60     3.00    (#     60:20  Double Ambig)
 &rst
  ixpk= 60, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 962, 963, 962, 963,
 igr2= 954, 955, 954, 955,
 &end
#
#    0 AMB  20-2:61       0 AMB  20-1:61     3.00    (#     61:20  Double Ambig)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 962, 963, 962, 963,
 igr2= 954, 955, 954, 955,
 &end
#
#    0 AMB  20-2:62      81 SER  HA          3.20    (#     62:20  Single Ambig)
 &rst
  ixpk= 62, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1180,1181,1180,1181,
 &end
#
#    0 AMB  20-2:72     141 SER  HA          4.50    (#     72:20  Single Ambig)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:73     141 SER  HA          3.20    (#     73:20  Single Ambig)
 &rst
  ixpk= 73, nxpk= 20, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=2076,2077,2076,2077,
 &end
#
#    0 AMB  20-2:81     110 LYS  HA          3.20    (#     81:20  Single Ambig)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,1604, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:87       0 AMB  20-1:87     3.20    (#     87:20  Double Ambig)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 269, 270, 330, 331,
 igr2= 264, 325,
 &end
#
#   23 ALA  MB            0 AMB  20-1:88     4.00    (#     88:20  Single Ambig)
 &rst
  ixpk= 88, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 317, 318, 319,
 igr2= 264, 325,
 &end
#
#    0 AMB  20-2:100      0 AMB  20-1:100    3.50    (#    100:20  Double Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1447,1448, 386, 387, 386, 387,
 igr2=1445, 325,
 &end
#
#    0 AMB  20-2:106      0 AMB  20-1:106    3.20    (#    106:20  Double Ambig)
 &rst
  ixpk= 106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1020,1021,1572,1573,
 igr2=1018,1062,
 &end
#
#    0 AMB  20-2:109    105 LEU  HA          3.20    (#    109:20  Single Ambig)
 &rst
  ixpk= 109, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1528,1529,1572,1573,
 &end
#
#    0 AMB  20-2:110    105 LEU  HA          4.00    (#    110:20  Single Ambig)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1531,1045,1046,
 &end
#
#    0 AMB  20-2:113      0 AMB  20-1:113    3.00    (#    113:20  Double Ambig)
 &rst
  ixpk= 113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1064,1065,1067,1068,1064,1065,
 igr2=1062,1018,
 &end
#
#    0 AMB  20-2:131      0 AMB  20-1:131    4.00    (#    131:20  Double Ambig)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 413, 414, 415,1067,1068,
 igr2= 362,1079,
 &end
#
#    0 AMB  20-2:142      0 AMB  20-1:142    3.20    (#    142:20  Double Ambig)
 &rst
  ixpk= 142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=2050,2051, 342, 343,
 igr2=2048, 296,
 &end
#
#    0 AMB  20-2:145      0 AMB  20-1:145    4.20    (#    145:20  Double Ambig)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
      1769,1770,
 igr2=2048, 296,
 &end
#
#    0 AMB  20-2:147     22 LEU  HA          3.20    (#    147:20  Single Ambig)
 &rst
  ixpk= 147, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1= 298, 299, 342, 343,
 &end
#
#    0 AMB  20-2:150      0 AMB  20-1:150    2.80    (#    150:20  Double Ambig)
 &rst
  ixpk= 150, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 909, 910,1494,1495,
 igr2= 907,1492,
 &end
#
#    0 AMB  20-2:152      0 AMB  20-1:152    4.00    (#    152:20  Double Ambig)
 &rst
  ixpk= 152, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 398, 399, 330, 331,1344,1345,
 igr2= 340,1363,
 &end
#
#    0 AMB  20-2:157      0 AMB  20-1:157    3.00    (#    157:20  Double Ambig)
 &rst
  ixpk= 157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1096,1097, 342, 343,
 igr2=1094, 340,
 &end
#
#    0 AMB  20-2:160     47 SER  HA          2.80    (#    160:20  Single Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 672, 673, 672, 673,
 &end
#
#    0 AMB  20-2:174    111 ASN  HA          3.00    (#    174:20  Single Ambig)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=1628,1629,1628,1629,
 &end
#
#    0 AMB  20-2:194     72 ALA  HA          3.00    (#    194:20  Single Ambig)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=1081,1082,1081,1082,
 &end
#
#    0 AMB  20-2:209     40 LEU  HA          3.20    (#    209:20  Single Ambig)
 &rst
  ixpk= 209, nxpk= 20, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 567, 583, 584,
 &end
#
#    0 AMB  20-2:223      0 AMB  20-1:223    3.00    (#    223:20  Double Ambig)
 &rst
  ixpk= 223, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 629, 630,2113,2114,2115,2117,2118,2119,2113,2114,
      2115,2117,2118,2119,
 igr2= 627, 411,
 &end
#
#    0 AMB  20-2:237      0 AMB  20-1:237    2.80    (#    237:20  Double Ambig)
 &rst
  ixpk= 237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 954, 955,1111,
 igr2= 962, 963,1132,1133,
 &end
#
#    0 AMB  20-2:245      0 AMB  20-1:245    3.00    (#    245:20  Double Ambig)
 &rst
  ixpk= 245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 648, 649, 968, 969,
 igr2= 645, 646, 962, 963,
 &end
#
#    0 AMB  20-2:248      0 AMB  20-1:248    3.00    (#    248:20  Double Ambig)
 &rst
  ixpk= 248, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 648, 649, 968, 969,
 igr2= 645, 646, 962, 963,
 &end
#
#    0 AMB  20-2:287      0 AMB  20-1:287    4.00    (#    287:20  Double Ambig)
 &rst
  ixpk= 287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1=  85,  86,  87,  89,  90,  91,  49,  50,  51,
 igr2= 733, 734, 733, 734,
 &end
#
#    0 AMB  20-2:296     51 LEU  HB-         4.00    (#    296:20  Single Ambig)
 &rst
  ixpk= 296, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1=  85,  86,  87,  89,  90,  91,  49,  50,  51,
 igr2= 733, 734,
 &end
#
#    0 AMB  20-2:304      0 AMB  20-1:304    3.50    (#    304:20  Double Ambig)
 &rst
  ixpk= 304, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1609,1610,1692,1693,
 igr2=1615,1616,1615,1616,
 &end
#
#    0 AMB  20-2:305      0 AMB  20-1:305    3.20    (#    305:20  Double Ambig)
 &rst
  ixpk= 305, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1612,1613,1612,1613,
 igr2=1615,1616,1615,1616,
 &end
#
#    0 AMB  20-2:306    110 LYS  HE-         3.20    (#    306:20  Single Ambig)
 &rst
  ixpk= 306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1612,1613,1612,1613,
 igr2=1615,1616,
 &end
#
#    0 AMB  20-2:307    139 LEU  HB-         3.20    (#    307:20  Single Ambig)
 &rst
  ixpk= 307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=2048,1994,
 igr2=2050,2051,
 &end
#
#    0 AMB  20-2:308      0 AMB  20-1:308    3.20    (#    308:20  Double Ambig)
 &rst
  ixpk= 308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=2048,1994,
 igr2=2050,2051,2050,2051,
 &end
#
#    0 AMB  20-2:316      0 AMB  20-1:316    3.80    (#    316:20  Double Ambig)
 &rst
  ixpk= 316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
 igr1=2055,2056,2057,2059,2060,2061,1533,1534,1535,1537,
      1538,1539,
 igr2=2050,2051,1528,1529,
 &end
#
#    0 AMB  20-2:320      0 AMB  20-1:320    3.50    (#    320:20  Double Ambig)
 &rst
  ixpk= 320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1526,2048,1994,
 igr2=1528,1529,2050,2051,
 &end
#
#    0 AMB  20-2:322      0 AMB  20-1:322    3.20    (#    322:20  Double Ambig)
 &rst
  ixpk= 322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1676,1677,1119,1120,1217,1218,
 igr2=1679,1680,1122,1123,1679,1680,
 &end
#
#    0 AMB  20-2:324      0 AMB  20-1:324    4.00    (#    324:20  Double Ambig)
 &rst
  ixpk= 324, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=2182,2183, 345, 346,
 igr2=2188,2189, 351, 352,
 &end
#
#    0 AMB  20-2:338     73 LEU  HB-         3.50    (#    338:20  Single Ambig)
 &rst
  ixpk= 338, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1572,1573,1067,1068,
 igr2=1045,1046,
 &end
#
#    0 AMB  20-2:341      0 AMB  20-1:341    4.00    (#    341:20  Double Ambig)
 &rst
  ixpk= 341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 igr2=  80,  81,  80,  81,
 &end
#
#    0 AMB  20-2:342      0 AMB  20-1:342    3.50    (#    342:20  Double Ambig)
 &rst
  ixpk= 342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1572,1573,1067,1068,
 igr2=1045,1046,1045,1046,
 &end
#
#    0 AMB  20-2:347      6 LEU  HB-         4.00    (#    347:20  Single Ambig)
 &rst
  ixpk= 347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 igr2=  80,  81,
 &end
#
#    0 AMB  20-2:357      0 AMB  20-1:357    3.20    (#    357:20  Double Ambig)
 &rst
  ixpk= 357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 586, 564, 565,
 igr2= 583, 584, 583, 584,
 &end
#
#    0 AMB  20-2:358      0 AMB  20-1:358    3.80    (#    358:20  Double Ambig)
 &rst
  ixpk= 358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
 igr1= 588, 589, 590, 592, 593, 594,  68,  69,  70,
 igr2= 583, 584, 629, 630,
 &end
#
#    0 AMB  20-2:359      0 AMB  20-1:359    3.50    (#    359:20  Double Ambig)
 &rst
  ixpk= 359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  66, 581,
 igr2= 629, 630, 583, 584,
 &end
#
#    0 AMB  20-2:366     88 ILE  HB          3.00    (#    366:20  Single Ambig)
 &rst
  ixpk= 366, nxpk= 20, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr1= 774, 775, 770, 771, 772,1284,1285,
 &end
#
#    0 AMB  20-2:370      0 AMB  20-1:370    5.00    (#    370:20  Double Ambig)
 &rst
  ixpk= 370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 478, 479,2053,
 igr2= 617, 618, 351, 352,
 &end
#
#    0 AMB  20-2:380      0 AMB  20-1:380    4.20    (#    380:20  Double Ambig)
 &rst
  ixpk= 380, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1280,1281,1282,1762,
 igr2=1759,1760,1759,1760,
 &end
#
#    0 AMB  20-2:384    109 LEU  HB-         3.50    (#    384:20  Single Ambig)
 &rst
  ixpk= 384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1545,1585,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:386    123 ILE  HB          3.00    (#    386:20  Single Ambig)
 &rst
  ixpk= 386, nxpk= 20, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1=1802,1803,1804, 303, 304, 305, 307, 308, 309,
 &end
#
#    0 AMB  20-2:387    123 ILE  HB          4.00    (#    387:20  Single Ambig)
 &rst
  ixpk= 387, nxpk= 20, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 242, 243, 244, 246, 247, 248,1809,1810,1811,
 &end
#
#    0 AMB  20-2:388     53 ILE  HB          3.20    (#    388:20  Single Ambig)
 &rst
  ixpk= 388, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 777, 778, 779, 770, 771, 772, 774, 775,
 &end
#
#    0 AMB  20-2:390      0 AMB  20-1:390    3.20    (#    390:20  Double Ambig)
 &rst
  ixpk= 390, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1545,1585,
 igr2=1587,1588,1587,1588,
 &end
#
#    0 AMB  20-2:391    109 LEU  HB-         3.20    (#    391:20  Single Ambig)
 &rst
  ixpk= 391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1545,1585,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:393      0 AMB  20-1:393    3.80    (#    393:20  Double Ambig)
 &rst
  ixpk= 393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
 igr1= 303, 304, 305, 307, 308, 309,  85,  86,  87,  89,
        90,  91,1802,1803,1804, 369, 370, 371, 373, 374,
       375, 369, 370, 371, 373, 374, 375,
 igr2= 298, 299,1800,
 &end
#
#    0 AMB  20-2:396      0 AMB  20-1:396    6.00    (#    396:20  Double Ambig)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1=1201,1138,1139,
 igr2=1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:399     22 LEU  HB-         3.50    (#    399:20  Single Ambig)
 &rst
  ixpk= 399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 303, 304, 305, 307, 308, 309,  85,  86,  87,  89,
        90,  91, 369, 370, 371, 373, 374, 375, 369, 370,
       371, 373, 374, 375,
 igr2= 298, 299,
 &end
#
#    0 AMB  20-2:401      0 AMB  20-1:401    3.20    (#    401:20  Double Ambig)
 &rst
  ixpk= 401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 296, 315,
 igr2= 298, 299, 298, 299,
 &end
#
#    0 AMB  20-2:404      0 AMB  20-1:404    4.00    (#    404:20  Double Ambig)
 &rst
  ixpk= 404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 igr2=1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:405      0 AMB  20-1:405    3.50    (#    405:20  Double Ambig)
 &rst
  ixpk= 405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 303, 304, 305, 307, 308, 309,1166,1167,1168,1170,
      1171,1172, 369, 370, 371, 373, 374, 375,
 igr2= 298, 299,1161,1162, 298, 299,
 &end
#
#    0 AMB  20-2:411     49 ILE  HB          3.00    (#    411:20  Single Ambig)
 &rst
  ixpk= 411, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 692, 693, 694,  49,  50,  51,
 &end
#
#    0 AMB  20-2:412     49 ILE  HB          3.00    (#    412:20  Single Ambig)
 &rst
  ixpk= 412, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 696, 697, 699, 700, 701,
 &end
#
#    0 AMB  20-2:441      0 AMB  20-1:441    3.00    (#    441:20  Double Ambig)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 383, 384, 383, 384, 383, 384,
 igr2= 386, 387, 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:442      0 AMB  20-1:442    3.00    (#    442:20  Double Ambig)
 &rst
  ixpk= 442, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 383, 384, 383, 384,
 igr2= 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:444      0 AMB  20-1:444    4.00    (#    444:20  Double Ambig)
 &rst
  ixpk= 444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 340, 396,
 igr2= 401, 402, 401, 402,
 &end
#
#    0 AMB  20-2:448      0 AMB  20-1:448    3.00    (#    448:20  Double Ambig)
 &rst
  ixpk= 448, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2009,1079,
 igr2=2014,2015,1084,1085,
 &end
#
#    0 AMB  20-2:455      0 AMB  20-1:455    5.00    (#    455:20  Double Ambig)
 &rst
  ixpk= 455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1=1304,1035,1036,1037,
 igr2=1550,1551,1084,1085,
 &end
#
#    0 AMB  20-2:472      0 AMB  20-1:472    3.00    (#    472:20  Double Ambig)
 &rst
  ixpk= 472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1096,1097,1135,1136,
 igr2=1099,1100,1099,1100,
 &end
#
#    0 AMB  20-2:477     76 GLN  HG-         3.00    (#    477:20  Single Ambig)
 &rst
  ixpk= 477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1096,1097,1135,1136,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:479     74 GLN  HG-         3.50    (#    479:20  Single Ambig)
 &rst
  ixpk= 479, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1018,1062,
 igr2=1067,1068,
 &end
#
#    0 AMB  20-2:480      0 AMB  20-1:480    3.50    (#    480:20  Double Ambig)
 &rst
  ixpk= 480, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1018,1062,
 igr2=1067,1068,1067,1068,
 &end
#
#    0 AMB  20-2:500    116 GLN  HG-         3.20    (#    500:20  Single Ambig)
 &rst
  ixpk= 500, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1=1690,1259,1260,
 igr2=1695,1696,
 &end
#
#    0 AMB  20-2:503     78 PRO  HB-         6.50    (#    503:20  Single Ambig)
 &rst
  ixpk= 503, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1164, 583, 584,
 igr2=1138,1139,
 &end
#
#    0 AMB  20-2:504      0 AMB  20-1:504    3.00    (#    504:20  Double Ambig)
 &rst
  ixpk= 504, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1509,1510, 662, 663, 664,
 igr2=1506,1507,1138,1139,
 &end
#
#    0 AMB  20-2:510      0 AMB  20-1:510    3.00    (#    510:20  Double Ambig)
 &rst
  ixpk= 510, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1609,1610,1609,1610,
 igr2=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:528    143 VAL  HB          3.00    (#    528:20  Single Ambig)
 &rst
  ixpk= 528, nxpk= 20, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#    0 AMB  20-2:533      0 AMB  20-1:533    3.00    (#    533:20  Double Ambig)
 &rst
  ixpk= 533, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1= 238, 962, 963,
 igr2= 240, 968, 969,
 &end
#
#    0 AMB  20-2:537      6 LEU  HG          3.00    (#    537:20  Single Ambig)
 &rst
  ixpk= 537, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 &end
#
#    0 AMB  20-2:540      0 AMB  20-1:540    3.00    (#    540:20  Double Ambig)
 &rst
  ixpk= 540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1079, 340,
 igr2=1081,1082, 342, 343,
 &end
#
#    0 AMB  20-2:542      0 AMB  20-1:542    3.00    (#    542:20  Double Ambig)
 &rst
  ixpk= 542, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 242, 243, 244, 246, 247, 248, 166, 167, 168, 170,
       171, 172, 369, 370, 371, 373, 374, 375,
 igr2= 240, 968, 969, 342, 343,
 &end
#
#    0 AMB  20-2:560     74 GLN  HB-         3.00    (#    560:20  Single Ambig)
 &rst
  ixpk= 560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=1062,1018,
 igr2=1064,1065,
 &end
#
#    0 AMB  20-2:566      0 AMB  20-1:566    3.00    (#    566:20  Double Ambig)
 &rst
  ixpk= 566, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1062,1018,
 igr2=1064,1065,1064,1065,1572,1573,
 &end
#
#    0 AMB  20-2:567      0 AMB  20-1:567    3.20    (#    567:20  Double Ambig)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1615,1616,1615,1616,
 igr2=1612,1613,1612,1613,
 &end
#
#    0 AMB  20-2:570     28 GLU  HB-         3.20    (#    570:20  Single Ambig)
 &rst
  ixpk= 570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1= 396, 340,
 igr2= 398, 399,
 &end
#
#    0 AMB  20-2:578      0 AMB  20-1:578    3.00    (#    578:20  Double Ambig)
 &rst
  ixpk= 578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1018,1062,
 igr2=1020,1021,1572,1573,
 &end
#
#    0 AMB  20-2:585      0 AMB  20-1:585    3.00    (#    585:20  Double Ambig)
 &rst
  ixpk= 585, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1116,1117, 256, 257, 258,
 igr2=1119,1120, 204, 205,
 &end
#
#    0 AMB  20-2:587      0 AMB  20-1:587    3.00    (#    587:20  Double Ambig)
 &rst
  ixpk= 587, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1679,1680,1122,1123,
 igr2=1676,1677,1119,1120,
 &end
#
#   20 GLU  HA            0 AMB  20-1:590    3.20    (#    590:20  Single Ambig)
 &rst
  ixpk= 590, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:591      0 AMB  20-1:591    3.00    (#    591:20  Double Ambig)
 &rst
  ixpk= 591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1099,1100,1099,1100,
 igr2=1096,1097,1096,1097,
 &end
#
#    0 AMB  20-2:592     76 GLN  HB-         3.00    (#    592:20  Single Ambig)
 &rst
  ixpk= 592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1099,1100,1099,1100,
 igr2=1096,1097,
 &end
#
#    0 AMB  20-2:596      6 LEU  MDX         4.00    (#    596:20  Single Ambig)
 &rst
  ixpk= 596, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1=  80,  81, 367,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:599      6 LEU  MDX         4.00    (#    599:20  Single Ambig)
 &rst
  ixpk= 599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 733, 734, 298, 299,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:603      0 AMB  20-1:603    5.00    (#    603:20  Double Ambig)
 &rst
  ixpk= 603, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1=1132,1133, 962, 963,
 igr2=1096,1097, 965, 966,
 &end
#
#   24 GLU  HA            0 AMB  20-1:604    4.00    (#    604:20  Single Ambig)
 &rst
  ixpk= 604, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 383, 384, 383, 384,
 &end
#
#    0 AMB  20-2:605      0 AMB  20-1:605    3.00    (#    605:20  Double Ambig)
 &rst
  ixpk= 605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 386, 387, 386, 387, 386, 387,
 igr2= 383, 384, 383, 384, 383, 384,
 &end
#
#    0 AMB  20-2:620      0 AMB  20-1:620    3.00    (#    620:20  Double Ambig)
 &rst
  ixpk= 620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1695,1696, 690,
 igr2=1692,1693, 696, 697,
 &end
#
#    0 AMB  20-2:646      0 AMB  20-1:646    4.00    (#    646:20  Double Ambig)
 &rst
  ixpk= 646, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=  53,  54,1533,1534,1535,1537,1538,1539,
 igr2= 696, 697,1531,
 &end
#
#    0 AMB  20-2:658      0 AMB  20-1:658    4.00    (#    658:20  Double Ambig)
 &rst
  ixpk= 658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1132,1133,1642,1643,
 igr2=1135,1136,1135,1136,
 &end
#
#    0 AMB  20-2:659      0 AMB  20-1:659    3.00    (#    659:20  Double Ambig)
 &rst
  ixpk= 659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 364, 365,1138,1139,
 igr2= 367,1135,1136,
 &end
#
#    0 AMB  20-2:664      0 AMB  20-1:664    3.20    (#    664:20  Double Ambig)
 &rst
  ixpk= 664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 351, 352,1223,1224,
 igr2= 348, 349,1220,1221,
 &end
#
#    0 AMB  20-2:674     26 LEU  HG          3.00    (#    674:20  Single Ambig)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 369, 370, 371, 373, 374, 375,  85,  86,  87,  89,
        90,  91,
 &end
#
#    0 AMB  20-2:676      0 AMB  20-1:676    3.00    (#    676:20  Double Ambig)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1606,1607,1528,1529,
 igr2=1609,1610,1531,
 &end
#
#    0 AMB  20-2:685     12 LEU  HG          3.00    (#    685:20  Single Ambig)
 &rst
  ixpk= 685, nxpk= 20, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 166, 167, 168, 170, 171, 172, 166, 167, 168, 170,
       171, 172,
 &end
#
#    0 AMB  20-2:692      0 AMB  20-1:692    3.00    (#    692:20  Double Ambig)
 &rst
  ixpk= 692, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=1921,1922,1923,1914,1915,1916,
 igr2=1918,1919,1918,1919,
 &end
#
#    0 AMB  20-2:704    139 LEU  HG          3.00    (#    704:20  Single Ambig)
 &rst
  ixpk= 704, nxpk= 20, iat=  -1,2053, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
      1769,1770,
 &end
#
#    0 AMB  20-2:711    139 LEU  MDY         5.00    (#    711:20  Single Ambig)
 &rst
  ixpk= 711, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1994,2048,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:720      0 AMB  20-1:720    3.00    (#    720:20  Double Ambig)
 &rst
  ixpk= 720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1506,1507, 629, 630,
 igr2=1509,1510, 632,
 &end
#
#    0 AMB  20-2:721      0 AMB  20-1:721    4.00    (#    721:20  Double Ambig)
 &rst
  ixpk= 721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
 igr1=1528,1529, 367, 342, 343,2050,2051,
 igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
       374, 375,
 &end
#
#    0 AMB  20-2:737      0 AMB  20-1:737    3.10    (#    737:20  Double Ambig)
 &rst
  ixpk= 737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 629, 630,1045,1046,
 igr2= 632,1048,
 &end
#
#    0 AMB  20-2:738      0 AMB  20-1:738    4.00    (#    738:20  Double Ambig)
 &rst
  ixpk= 738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1=1526, 315, 296,
 igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
       374, 375,
 &end
#
#    0 AMB  20-2:739      0 AMB  20-1:739    4.00    (#    739:20  Double Ambig)
 &rst
  ixpk= 739, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1= 364, 365,1550,1551,
 igr2= 369, 370, 371, 373, 374, 375,1533,1534,1535,1537,
      1538,1539,
 &end
#
#    0 AMB  20-2:740     26 LEU  MDY         4.00    (#    740:20  Single Ambig)
 &rst
  ixpk= 740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=2053, 367,2050,2051,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:757     73 LEU  MDY         5.00    (#    757:20  Single Ambig)
 &rst
  ixpk= 757, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.20, r4=10.70,
 igr1=1592,1593,1594,1596,1597,1598, 588, 589, 590, 592,
       593, 594,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:794    109 LEU  MDY         4.00    (#    794:20  Single Ambig)
 &rst
  ixpk= 794, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1585,1545,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:804      0 AMB  20-1:804    3.00    (#    804:20  Double Ambig)
 &rst
  ixpk= 804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1676,1677,1217,1218,
 igr2=1673,1674,1673,1674,
 &end
#
#    0 AMB  20-2:813    146 LEU  MDY         3.00    (#    813:20  Single Ambig)
 &rst
  ixpk= 813, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=2163, 692, 693, 694,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#    0 AMB  20-2:837    105 LEU  MDY         5.50    (#    837:20  Single Ambig)
 &rst
  ixpk= 837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 997,1330,1331,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:885     26 LEU  MDX         4.50    (#    885:20  Single Ambig)
 &rst
  ixpk= 885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2053, 367, 342, 343,2050,2051,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:888      0 AMB  20-1:888    3.00    (#    888:20  Double Ambig)
 &rst
  ixpk= 888, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 240,1730,1731,
 igr2= 242, 243, 244, 246, 247, 248,1747,1748,1749,
 &end
#
#    0 AMB  20-2:899      0 AMB  20-1:899    5.50    (#    899:20  Double Ambig)
 &rst
  ixpk= 899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 367, 965, 966,
 igr2= 466, 467, 468, 149, 150, 151,
 &end
#
#    0 AMB  20-2:930      0 AMB  20-1:930    3.00    (#    930:20  Double Ambig)
 &rst
  ixpk= 930, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 301, 602, 603,
 igr2= 303, 304, 305, 307, 308, 309,  68,  69,  70,
 &end
#
#    0 AMB  20-2:934    121 LEU  MDX         5.00    (#    934:20  Single Ambig)
 &rst
  ixpk= 934, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=1284,1285,1759,1760,
 igr2=1764,1765,1766,1768,1769,1770,
 &end
#
#    0 AMB  20-2:948      0 AMB  20-1:948    4.20    (#    948:20  Double Ambig)
 &rst
  ixpk= 948, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=1135,1136,2053,
 igr2=1166,1167,1168,1170,1171,1172,1764,1765,1766,1768,
      1769,1770,
 &end
#
#    0 AMB  20-2:980     83 VAL  MGX         5.00    (#    980:20  Single Ambig)
 &rst
  ixpk= 980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=1164, 662, 663, 664,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1012     0 AMB  20-1:1012   3.00    (#   1012:20  Double Ambig)
 &rst
  ixpk= 1012, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1=1304,1778,1779,
 igr2=1306,1307,1308,1914,1915,1916,
 &end
#
#    0 AMB  20-2:1017    90 ILE  MG2         4.00    (#   1017:20  Single Ambig)
 &rst
  ixpk= 1017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1=1310,1311,1268,1269,1270,
 igr2=1306,1307,1308,
 &end
#
#    0 AMB  20-2:1039    19 ALA  MB          4.00    (#   1039:20  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 118, 119, 118, 119,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:1063     7 ILE  MG2         4.00    (#   1063:20  Single Ambig)
 &rst
  ixpk= 1063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 105, 106, 754, 755, 756, 758, 759, 760,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:1071    88 ILE  MG2         4.00    (#   1071:20  Single Ambig)
 &rst
  ixpk= 1071, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1=1802,1803,1804,1759,1760,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:1074    88 ILE  MG2         5.00    (#   1074:20  Single Ambig)
 &rst
  ixpk= 1074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1284,1285,1759,1760,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:1077    53 ILE  MD1         3.00    (#   1077:20  Single Ambig)
 &rst
  ixpk= 1077, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 774, 775,  80,  81,
 igr2= 777, 778, 779,
 &end
#
#    0 AMB  20-2:1084     7 ILE  MD1         3.00    (#   1084:20  Single Ambig)
 &rst
  ixpk= 1084, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 105, 106, 754, 755, 756, 758, 759, 760,
 igr2= 108, 109, 110,
 &end
#
#    0 AMB  20-2:1088    88 ILE  MD1         4.50    (#   1088:20  Single Ambig)
 &rst
  ixpk= 1088, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,
 igr2=1287,1288,1289,
 &end
#
#    0 AMB  20-2:1094    49 ILE  MD1         3.00    (#   1094:20  Single Ambig)
 &rst
  ixpk= 1094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 696, 697,1217,1218,
 igr2= 699, 700, 701,
 &end
#
#    0 AMB  20-2:1103    88 ILE  MD1         5.00    (#   1103:20  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
 igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,
 igr2=1287,1288,1289,
 &end
#
#    0 AMB  20-2:1106     4 ILE  MD1         4.00    (#   1106:20  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=  47, 696, 697,
 igr2=  56,  57,  58,
 &end
#
#    0 AMB  20-2:1119   143 VAL  HA          4.00    (#   1119:20  Single Ambig)
 &rst
  ixpk= 1119, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=2102,2156,
 &end
#
#    0 AMB  20-2:1125    68 PRO  HD-         3.00    (#   1125:20  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 954, 955, 954, 955,
 igr2= 962, 963,
 &end
#
#    0 AMB  20-2:1131     0 AMB  20-1:1131   3.20    (#   1131:20  Double Ambig)
 &rst
  ixpk= 1131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1649, 419,
 igr2=1651,1652, 421, 422,
 &end
#
#   41 LEU  HN            0 AMB  20-1:1154   4.50    (#   1154:20  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 564, 565, 583, 584,
 &end
#
#    0 AMB  20-2:1164    40 LEU  HB-         3.50    (#   1164:20  Single Ambig)
 &rst
  ixpk= 1164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 562, 615,
 igr2= 564, 565,
 &end
#
#    0 AMB  20-2:1165     0 AMB  20-1:1165   3.50    (#   1165:20  Double Ambig)
 &rst
  ixpk= 1165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 562, 615,
 igr2= 564, 565, 564, 565,
 &end
#
#    0 AMB  20-2:1167     0 AMB  20-1:1167   2.80    (#   1167:20  Double Ambig)
 &rst
  ixpk= 1167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 766,  78,
 igr2=1278,  80,  81,
 &end
#
#    0 AMB  20-2:1181   103 ASP  HB-         3.00    (#   1181:20  Single Ambig)
 &rst
  ixpk= 1181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=1492,1411,
 igr2=1494,1495,
 &end
#
#    0 AMB  20-2:1183     0 AMB  20-1:1183   3.00    (#   1183:20  Double Ambig)
 &rst
  ixpk= 1183, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1492,1411,
 igr2=1494,1495,1494,1495,
 &end
#
#    0 AMB  20-2:1190     0 AMB  20-1:1190   3.50    (#   1190:20  Double Ambig)
 &rst
  ixpk= 1190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1147, 952,
 igr2=1149,1150, 999,1000,
 &end
#
#  144 ASN  HA            0 AMB  20-1:1203   3.20    (#   1203:20  Single Ambig)
 &rst
  ixpk= 1203, nxpk= 20, iat=2125,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:1206     0 AMB  20-1:1206   3.20    (#   1206:20  Double Ambig)
 &rst
  ixpk= 1206, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1626, 217,
 igr2=1628,1629, 219, 220,
 &end
#
#    0 AMB  20-2:1208     0 AMB  20-1:1208   4.00    (#   1208:20  Double Ambig)
 &rst
  ixpk= 1208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1633,1634, 236,
 igr2=1628,1629, 219, 220,
 &end
#
#    0 AMB  20-2:1210     0 AMB  20-1:1210   4.00    (#   1210:20  Double Ambig)
 &rst
  ixpk= 1210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1633,1634, 236,
 igr2=1628,1629, 219, 220,
 &end
#
#    0 AMB  20-2:1213     0 AMB  20-1:1213   3.20    (#   1213:20  Double Ambig)
 &rst
  ixpk= 1213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1626, 217,
 igr2=1628,1629, 219, 220,
 &end
#
#   27 GLU  HN            0 AMB  20-1:1221   4.00    (#   1221:20  Single Ambig)
 &rst
  ixpk= 1221, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:1233     0 AMB  20-1:1233   3.50    (#   1233:20  Double Ambig)
 &rst
  ixpk= 1233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1016, 598,
 igr2=1023,1024, 605, 606, 605, 606,
 &end
#
#   42 GLU  HN            0 AMB  20-1:1234   4.00    (#   1234:20  Single Ambig)
 &rst
  ixpk= 1234, nxpk= 20, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 605, 606, 605, 606,
 &end
#
#    0 AMB  20-2:1238     0 AMB  20-1:1238   5.00    (#   1238:20  Double Ambig)
 &rst
  ixpk= 1238, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1077, 560,
 igr2=1084,1085, 605, 606,
 &end
#
#    0 AMB  20-2:1249     0 AMB  20-1:1249   3.50    (#   1249:20  Double Ambig)
 &rst
  ixpk= 1249, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1213,1666,
 igr2=1217,1218,1670,1671,
 &end
#
#    0 AMB  20-2:1258     0 AMB  20-1:1258   3.00    (#   1258:20  Double Ambig)
 &rst
  ixpk= 1258, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1937,1504,
 igr2=1934,1935,1506,1507,
 &end
#
#    0 AMB  20-2:1260     0 AMB  20-1:1260   3.00    (#   1260:20  Double Ambig)
 &rst
  ixpk= 1260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1141, 556,
 igr2=1138,1139, 553, 554,
 &end
#
#  110 LYS  HA            0 AMB  20-1:1262   3.20    (#   1262:20  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 20, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2=1606,1607,1606,1607,
 &end
#
#  110 LYS  HN            0 AMB  20-1:1263   3.80    (#   1263:20  Single Ambig)
 &rst
  ixpk= 1263, nxpk= 20, iat=1602,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2=1606,1607,1606,1607,
 &end
#
#  110 LYS  HA            0 AMB  20-1:1264   3.50    (#   1264:20  Single Ambig)
 &rst
  ixpk= 1264, nxpk= 20, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:1268     0 AMB  20-1:1268   3.00    (#   1268:20  Double Ambig)
 &rst
  ixpk= 1268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1728,1668,
 igr2=1730,1731,1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:1271     0 AMB  20-1:1271   2.80    (#   1271:20  Double Ambig)
 &rst
  ixpk= 1271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 679,1524,
 igr2=1201,1506,1507,
 &end
#
#    0 AMB  20-2:1295     0 AMB  20-1:1295   5.00    (#   1295:20  Double Ambig)
 &rst
  ixpk= 1295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1700,1701,1060,
 igr2=1341,1342,1064,1065,
 &end
#
#    0 AMB  20-2:1318     0 AMB  20-1:1318   3.20    (#   1318:20  Double Ambig)
 &rst
  ixpk= 1318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 600,1094,
 igr2= 602, 603,1096,1097,
 &end
#
#   28 GLU  HN            0 AMB  20-1:1326   4.00    (#   1326:20  Single Ambig)
 &rst
  ixpk= 1326, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 383, 384, 383, 384,
 &end
#
#   27 GLU  HA            0 AMB  20-1:1329   3.50    (#   1329:20  Single Ambig)
 &rst
  ixpk= 1329, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 383, 384, 383, 384,
 &end
#
#    0 AMB  20-2:1340    73 LEU  MDY         6.50    (#   1340:20  Single Ambig)
 &rst
  ixpk= 1340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1=1104,1105,1003,1012,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:1342    40 LEU  MDX         4.50    (#   1342:20  Single Ambig)
 &rst
  ixpk= 1342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 562, 615,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    0 AMB  20-2:1366    44 LEU  MDX         4.00    (#   1366:20  Single Ambig)
 &rst
  ixpk= 1366, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 627,  33,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#    0 AMB  20-2:1386    32 THR  MG2         5.50    (#   1386:20  Single Ambig)
 &rst
  ixpk= 1386, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 428, 381,
 igr2= 452, 453, 454,
 &end
#
#    0 AMB  20-2:1404     0 AMB  20-1:1404   5.00    (#   1404:20  Double Ambig)
 &rst
  ixpk= 1404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=2137,1656,
 igr2=2146,2147,2148,2150,2151,2152,1166,1167,1168,1170,
      1171,1172,
 &end
#
#    0 AMB  20-2:1413     0 AMB  20-1:1413   3.00    (#   1413:20  Double Ambig)
 &rst
  ixpk= 1413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1=1413, 809,
 igr2=1415,1416,1417, 811, 812, 813,
 &end
#
#    0 AMB  20-2:1435    72 ALA  MB          3.20    (#   1435:20  Single Ambig)
 &rst
  ixpk= 1435, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1=1033, 977,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  20-2:1451    83 VAL  MGY         4.50    (#   1451:20  Single Ambig)
 &rst
  ixpk= 1451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1197, 679,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1452    83 VAL  MGY         4.00    (#   1452:20  Single Ambig)
 &rst
  ixpk= 1452, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1199, 670,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1468    82 ALA  MB          4.50    (#   1468:20  Single Ambig)
 &rst
  ixpk= 1468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1197, 679,
 igr2=1191,1192,1193,
 &end
#
#    0 AMB  20-2:1506     0 AMB  20-1:1506   3.50    (#   1506:20  Double Ambig)
 &rst
  ixpk= 1506, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 679,1524,
 igr2= 672, 673,1330,1331,
 &end
#
#    0 AMB  20-2:1507     0 AMB  20-1:1507   4.50    (#   1507:20  Double Ambig)
 &rst
  ixpk= 1507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 668,1558,
 igr2= 672, 673,1330,1331,
 &end
#
#    0 AMB  20-2:1508     0 AMB  20-1:1508   4.50    (#   1508:20  Double Ambig)
 &rst
  ixpk= 1508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 679,1197,
 igr2= 672, 673, 672, 673,
 &end
#
#   67 SER  HN            0 AMB  20-1:1526   3.50    (#   1526:20  Single Ambig)
 &rst
  ixpk= 1526, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 954, 955, 954, 955,
 &end
#
#   67 SER  HN            0 AMB  20-1:1527   3.50    (#   1527:20  Single Ambig)
 &rst
  ixpk= 1527, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 954, 955, 954, 955,
 &end
#
#   24 GLU  HN            0 AMB  20-1:1535   3.50    (#   1535:20  Single Ambig)
 &rst
  ixpk= 1535, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 325, 264,
 &end
#
#    0 AMB  20-2:1536   137 GLU  HA          3.50    (#   1536:20  Single Ambig)
 &rst
  ixpk= 1536, nxpk= 20, iat=  -1,2009, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2007,2022,
 &end
#
#   74 GLN  HN            0 AMB  20-1:1541   3.50    (#   1541:20  Single Ambig)
 &rst
  ixpk= 1541, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1062,1018,
 &end
#
#    0 AMB  20-2:1561    23 ALA  HA          3.50    (#   1561:20  Single Ambig)
 &rst
  ixpk= 1561, nxpk= 20, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 313, 360,
 &end
#
#    0 AMB  20-2:1563    19 ALA  HA          3.50    (#   1563:20  Single Ambig)
 &rst
  ixpk= 1563, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 252, 262,
 &end
#
#    0 AMB  20-2:1566   144 ASN  HA          4.00    (#   1566:20  Single Ambig)
 &rst
  ixpk= 1566, nxpk= 20, iat=  -1,2125, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=2175,2156,
 &end
#
#    0 AMB  20-2:1569    72 ALA  HA          3.50    (#   1569:20  Single Ambig)
 &rst
  ixpk= 1569, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1031,1041,
 &end
#
#    0 AMB  20-2:1577   114 ALA  HA          3.00    (#   1577:20  Single Ambig)
 &rst
  ixpk= 1577, nxpk= 20, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr1=1666,1176,
 &end
#
#   83 VAL  HN            0 AMB  20-1:1580   4.00    (#   1580:20  Single Ambig)
 &rst
  ixpk= 1580, nxpk= 20, iat=1197,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1189,1658,
 &end
#
#    0 AMB  20-2:1591     0 AMB  20-1:1591   3.20    (#   1591:20  Double Ambig)
 &rst
  ixpk= 1591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 836, 843,
 igr2= 838, 839, 838, 839,
 &end
#
#    0 AMB  20-2:1593    48 GLY  HA-         3.50    (#   1593:20  Single Ambig)
 &rst
  ixpk= 1593, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 686, 679,
 igr2= 681, 682,
 &end
#
#    0 AMB  20-2:1610    33 THR  HA          5.00    (#   1610:20  Single Ambig)
 &rst
  ixpk= 1610, nxpk= 20, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1=  49,  50,  51,  85,  86,  87,  89,  90,  91,  85,
        86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:1619    84 ARG  HA          3.00    (#   1619:20  Single Ambig)
 &rst
  ixpk= 1619, nxpk= 20, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1217,1218,1220,1221,1220,1221,
 &end
#
#    0 AMB  20-2:1622    87 ALA  HA          3.00    (#   1622:20  Single Ambig)
 &rst
  ixpk= 1622, nxpk= 20, iat=  -1,1266, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1=1268,1269,1270,1310,1311,
 &end
#
#    0 AMB  20-2:1633    84 ARG  HA          3.00    (#   1633:20  Single Ambig)
 &rst
  ixpk= 1633, nxpk= 20, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr1=1666,1213,
 &end
#
#    0 AMB  20-2:1634    84 ARG  HA          3.00    (#   1634:20  Single Ambig)
 &rst
  ixpk= 1634, nxpk= 20, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1237,1245,1253,
 &end
#
#    0 AMB  20-2:1649     0 AMB  20-1:1649   3.20    (#   1649:20  Double Ambig)
 &rst
  ixpk= 1649, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1411, 145,
 igr2=1413, 147,
 &end
#
#    0 AMB  20-2:1663   143 VAL  HA          5.00    (#   1663:20  Single Ambig)
 &rst
  ixpk= 1663, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=2160,2161,2185,2186,
 &end
#
#   19 ALA  MB            0 AMB  20-1:1664   4.00    (#   1664:20  Single Ambig)
 &rst
  ixpk= 1664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 256, 257, 258,
 igr2= 118, 119, 118, 119,
 &end
#
#   68 PRO  HD-           0 AMB  20-1:1710   3.20    (#   1710:20  Single Ambig)
 &rst
  ixpk= 1710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 962, 963,
 igr2= 954, 955, 954, 955,
 &end
#
#    0 AMB  20-2:1717    70 TYR  HA          4.50    (#   1717:20  Single Ambig)
 &rst
  ixpk= 1717, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1041,1031,
 &end
#
#    0 AMB  20-2:1722     0 AMB  20-1:1722   3.50    (#   1722:20  Double Ambig)
 &rst
  ixpk= 1722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2022, 975,
 igr2=2024, 977,
 &end
#
#    0 AMB  20-2:1727   123 ILE  HA          5.00    (#   1727:20  Single Ambig)
 &rst
  ixpk= 1727, nxpk= 20, iat=  -1,1798, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1809,1810,1811, 770, 771, 772,
 &end
#
#    0 AMB  20-2:1731   136 GLU  HA          4.50    (#   1731:20  Single Ambig)
 &rst
  ixpk= 1731, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2046, 287,
 &end
#
#    0 AMB  20-2:1740   110 LYS  HA          5.00    (#   1740:20  Single Ambig)
 &rst
  ixpk= 1740, nxpk= 20, iat=  -1,1604, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1638,1656,
 &end
#
#   74 GLN  HB-           0 AMB  20-1:1747   3.00    (#   1747:20  Single Ambig)
 &rst
  ixpk= 1747, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=1064,1065,
 igr2=1062,1018,
 &end
#
#    0 AMB  20-2:1748    71 GLU  HA          4.50    (#   1748:20  Single Ambig)
 &rst
  ixpk= 1748, nxpk= 20, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1031,1041,
 &end
#
#    0 AMB  20-2:1765     0 AMB  20-1:1765   4.00    (#   1765:20  Double Ambig)
 &rst
  ixpk= 1765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 367,2050,2051,2053,1067,1068, 342, 343,
 igr2= 362,1079,
 &end
#
#    0 AMB  20-2:1785    96 ASP  HA          3.50    (#   1785:20  Single Ambig)
 &rst
  ixpk= 1785, nxpk= 20, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1397,1423,
 &end
#
#    0 AMB  20-2:1788   145 LEU  HA          4.50    (#   1788:20  Single Ambig)
 &rst
  ixpk= 1788, nxpk= 20, iat=  -1,2139, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2156,2175,
 &end
#
#    0 AMB  20-2:1793   107 ALA  HA          4.00    (#   1793:20  Single Ambig)
 &rst
  ixpk= 1793, nxpk= 20, iat=  -1,1560, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1612,1613,1612,1613,
 &end
#
#    0 AMB  20-2:1795    85 PHE  HA          4.00    (#   1795:20  Single Ambig)
 &rst
  ixpk= 1795, nxpk= 20, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1245,1253,1237,
 &end
#
#    0 AMB  20-2:1809     0 AMB  20-1:1809   5.50    (#   1809:20  Double Ambig)
 &rst
  ixpk= 1809, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 907,  97,
 igr2= 919, 615,
 &end
#
#    0 AMB  20-2:1822    50 TRP  HA          5.50    (#   1822:20  Single Ambig)
 &rst
  ixpk= 1822, nxpk= 20, iat=  -1, 707, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  49,  50,  51, 692, 693, 694,  85,  86,  87,  89,
        90,  91,
 &end
#
#    0 AMB  20-2:1852    87 ALA  HA          4.50    (#   1852:20  Single Ambig)
 &rst
  ixpk= 1852, nxpk= 20, iat=  -1,1266, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1310,1311,1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:1860    78 PRO  HD-         4.50    (#   1860:20  Single Ambig)
 &rst
  ixpk= 1860, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1138,1139,1113,1114,
 igr2=1132,1133,
 &end
#
#    0 AMB  20-2:1864     0 AMB  20-1:1864   5.00    (#   1864:20  Double Ambig)
 &rst
  ixpk= 1864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1=1096,1097, 965, 966,
 igr2=1132,1133, 962, 963,
 &end
#
#    0 AMB  20-2:1877     0 AMB  20-1:1877   5.50    (#   1877:20  Double Ambig)
 &rst
  ixpk= 1877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.42, r4=11.92,
 igr1= 987, 985, 989, 547, 548, 547, 548, 539,
 igr2= 541, 542, 541, 542, 541, 542, 541, 542, 541, 542,
      
 &end
#
#    0 AMB  20-2:1900     0 AMB  20-1:1900   6.00    (#   1900:20  Double Ambig)
 &rst
  ixpk= 1900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1=1159,1728,1640,
 igr2=1651,1652,1721,1722,1651,1652,
 &end
#
#    0 AMB  20-2:1901     0 AMB  20-1:1901   6.00    (#   1901:20  Double Ambig)
 &rst
  ixpk= 1901, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=1180,1181,1180,1181,
 igr2=1651,1652,1651,1652,
 &end
#
#    0 AMB  20-2:1954   110 LYS  HE-         4.00    (#   1954:20  Single Ambig)
 &rst
  ixpk= 1954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1609,1610,1692,1693,
 igr2=1615,1616,
 &end
#
#    0 AMB  20-2:1961     0 AMB  20-1:1961   6.00    (#   1961:20  Double Ambig)
 &rst
  ixpk= 1961, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=1547,1548,1550,1551,
 igr2=1615,1616,1615,1616,
 &end
#
#    0 AMB  20-2:1970     0 AMB  20-1:1970   4.00    (#   1970:20  Double Ambig)
 &rst
  ixpk= 1970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr1=1533,1534,1535,1537,1538,1539,2163,
 igr2=1528,1529,2160,2161,
 &end
#
#    0 AMB  20-2:1989     0 AMB  20-1:1989   6.00    (#   1989:20  Double Ambig)
 &rst
  ixpk= 1989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=1550,1551,1547,1548,
 igr2=1528,1529,1528,1529,
 &end
#
#    0 AMB  20-2:1995     0 AMB  20-1:1995   4.00    (#   1995:20  Double Ambig)
 &rst
  ixpk= 1995, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 igr2=  80,  81,  80,  81,
 &end
#
#    0 AMB  20-2:1996     0 AMB  20-1:1996   5.50    (#   1996:20  Double Ambig)
 &rst
  ixpk= 1996, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 495, 496, 497, 777, 778, 779,
 igr2=  80,  81,  80,  81,
 &end
#
#    0 AMB  20-2:2015    40 LEU  HB-         3.50    (#   2015:20  Single Ambig)
 &rst
  ixpk= 2015, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 562, 615,
 igr2= 564, 565,
 &end
#
#    0 AMB  20-2:2036     0 AMB  20-1:2036   5.50    (#   2036:20  Double Ambig)
 &rst
  ixpk= 2036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 386, 387, 386, 387,
 igr2= 364, 365, 364, 365,
 &end
#
#    0 AMB  20-2:2038     0 AMB  20-1:2038   3.50    (#   2038:20  Double Ambig)
 &rst
  ixpk= 2038, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2139, 147,
 igr2=2141,2142, 161, 162,
 &end
#
#    0 AMB  20-2:2039     0 AMB  20-1:2039   3.50    (#   2039:20  Double Ambig)
 &rst
  ixpk= 2039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 562, 615,
 igr2= 564, 565, 564, 565,
 &end
#
#    0 AMB  20-2:2046     0 AMB  20-1:2046   3.50    (#   2046:20  Double Ambig)
 &rst
  ixpk= 2046, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1898, 862,
 igr2=1900,1901, 864, 865,
 &end
#
#    0 AMB  20-2:2057   109 LEU  HB-         6.00    (#   2057:20  Single Ambig)
 &rst
  ixpk= 2057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1=1533,1534,1535,1537,1538,1539,1660,1661,1662,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:2058   109 LEU  HB-         4.00    (#   2058:20  Single Ambig)
 &rst
  ixpk= 2058, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1545,1585,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:2062     0 AMB  20-1:2062   4.00    (#   2062:20  Double Ambig)
 &rst
  ixpk= 2062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1=1268,1269,1270,1310,1311, 774, 775,
 igr2=1304, 768,
 &end
#
#    0 AMB  20-2:2063     0 AMB  20-1:2063   4.00    (#   2063:20  Double Ambig)
 &rst
  ixpk= 2063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1545,1585,
 igr2=1587,1588,1587,1588,
 &end
#
#    0 AMB  20-2:2065   121 LEU  HB-         5.00    (#   2065:20  Single Ambig)
 &rst
  ixpk= 2065, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1280,1281,1282,1762,
 igr2=1759,1760,
 &end
#
#    0 AMB  20-2:2095   103 ASP  HB-         3.00    (#   2095:20  Single Ambig)
 &rst
  ixpk= 2095, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=1492,1411,
 igr2=1494,1495,
 &end
#
#    0 AMB  20-2:2097     0 AMB  20-1:2097   3.50    (#   2097:20  Double Ambig)
 &rst
  ixpk= 2097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1159,1658,
 igr2=1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:2099     0 AMB  20-1:2099   6.50    (#   2099:20  Double Ambig)
 &rst
  ixpk= 2099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1201,1138,1139,
 igr2=1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:2100    80 LEU  HB-         6.50    (#   2100:20  Single Ambig)
 &rst
  ixpk= 2100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1201,1138,1139,
 igr2=1161,1162,
 &end
#
#    0 AMB  20-2:2103     0 AMB  20-1:2103   3.50    (#   2103:20  Double Ambig)
 &rst
  ixpk= 2103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 296,1642,1643, 315,
 igr2= 298, 299,1161,1162, 298, 299,
 &end
#
#    0 AMB  20-2:2110     0 AMB  20-1:2110   5.50    (#   2110:20  Double Ambig)
 &rst
  ixpk= 2110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1141, 660,1642,1643, 145,
 igr2=1149,1150,1149,1150,1149,1150, 999,1000,
 &end
#
#    0 AMB  20-2:2126    49 ILE  HB          3.50    (#   2126:20  Single Ambig)
 &rst
  ixpk= 2126, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 692, 693, 694,  49,  50,  51,
 &end
#
#    0 AMB  20-2:2136     0 AMB  20-1:2136   5.00    (#   2136:20  Double Ambig)
 &rst
  ixpk= 2136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1= 940, 941, 942, 944, 945, 946, 588, 589, 590, 592,
       593, 594,
 igr2= 979, 980, 979, 980,
 &end
#
#    0 AMB  20-2:2147     0 AMB  20-1:2147   6.00    (#   2147:20  Double Ambig)
 &rst
  ixpk= 2147, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1=2179,2180,2179,2180,2141,2142,
 igr2=2127,2128,2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:2148     0 AMB  20-1:2148   6.00    (#   2148:20  Double Ambig)
 &rst
  ixpk= 2148, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=2179,2180,2179,2180,
 igr2=2127,2128,2127,2128,
 &end
#
#  146 LEU  HN            0 AMB  20-1:2149   6.00    (#   2149:20  Single Ambig)
 &rst
  ixpk= 2149, nxpk= 20, iat=2156,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:2150     0 AMB  20-1:2150   4.00    (#   2150:20  Double Ambig)
 &rst
  ixpk= 2150, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr1=2132,2133,2132,2133,2137,
 igr2=2127,2128,2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:2181     0 AMB  20-1:2181   3.50    (#   2181:20  Double Ambig)
 &rst
  ixpk= 2181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 264, 325,
 igr2= 269, 270, 330, 331,
 &end
#
#    0 AMB  20-2:2187     0 AMB  20-1:2187   3.20    (#   2187:20  Double Ambig)
 &rst
  ixpk= 2187, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=2009,1321,1322,
 igr2=2014,2015,1344,1345,
 &end
#
#    0 AMB  20-2:2193     0 AMB  20-1:2193   6.50    (#   2193:20  Double Ambig)
 &rst
  ixpk= 2193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1= 995,1077,
 igr2=1023,1024,1023,1024,
 &end
#
#   33 THR  MG2           0 AMB  20-1:2199   4.20    (#   2199:20  Single Ambig)
 &rst
  ixpk= 2199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 466, 467, 468,
 igr2= 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:2200     0 AMB  20-1:2200   5.50    (#   2200:20  Double Ambig)
 &rst
  ixpk= 2200, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 394, 426, 474,
 igr2= 386, 387, 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:2201     0 AMB  20-1:2201   5.00    (#   2201:20  Double Ambig)
 &rst
  ixpk= 2201, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=1033,1721,1722,1757,
 igr2=1084,1085,1733,1734,1733,1734,
 &end
#
#    0 AMB  20-2:2212     0 AMB  20-1:2212   6.50    (#   2212:20  Double Ambig)
 &rst
  ixpk= 2212, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1=1747,1748,1749,1306,1307,1308,
 igr2=1344,1345,1344,1345,
 &end
#
#   43 ASP  HN            0 AMB  20-1:2214   6.50    (#   2214:20  Single Ambig)
 &rst
  ixpk= 2214, nxpk= 20, iat= 613,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr2= 605, 606, 605, 606,
 &end
#
#    0 AMB  20-2:2236     0 AMB  20-1:2236   4.00    (#   2236:20  Double Ambig)
 &rst
  ixpk= 2236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
 igr1= 720,1249, 722, 718,
 igr2= 605, 606, 605, 606,1550,1551, 605, 606, 605, 606,
      
 &end
#
#    0 AMB  20-2:2257    50 TRP  HB-         6.00    (#   2257:20  Single Ambig)
 &rst
  ixpk= 2257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 108, 109, 110,1203,1204,1205,1207,1208,1209,
 igr2= 709, 710,
 &end
#
#    0 AMB  20-2:2268     0 AMB  20-1:2268   3.50    (#   2268:20  Double Ambig)
 &rst
  ixpk= 2268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1690,1259,1260,
 igr2=1695,1696,1695,1696,
 &end
#
#    0 AMB  20-2:2272     0 AMB  20-1:2272   4.50    (#   2272:20  Double Ambig)
 &rst
  ixpk= 2272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1132,1133,1526,1642,1643,
 igr2=1138,1139,1506,1507,
 &end
#
#    0 AMB  20-2:2275     0 AMB  20-1:2275   5.00    (#   2275:20  Double Ambig)
 &rst
  ixpk= 2275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1159, 681, 682,1189,
 igr2=1201,1138,1139,
 &end
#
#    0 AMB  20-2:2281     0 AMB  20-1:2281   3.20    (#   2281:20  Double Ambig)
 &rst
  ixpk= 2281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1937,1560,
 igr2=1934,1935,1606,1607,
 &end
#
#  107 ALA  HA            0 AMB  20-1:2282   5.00    (#   2282:20  Single Ambig)
 &rst
  ixpk= 2282, nxpk= 20, iat=1560,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2=1606,1607,1606,1607,
 &end
#
#  111 ASN  HN            0 AMB  20-1:2283   4.00    (#   2283:20  Single Ambig)
 &rst
  ixpk= 2283, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:2319     6 LEU  HG          3.20    (#   2319:20  Single Ambig)
 &rst
  ixpk= 2319, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 &end
#
#    0 AMB  20-2:2333     0 AMB  20-1:2333   4.00    (#   2333:20  Double Ambig)
 &rst
  ixpk= 2333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1=2030,2046,2041,
 igr2=2026,2027,2026,2027,2026,2027,
 &end
#
#    0 AMB  20-2:2336    74 GLN  HB-         3.20    (#   2336:20  Single Ambig)
 &rst
  ixpk= 2336, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1062,1018,
 igr2=1064,1065,
 &end
#
#    0 AMB  20-2:2351   110 LYS  HD-         3.50    (#   2351:20  Single Ambig)
 &rst
  ixpk= 2351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1615,1616,1615,1616,
 igr2=1612,1613,
 &end
#
#    0 AMB  20-2:2354     0 AMB  20-1:2354   5.20    (#   2354:20  Double Ambig)
 &rst
  ixpk= 2354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
 igr1= 348, 349, 348, 349,
 igr2= 327, 328, 398, 399,
 &end
#
#    0 AMB  20-2:2373     0 AMB  20-1:2373   3.50    (#   2373:20  Double Ambig)
 &rst
  ixpk= 2373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1679,1680,1122,1123,
 igr2=1676,1677,1119,1120,
 &end
#
#   20 GLU  HN            0 AMB  20-1:2381   3.50    (#   2381:20  Single Ambig)
 &rst
  ixpk= 2381, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2385    68 PRO  HG-         4.50    (#   2385:20  Single Ambig)
 &rst
  ixpk= 2385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 145, 971,
 igr2= 965, 966,
 &end
#
#   21 HIS  HN            0 AMB  20-1:2390   4.00    (#   2390:20  Single Ambig)
 &rst
  ixpk= 2390, nxpk= 20, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2391     0 AMB  20-1:2391   3.20    (#   2391:20  Double Ambig)
 &rst
  ixpk= 2391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 269, 270, 269, 270,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2393     0 AMB  20-1:2393   5.50    (#   2393:20  Double Ambig)
 &rst
  ixpk= 2393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=  68,  69,  70, 588, 589, 590, 592, 593, 594,
 igr2= 602, 603, 602, 603,1096,1097,
 &end
#
#    0 AMB  20-2:2418     4 ILE  HG1-        4.50    (#   2418:20  Single Ambig)
 &rst
  ixpk= 2418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 696, 697,  47,
 igr2=  53,  54,
 &end
#
#    0 AMB  20-2:2423     0 AMB  20-1:2423   4.20    (#   2423:20  Double Ambig)
 &rst
  ixpk= 2423, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 696, 697,  47,
 igr2=  53,  54,  53,  54,
 &end
#
#    0 AMB  20-2:2430     0 AMB  20-1:2430   3.80    (#   2430:20  Double Ambig)
 &rst
  ixpk= 2430, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1=1615,1616,1223,1224,
 igr2=1609,1610,1220,1221,
 &end
#
#    0 AMB  20-2:2432     0 AMB  20-1:2432   4.20    (#   2432:20  Double Ambig)
 &rst
  ixpk= 2432, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
 igr1=  53,  54,1528,1529,1692,1693,
 igr2= 696, 697,1531,1609,1610,
 &end
#
#    0 AMB  20-2:2434     0 AMB  20-1:2434   4.50    (#   2434:20  Double Ambig)
 &rst
  ixpk= 2434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 505, 750, 476,
 igr2= 510, 774, 775,
 &end
#
#    0 AMB  20-2:2435    36 LEU  HG          5.00    (#   2435:20  Single Ambig)
 &rst
  ixpk= 2435, nxpk= 20, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 478, 479,  80,  81,
 &end
#
#    0 AMB  20-2:2442     0 AMB  20-1:2442   4.50    (#   2442:20  Double Ambig)
 &rst
  ixpk= 2442, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 362,1111,
 igr2= 367,1135,1136,
 &end
#
#    0 AMB  20-2:2445     0 AMB  20-1:2445   4.50    (#   2445:20  Double Ambig)
 &rst
  ixpk= 2445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 362,1111,
 igr2= 367,1135,1136,
 &end
#
#    0 AMB  20-2:2453     0 AMB  20-1:2453   4.00    (#   2453:20  Double Ambig)
 &rst
  ixpk= 2453, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
 igr1= 770, 771, 772, 242, 243, 244, 246, 247, 248,1809,
      1810,1811,
 igr2=1806,1807,1806,1807,1806,1807,
 &end
#
#    0 AMB  20-2:2454    51 LEU  HG          3.20    (#   2454:20  Single Ambig)
 &rst
  ixpk= 2454, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1=  49,  50,  51,  85,  86,  87,  89,  90,  91, 369,
       370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:2457     0 AMB  20-1:2457   4.00    (#   2457:20  Double Ambig)
 &rst
  ixpk= 2457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1615,1616,1223,1224,
 igr2=1609,1610,1220,1221,
 &end
#
#    0 AMB  20-2:2460     0 AMB  20-1:2460   6.50    (#   2460:20  Double Ambig)
 &rst
  ixpk= 2460, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1199,1570,1339,1492,
 igr2=1220,1221,1609,1610,1609,1610,1531,
 &end
#
#    0 AMB  20-2:2468     0 AMB  20-1:2468   4.50    (#   2468:20  Double Ambig)
 &rst
  ixpk= 2468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1908,1197,
 igr2=1918,1919,1164,
 &end
#
#    0 AMB  20-2:2489   109 LEU  HG          3.50    (#   2489:20  Single Ambig)
 &rst
  ixpk= 2489, nxpk= 20, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1545,1585,
 &end
#
#    0 AMB  20-2:2513    41 LEU  MDX         5.50    (#   2513:20  Single Ambig)
 &rst
  ixpk= 2513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1041,1031,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:2514    73 LEU  MDY         6.50    (#   2514:20  Single Ambig)
 &rst
  ixpk= 2514, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.26, r4=13.76,
 igr1=1533,1534,1535,1537,1538,1539, 588, 589, 590, 592,
       593, 594,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:2515    73 LEU  MDY         5.50    (#   2515:20  Single Ambig)
 &rst
  ixpk= 2515, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1572,1573,1135,1136,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   40 LEU  HN            0 AMB  20-1:2525   5.80    (#   2525:20  Single Ambig)
 &rst
  ixpk= 2525, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 8.78, r4= 9.28,
 igr2= 569, 570, 571, 573, 574, 575, 166, 167, 168, 170,
       171, 172,
 &end
#
#    0 AMB  20-2:2618    33 THR  MG2         5.20    (#   2618:20  Single Ambig)
 &rst
  ixpk= 2618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.01, r4= 9.51,
 igr1=  56,  57,  58, 738, 739, 740, 742, 743, 744,
 igr2= 466, 467, 468,
 &end
#
#    0 AMB  20-2:2625     0 AMB  20-1:2625   4.00    (#   2625:20  Double Ambig)
 &rst
  ixpk= 2625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 564, 565, 768,
 igr2= 569, 570, 571, 573, 574, 575, 242, 243, 244, 246,
       247, 248,
 &end
#
#    0 AMB  20-2:2634     0 AMB  20-1:2634   3.20    (#   2634:20  Double Ambig)
 &rst
  ixpk= 2634, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=1413, 809,
 igr2=1415,1416,1417, 811, 812, 813,
 &end
#
#    0 AMB  20-2:2635    87 ALA  MB          5.50    (#   2635:20  Single Ambig)
 &rst
  ixpk= 2635, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1550,1551,1344,1345,
 igr2=1268,1269,1270,
 &end
#
#    0 AMB  20-2:2682    49 ILE  MG2         6.00    (#   2682:20  Single Ambig)
 &rst
  ixpk= 2682, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 686, 679,
 igr2= 692, 693, 694,
 &end
#
#    0 AMB  20-2:2693     0 AMB  20-1:2693   4.20    (#   2693:20  Double Ambig)
 &rst
  ixpk= 2693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=1910,1321,1322,
 igr2=1914,1915,1916,1306,1307,1308,
 &end
#
#    0 AMB  20-2:2697    59 ALA  MB          4.50    (#   2697:20  Single Ambig)
 &rst
  ixpk= 2697, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 843, 836,
 igr2= 847, 848, 849,
 &end
#
#    0 AMB  20-2:2724    53 ILE  MD1         5.20    (#   2724:20  Single Ambig)
 &rst
  ixpk= 2724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
 igr1=  78, 766,
 igr2= 777, 778, 779,
 &end
#
#    0 AMB  20-2:2771    11 THR  HB          6.50    (#   2771:20  Single Ambig)
 &rst
  ixpk= 2771, nxpk= 20, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 136, 137, 136, 137,
 &end
#
#    0 AMB  20-2:2776     3 ASP  HA          5.50    (#   2776:20  Single Ambig)
 &rst
  ixpk= 2776, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  23, 681, 682,
 &end
#
#   50 TRP  HE1           0 AMB  20-1:2814   5.50    (#   2814:20  Single Ambig)
 &rst
  ixpk= 2814, nxpk= 20, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2=  68,  69,  70,1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  20-2:2819     0 AMB  20-1:2819   2.80    (#   2819:20  Double Ambig)
 &rst
  ixpk= 2819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=  95,1484,1485,1486,
 igr2=  78,1328,
 &end
#
#    0 AMB  20-2:2825     6 LEU  HG          5.50    (#   2825:20  Single Ambig)
 &rst
  ixpk= 2825, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 298, 299, 733, 734, 466, 467, 468,
 &end
#
#    0 AMB  20-2:2841     7 ILE  HA          4.00    (#   2841:20  Single Ambig)
 &rst
  ixpk= 2841, nxpk= 20, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 539,  95, 547, 548, 547, 548,
 &end
#
#    0 AMB  20-2:2865     7 ILE  MD1         5.00    (#   2865:20  Single Ambig)
 &rst
  ixpk= 2865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 987, 985, 989,  95,1247,1251,
 igr2= 108, 109, 110,
 &end
#
#    0 AMB  20-2:2870     7 ILE  MG2         5.00    (#   2870:20  Single Ambig)
 &rst
  ixpk= 2870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 985, 989, 987, 539,
 igr2= 101, 102, 103,
 &end
#
#   19 ALA  MB            0 AMB  20-1:2872   4.20    (#   2872:20  Single Ambig)
 &rst
  ixpk= 2872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 256, 257, 258,
 igr2= 118, 119, 118, 119,
 &end
#
#    8 SER  HA            0 AMB  20-1:2873   3.50    (#   2873:20  Single Ambig)
 &rst
  ixpk= 2873, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 118, 119, 118, 119,
 &end
#
#    8 SER  HN            0 AMB  20-1:2874   3.50    (#   2874:20  Single Ambig)
 &rst
  ixpk= 2874, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 118, 119, 118, 119,
 &end
#
#    0 AMB  20-2:2896    40 LEU  HB-         3.50    (#   2896:20  Single Ambig)
 &rst
  ixpk= 2896, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 562, 615,
 igr2= 564, 565,
 &end
#
#    0 AMB  20-2:2931     0 AMB  20-1:2931   4.20    (#   2931:20  Double Ambig)
 &rst
  ixpk= 2931, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1633,1634,1633,1634,
 igr2=1628,1629,1628,1629,
 &end
#
#    0 AMB  20-2:2932    18 VAL  HA          5.50    (#   2932:20  Single Ambig)
 &rst
  ixpk= 2932, nxpk= 20, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 301, 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2940     0 AMB  20-1:2940   4.50    (#   2940:20  Double Ambig)
 &rst
  ixpk= 2940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 962, 963, 296,
 igr2= 968, 969, 342, 343,
 &end
#
#    0 AMB  20-2:2941     0 AMB  20-1:2941   3.50    (#   2941:20  Double Ambig)
 &rst
  ixpk= 2941, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 238, 962, 963,
 igr2= 240, 968, 969,
 &end
#
#    0 AMB  20-2:2942     0 AMB  20-1:2942   6.50    (#   2942:20  Double Ambig)
 &rst
  ixpk= 2942, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
 igr1=1099,1100,1999,2000, 330, 331,
 igr2=1081,1082, 342, 343, 342, 343,
 &end
#
#    0 AMB  20-2:2943     0 AMB  20-1:2943   4.50    (#   2943:20  Double Ambig)
 &rst
  ixpk= 2943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 348, 349, 164,
 igr2= 342, 343, 968, 969,
 &end
#
#    0 AMB  20-2:2951    18 VAL  MGY         3.20    (#   2951:20  Single Ambig)
 &rst
  ixpk= 2951, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 240, 301,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:2968     0 AMB  20-1:2968   4.50    (#   2968:20  Double Ambig)
 &rst
  ixpk= 2968, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 379,1423, 294,
 igr2= 325,1445, 264,
 &end
#
#   20 GLU  HA            0 AMB  20-1:2970   3.50    (#   2970:20  Single Ambig)
 &rst
  ixpk= 2970, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2980     0 AMB  20-1:2980   3.20    (#   2980:20  Double Ambig)
 &rst
  ixpk= 2980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=2053,2050,2051, 342, 343,
 igr2=2048, 296,
 &end
#
#    0 AMB  20-2:2983     0 AMB  20-1:2983   3.20    (#   2983:20  Double Ambig)
 &rst
  ixpk= 2983, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1= 301,2050,2051,
 igr2= 296,2048,
 &end
#
#    0 AMB  20-2:2984    22 LEU  HG          4.00    (#   2984:20  Single Ambig)
 &rst
  ixpk= 2984, nxpk= 20, iat=  -1, 301, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1802,1803,1804, 303, 304, 305, 307, 308, 309,
 &end
#
#    0 AMB  20-2:2994     0 AMB  20-1:2994   3.50    (#   2994:20  Double Ambig)
 &rst
  ixpk= 2994, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 269, 270, 330, 331,
 igr2= 264, 325,
 &end
#
#    0 AMB  20-2:2998     0 AMB  20-1:2998   4.20    (#   2998:20  Double Ambig)
 &rst
  ixpk= 2998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=1368,1369,1096,1097, 342, 343,
 igr2=1363,1094, 340,
 &end
#
#    0 AMB  20-2:3001     0 AMB  20-1:3001   5.00    (#   3001:20  Double Ambig)
 &rst
  ixpk= 3001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 296,1994,
 igr2= 342, 343, 342, 343,
 &end
#
#    0 AMB  20-2:3007     0 AMB  20-1:3007   6.20    (#   3007:20  Double Ambig)
 &rst
  ixpk= 3007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.94, r4= 9.44,
 igr1= 962, 963, 296,
 igr2= 164, 348, 349,
 &end
#
#    0 AMB  20-2:3008     0 AMB  20-1:3008   5.00    (#   3008:20  Double Ambig)
 &rst
  ixpk= 3008, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
 igr1= 327, 328, 398, 399,1996,1997,
 igr2= 348, 349, 348, 349, 348, 349,
 &end
#
#    0 AMB  20-2:3010     0 AMB  20-1:3010   4.20    (#   3010:20  Double Ambig)
 &rst
  ixpk= 3010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=2182,2183, 345, 346,
 igr2=2188,2189, 351, 352,
 &end
#
#    0 AMB  20-2:3011     0 AMB  20-1:3011   6.50    (#   3011:20  Double Ambig)
 &rst
  ixpk= 3011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.54, r4=10.04,
 igr1= 564, 565,1119,1120, 586,
 igr2= 600,1079,
 &end
#
#    0 AMB  20-2:3019    26 LEU  HG          5.50    (#   3019:20  Single Ambig)
 &rst
  ixpk= 3019, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 736,2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:3023    26 LEU  HG          5.00    (#   3023:20  Single Ambig)
 &rst
  ixpk= 3023, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 360, 313,
 &end
#
#    0 AMB  20-2:3024     0 AMB  20-1:3024   6.50    (#   3024:20  Double Ambig)
 &rst
  ixpk= 3024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1157, 379,
 igr2=1135,1136, 367,
 &end
#
#    0 AMB  20-2:3032    27 GLU  HB-         3.50    (#   3032:20  Single Ambig)
 &rst
  ixpk= 3032, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 386, 387, 386, 387,
 igr2= 383, 384,
 &end
#
#    0 AMB  20-2:3037     0 AMB  20-1:3037   3.00    (#   3037:20  Double Ambig)
 &rst
  ixpk= 3037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 396, 340,
 igr2= 398, 399, 398, 399,
 &end
#
#    0 AMB  20-2:3048    29 ALA  MB          6.00    (#   3048:20  Single Ambig)
 &rst
  ixpk= 3048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=2111, 398, 399,
 igr2= 413, 414, 415,
 &end
#
# 33 THR QG2 33 THR HB 3.00  (# 0.9873 0:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,

      rk2=80.0, rk3=80.0, ir6=1, ialtd=0,
 igr1= 466, 467, 468,
 &end
#
# 56 THR QG2 56 THR HB 3.00  (# 0.0000 2:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 811, 812, 813,
 &end
#
# 32 THR QG2 32 THR HB 3.00  (# 0.9992 3:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 450, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 452, 453, 454,
 &end
#
# 117 THR QG2 117 THR HB 3.00  (# 0.9958 4:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1711,1712,1713,
 &end
#
# 97 THR QG2 97 THR HB 3.00  (# 0.0000 5:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1413, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1415,1416,1417,
 &end
#
# 5 THR QG2 5 THR HB 4.00  (# 0.9669 6:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  68,  69,  70,
 &end
#
# 11 THR QG2 11 THR HB 3.00  (# 0.0000 7:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 149, 150, 151,
 &end
#
# 120 THR QG2 120 THR HB 3.00  (# 0.9753 8:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1745, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1747,1748,1749,
 &end
#
# 35 THR QG2 35 THR HB 3.00  (# 0.9832 9:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 495, 496, 497,
 &end
#
# 18 VAL QG1 18 VAL HA 3.80  (# 0.0000 10:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 242, 243, 244,
 &end
#
# 18 VAL QG2 18 VAL HA 3.80  (# 0.9963 11:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 246, 247, 248,
 &end
#
# 68 PRO HB2 68 PRO HA 2.80  (# 0.9501 12:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 968, 971, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 143 VAL HB 143 VAL HA 3.50  (# 0.0000 19:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2109, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 LEU HG 112 SER HB2 5.50  (# 0.9476 28:20 3.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1164,1642, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 87 ALA QB 120 THR HA 4.20  (# 0.9663 35:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1743, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1268,1269,1270,
 &end
#
# 131 PRO HB3 131 PRO HA 2.80  (# 0.0000 37:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1935,1937, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 39 PRO HB2 39 PRO HA 3.00  (# 0.9990 39:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 556, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11 THR QG2 11 THR HA 4.00  (# 0.0000 40:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 145, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 149, 150, 151,
 &end
#
# 142 TRP HB3 142 TRP HA 3.00  (# 0.9793 42:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2088,2085, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 78 PRO HB2 78 PRO HA 3.00  (# 0.9980 46:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1138,1141, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 78 PRO HB3 78 PRO HA 3.00  (# 0.9747 47:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1141, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 83 VAL QG2 83 VAL HA 4.00  (# 0.0000 51:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1207,1208,1209,
 &end
#
# 83 VAL HB 83 VAL HA 3.00  (# 0.9658 52:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1201,1199, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 83 VAL QG1 83 VAL HA 4.00  (# 0.0000 54:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1203,1204,1205,
 &end
#
# 7 ILE HB 52 VAL HA 3.00  (# 0.9668 55:20 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99, 750, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 52 VAL QG2 52 VAL HA 4.00  (# 0.9909 57:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 758, 759, 760,
 &end
#
# 141 SER HB3 138 TRP HA 4.00  (# 0.9393 58:20 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=2077,2024, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 138 TRP HB2 138 TRP HA 3.20  (# 0.0000 59:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2026,2024, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 70 TYR HB3 70 TYR HA 3.00  (# 0.0000 65:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1000, 997, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 97 THR HB 97 THR HA 3.00  (# 0.9981 66:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=1413,1411, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 72 ALA QB 69 PHE HA 4.20  (# 0.9935 68:20 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 977, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1035,1036,1037,
 &end
#
# 70 TYR HB2 70 TYR HA 3.00  (# 0.9507 69:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 999, 997, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 69 PHE HB2 69 PHE HA 3.20  (# 0.9923 70:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat= 979, 977, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 69 PHE HB3 69 PHE HA 3.50  (# 0.9934 71:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat= 980, 977, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 ILE QG2 123 ILE HA 3.20  (# 0.9766 74:20 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1798, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=1802,1803,1804,
 &end
#
# 136 GLU HG2 136 GLU HA 4.00  (# 0.0000 75:20 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=1999,1994, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 136 GLU HB2 136 GLU HA 3.00  (# 0.0000 76:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=1996,1994, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7 ILE QG2 7 ILE HA 3.50  (# 0.0000 77:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 101, 102, 103,
 &end
#
# 110 LYS HG2 110 LYS HA 3.20  (# 0.9580 82:20 2.69,)
 &rst
  ixpk= 0, nxpk= 0, iat=1609,1604, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 109 LEU QD2 106 GLU HA 5.00  (# 0.0000 83:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1596,1597,1598,
 &end
#
# 109 LEU HB2 106 GLU HA 3.50  (# 0.9906 85:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1587,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 106 GLU HG2 106 GLU HA 3.50  (# 0.0000 86:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1550,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 88 ILE QG2 88 ILE HA 3.50  (# 0.9856 89:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1276, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1280,1281,1282,
 &end
#
# 104 LYS HB2 104 LYS HA 3.20  (# 0.9970 90:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1506,1504, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 107 ALA QB 104 LYS HA 3.50  (# 0.9996 91:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1562,1563,1564,
 &end
#
# 104 LYS HG3 104 LYS HA 3.50  (# 0.9993 95:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1510,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 137 GLU HB2 137 GLU HA 3.20  (# 0.9989 99:20 2.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=2011,2009, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 121 LEU HB2 88 ILE HA 3.50  (# 0.9673 101:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=1759,1276, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 71 GLU HG2 71 GLU HA 3.50  (# 0.0000 102:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 GLU HG2 28 GLU HA 4.00  (# 0.9994 103:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 396, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 28 GLU HB3 28 GLU HA 3.20  (# 0.9963 104:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 396, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 71 GLU HG3 71 GLU HA 3.50  (# 0.9978 105:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1024,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 HIS HB2 21 HIS HA 3.20  (# 0.0000 107:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 279, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 21 HIS HB3 21 HIS HA 3.20  (# 0.0000 108:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 279, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 105 LEU HG 105 LEU HA 4.00  (# 0.8206 110:20 3.65,)
 &rst
  ixpk= 0, nxpk= 0, iat=1531,1526, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 41 LEU HB2 41 LEU HA 3.20  (# 0.9954 114:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 581, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 41 LEU HG 41 LEU HA 2.80  (# 0.9903 115:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat= 586, 581, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 109 LEU QD1 109 LEU HA 4.00  (# 0.9892 119:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1585, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1592,1593,1594,
 &end
#
# 109 LEU HB3 109 LEU HA 3.00  (# 0.0000 120:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1588,1585, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 130 ILE QG2 130 ILE HA 4.00  (# 0.0000 121:20 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1910, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1914,1915,1916,
 &end
#
# 130 ILE HB 130 ILE HA 3.50  (# 0.0000 123:20 2.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=1912,1910, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 147 LYS HG2 147 LYS HA 3.00  (# 0.9845 124:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=2182,2177, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 73 LEU HB3 73 LEU HA 3.20  (# 0.0000 127:20 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,1043, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 146 LEU HG 147 LYS HA 4.50  (# 0.0000 132:20 3.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=2163,2177, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 73 LEU QD1 73 LEU HA 4.20  (# 0.0000 135:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1050,1051,1052,
 &end
#
# 147 LYS HB3 147 LYS HA 3.20  (# 0.0000 138:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=2180,2177, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 108 GLU HB2 108 GLU HA 3.00  (# 0.9808 139:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1572,1570, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 3 ASP HB2 3 ASP HA 3.20  (# 0.0000 143:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  35,  33, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 3 ASP HB3 3 ASP HA 3.20  (# 0.0000 144:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  33, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HB3 25 LYS HA 3.00  (# 0.9988 148:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 340, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 94 GLU HG3 94 GLU HA 4.00  (# 0.9938 149:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=1369,1363, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HD2 25 LYS HA 3.50  (# 0.0000 153:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 94 GLU HB2 94 GLU HA 3.00  (# 0.9933 154:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1365,1363, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 76 GLN HB2 76 GLN HA 3.00  (# 0.9699 155:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=1096,1094, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 78 PRO HD2 77 LYS HA 3.00  (# 0.9294 162:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 77 LYS HB2 77 LYS HA 3.00  (# 0.9837 163:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=1113,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 77 LYS HG2 77 LYS HA 3.50  (# 0.9984 164:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1116,1111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 ALA QB 23 ALA HA 3.00  (# 0.0000 165:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 317, 318, 319,
 &end
#
# 26 LEU HB2 23 ALA HA 4.00  (# 0.9924 168:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 315, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 34 GLU HG3 34 GLU HA 3.20  (# 0.9995 169:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 476, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 34 GLU HB2 34 GLU HA 3.20  (# 0.9865 170:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 478, 476, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 116 GLN HG3 116 GLN HA 3.20  (# 0.9690 173:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1696,1690, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 116 GLN HB2 116 GLN HA 3.00  (# 0.9292 178:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1690, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 116 GLN HB3 116 GLN HA 3.00  (# 0.9993 179:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1693,1690, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 145 LEU HB3 145 LEU HA 3.20  (# 0.9694 180:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=2142,2139, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 145 LEU HB2 145 LEU HA 3.20  (# 0.0000 181:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=2141,2139, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 19 ALA QB 19 ALA HA 3.00  (# 0.9716 182:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 256, 257, 258,
 &end
#
# 146 LEU HB2 146 LEU HA 2.80  (# 0.0000 185:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2160,2158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 147 LYS HD2 144 ASN HA 3.50  (# 0.9963 187:20 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=2185,2125, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 146 LEU HB3 146 LEU HA 2.80  (# 0.9979 189:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2161,2158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 146 LEU HG 146 LEU HA 4.00  (# 0.9073 190:20 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat=2163,2158, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 12 LEU HB2 12 LEU HA 3.20  (# 0.9966 192:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 159, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 72 ALA QB 72 ALA HA 3.00  (# 0.0000 195:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1035,1036,1037,
 &end
#
# 65 ASN HB2 65 ASN HA 3.00  (# 0.0000 201:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat= 921, 919, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 65 ASN HB3 65 ASN HA 3.00  (# 0.9871 202:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat= 922, 919, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 121 LEU HG 121 LEU HA 2.80  (# 0.9888 207:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1762,1757, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 40 LEU HB3 40 LEU HA 3.20  (# 0.9911 210:20 2.44,)
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 562, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 36 LEU HG 36 LEU HA 3.80  (# 0.9549 212:20 2.84,)
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 505, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 36 LEU HB3 36 LEU HA 2.80  (# 0.0000 213:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 505, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 40 LEU HB2 40 LEU HA 3.20  (# 0.9955 215:20 2.44,)
 &rst
  ixpk= 0, nxpk= 0, iat= 564, 562, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 59 ALA QB 59 ALA HA 3.00  (# 0.0000 217:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 847, 848, 849,
 &end
#
# 44 LEU QD1 44 LEU HA 4.00  (# 0.0000 220:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 634, 635, 636,
 &end
#
# 45 PRO HD2 44 LEU HA 3.00  (# 0.9992 221:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 645, 627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HD3 44 LEU HA 3.00  (# 0.0000 222:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 46 ALA QB 46 ALA HA 3.00  (# 0.9740 224:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 662, 663, 664,
 &end
#
# 2 ALA QB 2 ALA HA 3.00  (# 0.9986 230:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=  25,  26,  27,
 &end
#
# 130 ILE QG2 131 PRO HD3 4.00  (# 0.9945 233:20 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1929, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1914,1915,1916,
 &end
#
# 130 ILE HB 131 PRO HD2 2.80  (# 0.0000 234:20 1.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1912,1928, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 76 GLN HB2 78 PRO HD3 5.00  (# 0.9921 236:20 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=1096,1133, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 44 LEU HB2 45 PRO HD2 3.50  (# 0.9457 242:20 1.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 629, 645, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 68 PRO HG2 68 PRO HD2 3.00  (# 0.9965 243:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 965, 962, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 LEU HB3 45 PRO HD2 3.50  (# 0.9992 246:20 1.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 645, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 45 PRO HG3 45 PRO HD3 3.00  (# 0.0000 250:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 649, 646, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HG3 45 PRO HD2 3.00  (# 0.0000 251:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 649, 645, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 LEU HB3 45 PRO HD3 4.00  (# 0.0000 252:20 1.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 646, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 LEU QD1 51 LEU HB2 4.00  (# 0.9976 294:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 733, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 738, 739, 740,
 &end
#
# 36 LEU QD1 36 LEU HB2 3.50  (# 0.9982 299:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 507, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 512, 513, 514,
 &end
#
# 36 LEU HG 36 LEU HB2 3.20  (# 0.9710 300:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 507, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 36 LEU HG 36 LEU HB3 3.20  (# 0.9766 303:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 508, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 139 LEU QD2 139 LEU HB2 4.00  (# 0.9412 310:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2050, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2059,2060,2061,
 &end
#
# 146 LEU HA 146 LEU HB2 3.00  (# 0.0000 311:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2158,2160, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 146 LEU HA 146 LEU HB2 3.00  (# 0.0000 312:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2158,2160, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 146 LEU QD2 146 LEU HB3 3.80  (# 0.0000 313:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2161, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=2169,2170,2171,
 &end
#
# 115 LYS HG2 115 LYS HE2 3.50  (# 0.0000 317:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1673,1679, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 77 LYS HG3 77 LYS HE2 3.50  (# 0.9995 318:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=1117,1122, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 147 LYS HD2 147 LYS HE2 3.00  (# 0.9991 323:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=2185,2188, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 105 LEU QD1 105 LEU HB2 4.00  (# 0.9328 328:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1528, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1533,1534,1535,
 &end
#
# 105 LEU HA 105 LEU HB3 3.20  (# 0.9114 330:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1526,1529, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 147 LYS HG3 147 LYS HE2 4.00  (# 0.0000 333:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2183,2188, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 6 LEU HG 6 LEU HB3 3.00  (# 0.9962 336:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  83,  81, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 105 LEU QD2 105 LEU HB3 4.00  (# 0.9986 337:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1537,1538,1539,
 &end
#
# 25 LYS HD2 25 LYS HE2 3.20  (# 0.9906 339:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 351, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HD2 25 LYS HE3 3.20  (# 0.9996 340:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 352, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 73 LEU QD2 73 LEU HB2 3.80  (# 0.0000 344:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1045, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1054,1055,1056,
 &end
#
# 41 LEU QD1 41 LEU HB3 3.80  (# 0.9837 346:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 584, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 588, 589, 590,
 &end
#
# 73 LEU QD2 73 LEU HB3 3.80  (# 0.0000 351:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1046, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1054,1055,1056,
 &end
#
# 73 LEU QD1 73 LEU HB3 3.80  (# 0.0000 353:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1046, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1050,1051,1052,
 &end
#
# 41 LEU QD2 41 LEU HB3 3.50  (# 0.9926 365:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 584, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 592, 593, 594,
 &end
#
# 88 ILE QG2 88 ILE HB 3.00  (# 0.9987 367:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1280,1281,1282,
 &end
#
# 44 LEU QD2 44 LEU HB3 4.00  (# 0.9913 368:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 630, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 638, 639, 640,
 &end
#
# 26 LEU QD2 26 LEU HB2 4.00  (# 0.9639 372:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 373, 374, 375,
 &end
#
# 88 ILE QG2 88 ILE HB 3.00  (# 0.9987 374:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1280,1281,1282,
 &end
#
# 90 ILE QG2 90 ILE HB 3.00  (# 0.9468 377:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1304, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1306,1307,1308,
 &end
#
# 109 LEU HG 109 LEU HB2 3.00  (# 0.0000 378:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=1590,1587, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 109 LEU QD2 109 LEU HB2 3.50  (# 0.0000 379:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1587, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1596,1597,1598,
 &end
#
# 109 LEU QD2 109 LEU HB3 3.80  (# 0.0000 383:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1588, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1596,1597,1598,
 &end
#
# 53 ILE HG12 53 ILE HB 3.20  (# 0.9536 394:20 2.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 768, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 80 LEU QD2 80 LEU HB3 4.00  (# 0.0000 403:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1162, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1170,1171,1172,
 &end
#
# 70 TYR HA 70 TYR HB3 3.00  (# 0.9777 409:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1000, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 130 ILE QG2 130 ILE HB 3.00  (# 0.0000 422:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1912, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1914,1915,1916,
 &end
#
# 130 ILE HG12 130 ILE HB 3.00  (# 0.0000 424:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1918,1912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20 GLU HA 20 GLU HG2 3.00  (# 0.9916 430:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 269, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20 GLU HB3 20 GLU HG2 3.00  (# 0.9844 431:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 269, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 71 GLU HA 71 GLU HG3 3.50  (# 0.9875 435:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1018,1024, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 71 GLU HA 71 GLU HG2 3.50  (# 0.9875 436:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1018,1023, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 33 THR QG2 27 GLU HG2 4.00  (# 0.9996 443:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 466, 467, 468,
 &end
#
# 73 LEU HB3 108 GLU HG3 4.50  (# 0.9862 451:20 2.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,1576, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 2 ALA QB 34 GLU HG3 4.00  (# 0.9938 460:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  25,  26,  27,
 &end
#
# 2 ALA QB 34 GLU HG2 4.00  (# 0.9952 464:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  25,  26,  27,
 &end
#
# 106 GLU HA 106 GLU HG2 3.50  (# 0.9990 466:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1550, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 106 GLU HA 106 GLU HG3 3.50  (# 0.9990 467:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1551, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 122 LYS HG2 122 LYS HB2 3.00  (# 0.9899 468:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1781,1778, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 76 GLN HB2 76 GLN HG2 3.00  (# 0.9974 471:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1096,1099, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 72 ALA HA 76 GLN HG3 6.00  (# 0.0000 473:20 4.53,)
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1100, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 76 GLN HB2 76 GLN HG3 3.00  (# 0.9655 475:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1096,1100, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 147 LYS HA 147 LYS HB3 3.30  (# 0.0000 483:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=2177,2180, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 147 LYS HG2 147 LYS HB3 3.00  (# 0.0000 486:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=2182,2180, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 34 GLU HG2 34 GLU HB3 3.00  (# 0.0000 488:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 481, 479, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 36 LEU QD2 34 GLU HB3 4.50  (# 0.9986 489:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 479, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 516, 517, 518,
 &end
#
# 34 GLU HG2 34 GLU HB2 3.00  (# 0.0000 491:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 481, 478, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 116 GLN HB3 116 GLN HG2 3.00  (# 0.0000 495:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1693,1695, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 52 VAL QG1 52 VAL HB 3.00  (# 0.9474 496:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 754, 755, 756,
 &end
#
# 52 VAL QG2 52 VAL HB 3.00  (# 0.9923 497:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 758, 759, 760,
 &end
#
# 52 VAL QG1 52 VAL HB 3.00  (# 0.9474 498:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 754, 755, 756,
 &end
#
# 104 LYS HA 104 LYS HB2 3.50  (# 0.9982 499:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1504,1506, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 116 GLN HB2 116 GLN HG3 3.20  (# 0.9796 502:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1696, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 122 LYS HG2 131 PRO HB2 4.00  (# 0.9797 513:20 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1781,1934, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 83 VAL QG1 83 VAL HB 3.00  (# 0.9940 514:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1203,1204,1205,
 &end
#
# 119 GLU HG2 119 GLU HB3 3.00  (# 0.0000 519:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1733,1731, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 83 VAL QG2 83 VAL HB 3.00  (# 0.9950 521:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1207,1208,1209,
 &end
#
# 143 VAL HA 143 VAL HB 3.50  (# 0.0000 527:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,2111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 18 VAL QG2 18 VAL HB 3.00  (# 0.9292 534:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 246, 247, 248,
 &end
#
# 75 GLU HA 75 GLU HB3 3.00  (# 0.9350 538:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1079,1082, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 138 TRP HA 138 TRP HB2 3.20  (# 0.9884 549:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2024,2026, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 121 LEU HG 138 TRP HB2 3.00  (# 0.9984 550:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1762,2026, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 121 LEU HG 138 TRP HB2 3.00  (# 0.9984 551:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1762,2026, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 94 GLU HA 94 GLU HB2 3.00  (# 0.0000 553:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1365, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 106 GLU HA 106 GLU HB2 3.20  (# 0.9980 559:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1547, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 106 GLU HB2 110 LYS HD2 4.00  (# 0.9759 572:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=1547,1612, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 24 GLU HG2 24 GLU HB2 3.00  (# 0.9636 574:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 330, 327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 24 GLU HA 24 GLU HB2 3.00  (# 0.9790 575:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 325, 327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 147 LYS HE2 147 LYS HD2 3.00  (# 0.9404 577:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=2188,2185, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 71 GLU HG2 71 GLU HB2 3.00  (# 0.9982 579:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1020, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 24 GLU HA 24 GLU HB2 3.20  (# 0.9790 584:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 325, 327, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 77 LYS HG3 77 LYS HD3 3.00  (# 0.9893 588:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1117,1120, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20 GLU HA 20 GLU HB3 3.20  (# 0.9394 589:20 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 267, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 77 LYS HE2 77 LYS HD2 3.00  (# 0.9876 594:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1122,1119, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 23 ALA HA 6 LEU QD1 5.00  (# 0.9627 595:20 2.71,)
 &rst
  ixpk= 0, nxpk= 0, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=  85,  86,  87,
 &end
#
# 6 LEU HG 6 LEU QD1 3.00  (# 0.9333 597:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=  85,  86,  87,
 &end
#
# 90 ILE QD1 90 ILE HG12 3.00  (# 0.9780 612:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1313,1314,1315,
 &end
#
# 139 LEU HA 142 TRP HB2 4.50  (# 0.9639 613:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=2048,2087, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 90 ILE HB 90 ILE HG12 3.00  (# 0.9971 617:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=1304,1310, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HA 142 TRP HB2 3.00  (# 0.0000 618:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2087, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HD2 45 PRO HG2 3.00  (# 0.0000 619:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 645, 648, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 139 LEU HA 142 TRP HB3 4.00  (# 0.9639 621:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=2048,2088, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 4 ILE QD1 4 ILE HG12 3.00  (# 0.0000 623:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=  56,  57,  58,
 &end
#
# 45 PRO HD2 45 PRO HG3 3.00  (# 0.0000 624:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 645, 649, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HD3 45 PRO HG3 3.00  (# 0.0000 625:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 649, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HD3 45 PRO HG2 3.00  (# 0.0000 627:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 648, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4 ILE QD1 4 ILE HG12 3.00  (# 0.9632 630:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=  56,  57,  58,
 &end
#
# 7 ILE QD1 7 ILE HG12 3.00  (# 0.0000 631:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 108, 109, 110,
 &end
#
# 7 ILE QD1 7 ILE HG12 3.00  (# 0.0000 636:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 108, 109, 110,
 &end
#
# 53 ILE HB 53 ILE HG12 3.20  (# 0.9744 639:20 2.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 768, 774, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 7 ILE QD1 7 ILE HG12 3.00  (# 0.0000 642:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 108, 109, 110,
 &end
#
# 7 ILE HB 7 ILE HG12 3.10  (# 0.9932 643:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99, 105, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 41 LEU QD2 41 LEU HG 3.00  (# 0.9739 647:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 592, 593, 594,
 &end
#
# 36 LEU HB3 36 LEU HG 3.20  (# 0.9598 649:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 510, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU QD1 51 LEU HG 3.00  (# 0.9961 650:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 738, 739, 740,
 &end
#
# 78 PRO HB3 78 PRO HG2 3.00  (# 0.9530 656:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1135, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 25 LYS HA 25 LYS HD2 3.50  (# 0.9962 663:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 348, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS HG3 25 LYS HD2 3.00  (# 0.9917 665:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 348, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 88 ILE QD1 53 ILE HG12 3.80  (# 0.9995 667:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 774, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1287,1288,1289,
 &end
#
# 36 LEU HB3 36 LEU HG 3.20  (# 0.9954 668:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 510, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 110 LYS HD2 110 LYS HG2 3.00  (# 0.0000 677:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1612,1609, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 40 LEU HB3 40 LEU HG 3.30  (# 0.9988 682:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 567, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 40 LEU QD1 40 LEU HG 3.00  (# 0.0000 683:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 569, 570, 571,
 &end
#
# 40 LEU HB2 40 LEU HG 3.40  (# 0.0000 684:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 564, 567, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 109 LEU QD1 109 LEU HG 3.00  (# 0.9952 699:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1592,1593,1594,
 &end
#
# 105 LEU HB2 105 LEU QD1 4.00  (# 0.9673 702:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1533,1534,1535,
 &end
#
# 109 LEU HG 105 LEU QD1 4.00  (# 0.9624 707:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1533,1534,1535,
 &end
#
# 109 LEU QD2 109 LEU HG 3.00  (# 0.0000 709:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1596,1597,1598,
 &end
#
# 44 LEU QD2 44 LEU HG 3.00  (# 0.0000 710:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 638, 639, 640,
 &end
#
# 43 ASP HB2 36 LEU QD1 4.00  (# 0.0000 713:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 617,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 512, 513, 514,
 &end
#
# 44 LEU HG 44 LEU QD2 3.00  (# 0.0000 715:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 638, 639, 640,
 &end
#
# 44 LEU HB3 44 LEU QD2 3.80  (# 0.9796 716:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 630,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 638, 639, 640,
 &end
#
# 104 LYS HB2 104 LYS HG2 3.00  (# 0.0000 718:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1506,1509, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 34 GLU HB2 36 LEU QD1 4.50  (# 0.9609 723:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 512, 513, 514,
 &end
#
# 36 LEU HB2 36 LEU QD1 3.50  (# 0.9922 724:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 507,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 512, 513, 514,
 &end
#
# 36 LEU HB3 36 LEU QD1 3.50  (# 0.0000 725:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 512, 513, 514,
 &end
#
# 44 LEU HB2 44 LEU QD2 4.00  (# 0.9986 728:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 629,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 638, 639, 640,
 &end
#
# 104 LYS HB2 104 LYS HG2 3.00  (# 0.0000 730:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1506,1509, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 73 LEU QD2 73 LEU HG 3.00  (# 0.0000 736:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1048, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1054,1055,1056,
 &end
#
# 105 LEU HG 105 LEU QD1 3.00  (# 0.9765 743:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1533,1534,1535,
 &end
#
# 41 LEU HB2 41 LEU QD1 4.00  (# 0.9991 746:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat= 583,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 588, 589, 590,
 &end
#
# 70 TYR HA 73 LEU QD2 5.00  (# 0.9977 749:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1054,1055,1056,
 &end
#
# 73 LEU HB2 73 LEU QD2 4.00  (# 0.9852 750:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1045,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1054,1055,1056,
 &end
#
# 73 LEU HG 73 LEU QD2 3.00  (# 0.9585 751:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1054,1055,1056,
 &end
#
# 73 LEU HB3 73 LEU QD2 4.00  (# 0.0000 756:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1054,1055,1056,
 &end
#
# 121 LEU QD2 121 LEU HG 3.00  (# 0.9224 759:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1768,1769,1770,
 &end
#
# 138 TRP HB2 121 LEU HG 3.00  (# 0.0000 761:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=2026,1762, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 121 LEU QD1 121 LEU HG 3.00  (# 0.9834 762:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1764,1765,1766,
 &end
#
# 121 LEU HB3 121 LEU HG 3.50  (# 0.9650 764:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat=1760,1762, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 88 ILE QD1 88 ILE HG12 3.50  (# 0.0000 781:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1287,1288,1289,
 &end
#
# 51 LEU HB2 51 LEU QD1 4.00  (# 0.9412 782:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 738, 739, 740,
 &end
#
# 51 LEU HG 51 LEU QD1 3.00  (# 0.9381 784:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 738, 739, 740,
 &end
#
# 147 LYS HD2 147 LYS HG2 3.20  (# 0.9992 789:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2185,2182, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 146 LEU QD1 146 LEU HG 3.20  (# 0.0000 791:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2163, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=2165,2166,2167,
 &end
#
# 88 ILE QD1 88 ILE HG12 3.20  (# 0.9024 792:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=1287,1288,1289,
 &end
#
# 109 LEU HG 109 LEU QD2 3.00  (# 0.0000 795:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1596,1597,1598,
 &end
#
# 109 LEU HB2 109 LEU QD2 4.00  (# 0.9618 796:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1587,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1596,1597,1598,
 &end
#
# 109 LEU HB3 109 LEU QD2 4.00  (# 0.0000 799:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1588,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1596,1597,1598,
 &end
#
# 146 LEU QD2 146 LEU HG 3.00  (# 0.0000 801:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2163, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=2169,2170,2171,
 &end
#
# 109 LEU HG 109 LEU QD1 3.00  (# 0.0000 806:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1592,1593,1594,
 &end
#
# 109 LEU HB2 109 LEU QD1 4.00  (# 0.9618 807:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1587,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1592,1593,1594,
 &end
#
# 146 LEU HB3 146 LEU QD2 4.00  (# 0.9692 812:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=2161,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2169,2170,2171,
 &end
#
# 77 LYS HD3 77 LYS HG2 3.00  (# 0.0000 815:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1120,1116, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 77 LYS HD3 77 LYS HG3 3.00  (# 0.0000 816:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1120,1117, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 73 LEU HA 73 LEU QD1 4.20  (# 0.9347 818:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1050,1051,1052,
 &end
#
# 73 LEU HB3 73 LEU QD1 4.00  (# 0.0000 820:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1050,1051,1052,
 &end
#
# 143 VAL HA 146 LEU QD2 4.50  (# 0.0000 824:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2169,2170,2171,
 &end
#
# 77 LYS HB2 77 LYS HG2 3.00  (# 0.9932 825:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1113,1116, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 77 LYS HB2 77 LYS HG3 3.50  (# 0.9932 826:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1113,1117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HB2 73 LEU QD1 4.00  (# 0.9503 827:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1045,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1050,1051,1052,
 &end
#
# 73 LEU HG 73 LEU QD1 3.20  (# 0.9585 828:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=1050,1051,1052,
 &end
#
# 146 LEU HB2 146 LEU QD2 4.00  (# 0.0000 833:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=2160,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2169,2170,2171,
 &end
#
# 70 TYR HB3 105 LEU QD2 6.50  (# 0.0000 838:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1000,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1537,1538,1539,
 &end
#
# 105 LEU HG 105 LEU QD2 3.00  (# 0.9775 839:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1537,1538,1539,
 &end
#
# 105 LEU HB3 105 LEU QD2 4.00  (# 0.0000 840:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1537,1538,1539,
 &end
#
# 25 LYS HA 25 LYS HG2 4.00  (# 0.9988 844:20 2.45,)
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 345, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HB3 25 LYS HG3 3.00  (# 0.9987 845:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 346, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HD2 44 LEU QD1 5.00  (# 0.0000 846:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat= 645,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 634, 635, 636,
 &end
#
# 25 LYS HD2 25 LYS HG3 3.00  (# 0.0000 850:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 346, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HD3 44 LEU QD1 5.00  (# 0.0000 855:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 634, 635, 636,
 &end
#
# 44 LEU HG 44 LEU QD1 3.30  (# 0.0000 857:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 634, 635, 636,
 &end
#
# 44 LEU HB3 44 LEU QD1 4.00  (# 0.0000 858:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 630,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 634, 635, 636,
 &end
#
# 41 LEU HG 41 LEU QD2 3.00  (# 0.9843 865:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 592, 593, 594,
 &end
#
# 12 LEU HG 12 LEU QD2 3.00  (# 0.9129 869:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 170, 171, 172,
 &end
#
# 41 LEU HB2 41 LEU QD2 3.50  (# 0.9991 870:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat= 583,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 592, 593, 594,
 &end
#
# 34 GLU HG3 36 LEU QD2 6.50  (# 0.9098 876:20 3.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 516, 517, 518,
 &end
#
# 36 LEU HB2 36 LEU QD2 4.00  (# 0.0000 878:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 507,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 516, 517, 518,
 &end
#
# 36 LEU HG 36 LEU QD2 3.00  (# 0.9349 879:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 516, 517, 518,
 &end
#
# 36 LEU HB3 36 LEU QD2 4.00  (# 0.9071 880:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 516, 517, 518,
 &end
#
# 120 THR HB 120 THR QG2 3.00  (# 0.9934 883:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1745,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1747,1748,1749,
 &end
#
# 93 ARG HG2 120 THR QG2 6.00  (# 0.9176 886:20 3.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1747,1748,1749,
 &end
#
# 18 VAL HA 18 VAL QG1 4.00  (# 0.0000 887:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 242, 243, 244,
 &end
#
# 33 THR HB 33 THR QG2 3.00  (# 0.9991 891:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 466, 467, 468,
 &end
#
# 26 LEU HB2 33 THR QG2 4.00  (# 0.9987 893:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 466, 467, 468,
 &end
#
# 4 ILE HB 33 THR QG2 3.50  (# 0.9988 894:20 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 466, 467, 468,
 &end
#
# 117 THR HB 117 THR QG2 3.00  (# 0.0000 896:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1709,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1711,1712,1713,
 &end
#
# 40 LEU HB2 40 LEU QD2 4.00  (# 0.9952 904:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat= 564,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 573, 574, 575,
 &end
#
# 51 LEU HG 51 LEU QD2 3.00  (# 0.0000 907:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 742, 743, 744,
 &end
#
# 51 LEU HB2 51 LEU QD2 4.00  (# 0.9412 911:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 742, 743, 744,
 &end
#
# 147 LYS HD2 143 VAL QG2 6.00  (# 0.9560 915:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2117,2118,2119,
 &end
#
# 143 VAL HA 143 VAL QG2 4.00  (# 0.0000 916:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2117,2118,2119,
 &end
#
# 143 VAL HB 143 VAL QG2 3.00  (# 0.9987 917:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=2117,2118,2119,
 &end
#
# 138 TRP HB2 121 LEU QD1 4.50  (# 0.9224 929:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=2026,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1764,1765,1766,
 &end
#
# 143 VAL HA 143 VAL QG1 4.00  (# 0.0000 938:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2113,2114,2115,
 &end
#
# 143 VAL HB 143 VAL QG1 3.00  (# 0.9987 939:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=2113,2114,2115,
 &end
#
# 29 ALA QB 143 VAL QG1 4.50  (# 0.9988 940:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 413, 414, 415,
 igr2=2113,2114,2115,
 &end
#
# 20 GLU HG2 35 THR QG2 6.00  (# 0.0000 944:20 3.52,)
 &rst
  ixpk= 0, nxpk= 0, iat= 269,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 495, 496, 497,
 &end
#
# 78 PRO HB3 80 LEU QD1 5.00  (# 0.9827 950:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1166,1167,1168,
 &end
#
# 35 THR HB 35 THR QG2 3.00  (# 0.9194 951:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 495, 496, 497,
 &end
#
# 6 LEU HB2 35 THR QG2 5.00  (# 0.9580 952:20 3.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 495, 496, 497,
 &end
#
# 78 PRO HG2 80 LEU QD1 4.20  (# 0.0000 957:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1135,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1166,1167,1168,
 &end
#
# 80 LEU HB2 80 LEU QD1 4.00  (# 0.0000 959:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1161,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1166,1167,1168,
 &end
#
# 52 VAL HB 52 VAL QG2 3.00  (# 0.9960 963:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 758, 759, 760,
 &end
#
# 52 VAL HB 52 VAL QG1 3.30  (# 0.0000 965:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 754, 755, 756,
 &end
#
# 18 VAL HB 18 VAL QG2 3.00  (# 0.0000 969:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 246, 247, 248,
 &end
#
# 146 LEU HB2 146 LEU QD1 4.00  (# 0.0000 973:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=2160,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2165,2166,2167,
 &end
#
# 18 VAL HA 18 VAL QG2 4.00  (# 0.0000 976:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 246, 247, 248,
 &end
#
# 83 VAL HB 83 VAL QG1 3.00  (# 0.9584 977:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1201,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1203,1204,1205,
 &end
#
# 146 LEU HB3 146 LEU QD1 4.00  (# 0.9030 981:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=2161,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2165,2166,2167,
 &end
#
# 2 ALA HA 2 ALA QB 3.00  (# 0.9963 990:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=  25,  26,  27,
 &end
#
# 49 ILE HB 49 ILE QG2 3.00  (# 0.0000 992:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 692, 693, 694,
 &end
#
# 49 ILE HG12 49 ILE QG2 4.00  (# 0.9240 993:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 692, 693, 694,
 &end
#
# 34 GLU HG2 2 ALA QB 4.00  (# 0.9993 998:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat= 481,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  25,  26,  27,
 &end
#
# 80 LEU QD1 83 VAL QG2 6.00  (# 0.9570 1001:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=1166,1167,1168,
 igr2=1207,1208,1209,
 &end
#
# 83 VAL HB 83 VAL QG2 3.00  (# 0.9702 1010:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1201,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1207,1208,1209,
 &end
#
# 131 PRO HD3 130 ILE QG2 4.00  (# 0.0000 1034:20 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1929,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1914,1915,1916,
 &end
#
# 130 ILE HG12 130 ILE QG2 4.00  (# 0.9935 1035:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1918,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1914,1915,1916,
 &end
#
# 19 ALA HA 19 ALA QB 3.00  (# 0.9645 1038:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 256, 257, 258,
 &end
#
# 130 ILE HB 130 ILE QG2 3.00  (# 0.0000 1041:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1914,1915,1916,
 &end
#
# 130 ILE HG12 130 ILE QG2 4.00  (# 0.0000 1042:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1918,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1914,1915,1916,
 &end
#
# 53 ILE HB 53 ILE QG2 3.00  (# 0.0000 1050:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 770, 771, 772,
 &end
#
# 88 ILE QG2 53 ILE QG2 4.00  (# 0.9997 1053:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1280,1281,1282,
 igr2= 770, 771, 772,
 &end
#
# 4 ILE HG12 4 ILE QG2 4.00  (# 0.9649 1054:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  49,  50,  51,
 &end
#
# 123 ILE HG12 123 ILE QG2 3.50  (# 0.9977 1056:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1806,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1802,1803,1804,
 &end
#
# 123 ILE HB 123 ILE QG2 3.00  (# 0.9912 1061:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1802,1803,1804,
 &end
#
# 7 ILE HB 7 ILE QG2 3.00  (# 0.9991 1062:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 101, 102, 103,
 &end
#
# 53 ILE HB 53 ILE QD1 3.50  (# 0.0000 1076:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 777, 778, 779,
 &end
#
# 22 LEU HB2 53 ILE QD1 5.00  (# 0.9499 1078:20 3.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 777, 778, 779,
 &end
#
# 7 ILE HB 7 ILE QD1 3.50  (# 0.9942 1083:20 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 108, 109, 110,
 &end
#
# 90 ILE HB 90 ILE QD1 4.20  (# 0.9639 1087:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1313,1314,1315,
 &end
#
# 88 ILE HG12 88 ILE QD1 3.00  (# 0.9684 1091:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1287,1288,1289,
 &end
#
# 53 ILE HG12 88 ILE QD1 4.00  (# 0.9971 1098:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1287,1288,1289,
 &end
#
# 123 ILE HB 123 ILE QD1 4.00  (# 0.9938 1104:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1809,1810,1811,
 &end
#
# 4 ILE HG12 4 ILE QD1 3.20  (# 0.9982 1109:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=  56,  57,  58,
 &end
#
# 31 PHE HB2 4 ILE QD1 5.00  (# 0.0000 1110:20 3.20,)
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=  56,  57,  58,
 &end
#
# 130 ILE HG12 130 ILE QD1 3.00  (# 0.0000 1112:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1918,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1921,1922,1923,
 &end
#
# 130 ILE HG12 130 ILE QD1 3.00  (# 0.0000 1113:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1918,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1921,1922,1923,
 &end
#
# 117 THR HA 117 THR HB 3.50  (# 0.0000 1115:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat=1707,1709, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 THR HN 117 THR HB 3.00  (# 0.0000 1116:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1705,1709, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 84 ARG HE 117 THR HB 3.00  (# 0.0000 1117:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=1226,1709, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 143 VAL HN 143 VAL HA 3.20  (# 0.0000 1118:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2109, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 73 LEU HN 73 LEU HA 3.50  (# 0.9808 1121:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 THR HN 116 GLN HA 2.80  (# 0.0000 1122:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1705,1690, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 77 LYS HN 78 PRO HD3 3.50  (# 0.0000 1124:20 2.63,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 67 SER HN 68 PRO HD3 3.00  (# 0.9983 1126:20 1.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 963, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 LEU HA 45 PRO HD3 3.00  (# 0.9915 1127:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 627, 646, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 85 PHE HA 85 PHE HB2 3.20  (# 0.9956 1133:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1239,1241, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 85 PHE HA 85 PHE HB3 3.20  (# 0.9956 1137:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1239,1242, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 146 LEU HN 146 LEU HB3 3.50  (# 0.9977 1144:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 139 LEU HN 139 LEU HB3 3.50  (# 0.9674 1145:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2051, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 146 LEU HN 146 LEU HB2 3.50  (# 0.9977 1146:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2160, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 THR HN 3 ASP HB2 3.50  (# 0.0000 1149:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 42 GLU HN 41 LEU HB2 4.50  (# 0.9843 1152:20 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 583, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 145 LEU HN 145 LEU HB3 3.50  (# 0.9843 1153:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2142, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 145 LEU HA 145 LEU HB2 3.50  (# 0.9244 1155:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=2139,2141, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 3 ASP HA 3 ASP HB2 3.50  (# 0.0000 1156:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  33,  35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HN 3 ASP HB2 4.00  (# 0.0000 1157:20 3.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  35, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 3 ASP HA 3 ASP HB3 3.50  (# 0.9028 1158:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  33,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU HN 41 LEU HB2 4.00  (# 0.9344 1160:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 583, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 44 LEU HA 44 LEU HB2 3.50  (# 0.9820 1161:20 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat= 627, 629, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 44 LEU HN 44 LEU HB2 3.50  (# 0.9992 1162:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 629, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 12 LEU HA 12 LEU HB2 3.50  (# 0.9912 1163:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 159, 161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU HN 41 LEU HB3 4.00  (# 0.0000 1166:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 584, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 44 LEU HA 44 LEU HB3 3.50  (# 0.9820 1168:20 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat= 627, 630, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 43 ASP HA 43 ASP HB2 3.50  (# 0.9881 1169:20 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 617, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 40 LEU HN 40 LEU HB2 4.00  (# 0.0000 1171:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 564, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 43 ASP HN 43 ASP HB2 3.20  (# 0.0000 1172:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 613, 617, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 52 VAL HA 7 ILE HB 3.00  (# 0.0000 1175:20 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat= 750,  99, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 96 ASP HA 96 ASP HB2 3.20  (# 0.0000 1176:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1401, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 31 PHE HA 31 PHE HB2 3.00  (# 0.9906 1177:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 430, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 64 ASP HA 64 ASP HB2 3.20  (# 0.9973 1180:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 907, 909, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 80 LEU HA 80 LEU HB2 3.20  (# 0.9764 1182:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1159,1161, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 70 TYR QD 70 TYR HB3 3.50  (# 0.0000 1184:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1003,1012,
 &end
#
# 70 TYR HN 70 TYR HB3 3.00  (# 0.9996 1185:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995,1000, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 79 ASP HN 79 ASP HB2 3.20  (# 0.9981 1186:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1145,1149, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 79 ASP HN 79 ASP HB3 3.20  (# 0.0000 1187:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1145,1150, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 79 ASP HA 79 ASP HB3 3.20  (# 0.9973 1188:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1150, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 70 TYR QD 70 TYR HB2 3.80  (# 0.0000 1189:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 999, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=1003,1012,
 &end
#
# 79 ASP HN 79 ASP HB3 3.20  (# 0.0000 1191:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1145,1150, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 49 ILE HN 49 ILE HB 3.50  (# 0.9928 1193:20 2.87,)
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 TYR HN 70 TYR HB2 3.20  (# 0.9996 1194:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 999, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 4 ILE HA 49 ILE HB 4.00  (# 0.9926 1196:20 3.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45, 690, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 69 PHE HA 69 PHE HB2 3.50  (# 0.9958 1197:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat= 977, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 PHE HN 69 PHE HB3 3.50  (# 0.0000 1198:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 TYR HN 69 PHE HB3 3.50  (# 0.0000 1199:20 1.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 111 ASN HN 111 ASN HB3 3.20  (# 0.0000 1205:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1629, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 111 ASN HN 111 ASN HB2 3.00  (# 0.0000 1207:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1628, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 108 GLU HA 111 ASN HB2 4.00  (# 0.0000 1209:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1628, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 112 SER HN 111 ASN HB3 4.50  (# 0.9894 1211:20 3.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1629, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 108 GLU HA 111 ASN HB3 4.20  (# 0.0000 1212:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1629, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 71 GLU HN 71 GLU HG2 3.50  (# 0.0000 1216:20 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1023, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 65 ASN HA 65 ASN HB3 3.50  (# 0.0000 1217:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 922, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 65 ASN HA 65 ASN HB2 3.50  (# 0.0000 1219:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 921, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 27 GLU HA 27 GLU HG3 3.50  (# 0.9979 1220:20 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 387, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 27 GLU HN 27 GLU HG2 4.00  (# 0.0000 1222:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 386, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 27 GLU HA 27 GLU HG2 3.50  (# 0.9979 1223:20 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 386, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 GLU HN 28 GLU HG2 4.00  (# 0.0000 1225:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 401, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 108 GLU HN 108 GLU HG2 4.00  (# 0.9942 1226:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1575, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 74 GLN HE21 108 GLU HG2 4.00  (# 0.0000 1227:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1072,1575, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 74 GLN HE21 108 GLU HG3 4.00  (# 0.0000 1229:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1072,1576, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 108 GLU HA 108 GLU HG2 4.00  (# 0.9975 1231:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1575, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 119 GLU HN 119 GLU HG2 3.50  (# 0.0000 1232:20 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1726,1733, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 GLU HN 75 GLU HG3 5.00  (# 0.0000 1236:20 3.68,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1085, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 34 GLU HA 34 GLU HG3 3.50  (# 0.9849 1239:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 482, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 34 GLU HA 34 GLU HG2 3.50  (# 0.9940 1240:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 481, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HE22 76 GLN HG2 3.50  (# 0.0000 1242:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HN 76 GLN HG2 3.50  (# 0.0000 1243:20 1.79,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HE22 76 GLN HG3 3.50  (# 0.0000 1246:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1100, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HN 76 GLN HG3 3.50  (# 0.0000 1247:20 1.79,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1100, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 74 GLN HG3 3.00  (# 0.0000 1248:20 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1068, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 115 LYS HA 115 LYS HB2 3.00  (# 0.9912 1250:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1668,1670, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 147 LYS HN 147 LYS HB2 3.20  (# 0.0000 1251:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2175,2179, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 84 ARG HA 84 ARG HB2 3.00  (# 0.0000 1252:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1215,1217, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 34 GLU HA 34 GLU HB3 3.20  (# 0.9851 1253:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 479, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 34 GLU HA 34 GLU HB2 3.50  (# 0.9930 1254:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 478, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 85 PHE HA 50 TRP HB2 3.50  (# 0.9332 1255:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1239, 709, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 85 PHE HA 50 TRP HB3 3.50  (# 0.9332 1256:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1239, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 52 VAL HN 52 VAL HB 4.00  (# 0.0000 1257:20 3.09,)
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 752, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 78 PRO HA 78 PRO HB3 3.00  (# 0.9996 1259:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1141,1139, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 119 GLU HA 119 GLU HB2 3.00  (# 0.9961 1261:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1730, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 39 PRO HA 39 PRO HB2 3.20  (# 0.0000 1266:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 553, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 119 GLU HN 119 GLU HB3 4.00  (# 0.0000 1269:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat=1726,1731, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 39 PRO HA 39 PRO HB2 3.00  (# 0.0000 1270:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 553, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HA 45 PRO HB2 3.00  (# 0.9988 1273:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 651, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HA 45 PRO HB3 3.00  (# 0.9988 1274:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 652, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 143 VAL HN 143 VAL HB 3.00  (# 0.0000 1276:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HE3 143 VAL HB 4.50  (# 0.9192 1277:20 3.66,)
 &rst
  ixpk= 0, nxpk= 0, iat=2102,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 72 ALA HA 75 GLU HB3 3.00  (# 0.9990 1278:20 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1082, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 76 GLN HN 75 GLU HB3 4.00  (# 0.0000 1281:20 2.45,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1082, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 75 GLU HN 75 GLU HB3 3.20  (# 0.9954 1282:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1082, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 76 GLN HN 75 GLU HB2 4.00  (# 0.0000 1283:20 2.45,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1081, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 75 GLU HN 75 GLU HB2 3.20  (# 0.9258 1284:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1081, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 72 ALA HA 75 GLU HB2 3.00  (# 0.9990 1285:20 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1081, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 18 VAL HN 18 VAL HB 3.00  (# 0.9885 1287:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 68 PRO HA 68 PRO HB2 3.20  (# 0.9813 1288:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 968, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 138 TRP HA 138 TRP HB2 3.50  (# 0.9884 1289:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2024,2026, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 77 LYS HA 77 LYS HB2 3.50  (# 0.9971 1290:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1113, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 138 TRP HN 138 TRP HB2 3.50  (# 0.9894 1291:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2022,2026, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 106 GLU HN 106 GLU HB2 3.50  (# 0.0000 1293:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1547, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 107 ALA HN 106 GLU HB2 4.00  (# 0.0000 1294:20 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1547, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 74 GLN HN 74 GLN HB3 4.00  (# 0.9840 1296:20 2.68,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1065, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 94 GLU HN 93 ARG HB3 4.00  (# 0.9221 1297:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1361,1342, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 21 HIS HA 24 GLU HB3 4.00  (# 0.9217 1299:20 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 328, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 28 GLU HN 28 GLU HB3 3.50  (# 0.9988 1300:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS HN 24 GLU HB3 3.50  (# 0.9475 1301:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 328, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 GLU HN 24 GLU HB2 3.00  (# 0.0000 1304:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 25 LYS HN 24 GLU HB2 3.50  (# 0.0000 1305:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 327, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 GLU HN 108 GLU HB3 3.50  (# 0.9832 1306:20 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1573, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 GLU HA 108 GLU HB3 3.50  (# 0.0000 1307:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1573, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 GLU HN 108 GLU HB2 3.50  (# 0.9867 1308:20 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 GLU HA 108 GLU HB2 3.50  (# 0.9787 1309:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 GLU HN 28 GLU HB3 3.50  (# 0.9988 1310:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 GLU HN 24 GLU HB3 3.00  (# 0.9986 1311:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 328, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 72 ALA HN 71 GLU HB2 3.50  (# 0.9818 1312:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1020, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 HIS HN 21 HIS HB3 3.50  (# 0.0000 1315:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HN 76 GLN HB2 4.00  (# 0.9967 1316:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1096, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 6 LEU HA 6 LEU QD1 3.50  (# 0.9988 1317:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  85,  86,  87,
 &end
#
# 76 GLN HN 76 GLN HB3 4.00  (# 0.0000 1320:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1097, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 76 GLN HA 76 GLN HB3 3.00  (# 0.9322 1321:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=1094,1097, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 112 SER HA 77 LYS HD2 4.50  (# 0.0000 1322:20 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=1640,1119, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 GLU HN 27 GLU HB3 3.50  (# 0.0000 1324:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 27 GLU HA 27 GLU HB3 3.50  (# 0.9959 1325:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 27 GLU HN 27 GLU HB2 3.50  (# 0.0000 1327:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 116 GLN HN 116 GLN HB2 3.00  (# 0.0000 1328:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1688,1692, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 143 VAL HN 142 TRP HB2 4.00  (# 0.0000 1330:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2087, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 142 TRP HE3 142 TRP HB2 4.00  (# 0.9931 1331:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=2102,2087, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 142 TRP HN 142 TRP HB3 3.00  (# 0.0000 1332:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2088, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 40 LEU HN 40 LEU HG 3.50  (# 0.0000 1334:20 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 110 LYS HA 110 LYS HG2 3.50  (# 0.9944 1335:20 2.69,)
 &rst
  ixpk= 0, nxpk= 0, iat=1604,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 145 LEU HA 145 LEU HG 3.00  (# 0.9720 1338:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=2139,2144, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12 LEU HA 12 LEU QD1 4.50  (# 0.9916 1350:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 166, 167, 168,
 &end
#
# 115 LYS HA 115 LYS HG3 4.50  (# 0.9778 1351:20 3.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=1668,1674, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 115 LYS HA 115 LYS HG2 4.50  (# 0.9778 1353:20 3.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=1668,1673, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LYS HA 77 LYS HG2 3.50  (# 0.9985 1357:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 77 LYS HA 77 LYS HG2 3.50  (# 0.0000 1358:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS HN 25 LYS HG2 3.50  (# 0.0000 1364:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 345, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 91 GLY HA2 120 THR QG2 6.00  (# 0.9844 1376:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=1321,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1747,1748,1749,
 &end
#
# 33 THR HA 33 THR QG2 4.00  (# 0.0000 1377:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 466, 467, 468,
 &end
#
# 33 THR HN 33 THR QG2 4.00  (# 0.0000 1382:20 2.78,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 466, 467, 468,
 &end
#
# 118 GLY HN 117 THR QG2 3.80  (# 0.0000 1383:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2=1711,1712,1713,
 &end
#
# 33 THR HN 32 THR QG2 5.00  (# 0.0000 1385:20 3.69,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 452, 453, 454,
 &end
#
# 51 LEU HA 51 LEU QD2 4.00  (# 0.0000 1395:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 742, 743, 744,
 &end
#
# 87 ALA HN 87 ALA QB 3.50  (# 0.0000 1398:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1264,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1268,1269,1270,
 &end
#
# 87 ALA HA 87 ALA QB 3.20  (# 0.0000 1400:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1266,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=1268,1269,1270,
 &end
#
# 11 THR HA 11 THR QG2 4.00  (# 0.0000 1401:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 149, 150, 151,
 &end
#
# 56 THR HA 56 THR QG2 4.00  (# 0.0000 1402:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 807,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 811, 812, 813,
 &end
#
# 88 ILE HN 87 ALA QB 4.50  (# 0.9202 1406:20 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1268,1269,1270,
 &end
#
# 120 THR HA 87 ALA QB 4.50  (# 0.9862 1407:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1743,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1268,1269,1270,
 &end
#
# 144 ASN HN 143 VAL QG1 5.00  (# 0.0000 1411:20 2.58,)
 &rst
  ixpk= 0, nxpk= 0, iat=2123,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2113,2114,2115,
 &end
#
# 36 LEU HN 35 THR QG2 4.50  (# 0.0000 1414:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 503,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 495, 496, 497,
 &end
#
# 97 THR HA 97 THR QG2 4.00  (# 0.0000 1416:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=1411,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1415,1416,1417,
 &end
#
# 114 ALA HN 80 LEU QD1 5.50  (# 0.9717 1420:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1656,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1166,1167,1168,
 &end
#
# 50 TRP HD1 5 THR QG2 4.00  (# 0.9710 1423:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  68,  69,  70,
 &end
#
# 52 VAL HA 52 VAL QG2 4.00  (# 0.9775 1424:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 758, 759, 760,
 &end
#
# 52 VAL HA 52 VAL QG1 4.00  (# 0.0000 1427:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 754, 755, 756,
 &end
#
# 34 GLU HN 2 ALA QB 4.50  (# 0.0000 1436:20 3.06,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  25,  26,  27,
 &end
#
# 33 THR HA 2 ALA QB 4.00  (# 0.0000 1437:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  25,  26,  27,
 &end
#
# 3 ASP HN 2 ALA QB 3.50  (# 0.9977 1439:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  25,  26,  27,
 &end
#
# 4 ILE HN 2 ALA QB 4.00  (# 0.0000 1440:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  25,  26,  27,
 &end
#
# 32 THR HB 2 ALA QB 4.00  (# 0.9608 1442:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  25,  26,  27,
 &end
#
# 49 ILE HA 49 ILE QG2 3.50  (# 0.0000 1444:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 692, 693, 694,
 &end
#
# 115 LYS HN 114 ALA QB 4.00  (# 0.9671 1447:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1666,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1660,1661,1662,
 &end
#
# 114 ALA HA 114 ALA QB 3.00  (# 0.9750 1450:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1660,1661,1662,
 &end
#
# 31 PHE HN 29 ALA QB 4.50  (# 0.0000 1457:20 3.01,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 413, 414, 415,
 &end
#
# 90 ILE HA 90 ILE QG2 4.00  (# 0.9995 1459:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=1302,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1306,1307,1308,
 &end
#
# 26 LEU HA 29 ALA QB 4.00  (# 0.0000 1464:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 413, 414, 415,
 &end
#
# 91 GLY HN 90 ILE QG2 4.50  (# 0.9528 1466:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1319,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1306,1307,1308,
 &end
#
# 82 ALA HA 82 ALA QB 3.00  (# 0.9739 1469:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1191,1192,1193,
 &end
#
# 108 GLU HN 107 ALA QB 4.00  (# 0.0000 1472:20 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1562,1563,1564,
 &end
#
# 130 ILE HA 130 ILE QG2 4.00  (# 0.9788 1476:20 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat=1910,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1914,1915,1916,
 &end
#
# 80 LEU HA 46 ALA QB 4.20  (# 0.9841 1478:20 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 662, 663, 664,
 &end
#
# 46 ALA HA 46 ALA QB 3.00  (# 0.9983 1479:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat= 660,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 662, 663, 664,
 &end
#
# 24 GLU HN 23 ALA QB 4.00  (# 0.0000 1481:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 317, 318, 319,
 &end
#
# 53 ILE HA 53 ILE QG2 3.50  (# 0.9997 1483:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 770, 771, 772,
 &end
#
# 5 THR HN 4 ILE QG2 4.00  (# 0.0000 1484:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  49,  50,  51,
 &end
#
# 4 ILE HA 4 ILE QG2 4.00  (# 0.9030 1486:20 2.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  49,  50,  51,
 &end
#
# 123 ILE HA 123 ILE QG2 3.50  (# 0.0000 1488:20 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=1798,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1802,1803,1804,
 &end
#
# 7 ILE HA 7 ILE QG2 3.50  (# 0.9972 1489:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  97,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 101, 102, 103,
 &end
#
# 88 ILE HA 88 ILE QG2 3.50  (# 0.0000 1492:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1276,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1280,1281,1282,
 &end
#
# 49 ILE HA 49 ILE QD1 4.00  (# 0.0000 1496:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 699, 700, 701,
 &end
#
# 34 GLU HN 33 THR HB 3.00  (# 0.9983 1501:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 464, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 33 THR HN 32 THR HB 3.20  (# 0.0000 1502:20 2.83,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 450, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 5 THR HN 5 THR HB 3.20  (# 0.9974 1503:20 2.66,)
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  66, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 120 THR HN 120 THR HB 3.00  (# 0.0000 1504:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1745, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 35 THR HN 35 THR HB 3.50  (# 0.0000 1505:20 2.78,)
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 493, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 112 SER HN 112 SER HB2 4.00  (# 0.9412 1509:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1642, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 112 SER HN 112 SER HB3 4.00  (# 0.9412 1510:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1643, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 121 LEU HN 120 THR HA 2.80  (# 0.9949 1512:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1755,1743, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 132 GLU HN 131 PRO HA 4.00  (# 0.0000 1513:20 3.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1941,1937, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 81 SER HN 81 SER HB3 3.20  (# 0.9995 1515:20 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat=1176,1181, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 141 SER HN 141 SER HB3 3.20  (# 0.0000 1516:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2077, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 141 SER HN 141 SER HB2 3.20  (# 0.0000 1517:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2076, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 142 TRP HN 142 TRP HA 3.50  (# 0.0000 1518:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2085, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 79 ASP HN 78 PRO HA 3.20  (# 0.0000 1519:20 2.33,)
 &rst
  ixpk= 0, nxpk= 0, iat=1145,1141, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 118 GLY HN 117 THR HA 3.00  (# 0.0000 1520:20 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1719,1707, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 48 GLY HN 83 VAL HA 2.80  (# 0.9226 1521:20 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 679,1199, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 84 ARG HN 83 VAL HA 2.80  (# 0.9968 1522:20 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1213,1199, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 53 ILE HN 52 VAL HA 2.80  (# 0.9997 1523:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 764, 750, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 7 ILE HN 52 VAL HA 3.50  (# 0.9972 1524:20 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=  95, 750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 138 TRP HN 138 TRP HA 3.50  (# 0.9808 1525:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2022,2024, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 TYR QD 70 TYR HA 4.10  (# 0.9992 1528:20 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1003,1012,
 &end
#
# 124 ASN HN 123 ILE HA 2.80  (# 0.9865 1529:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1815,1798, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 141 SER HN 141 SER HA 3.50  (# 0.0000 1530:20 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2074, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 8 SER HN 7 ILE HA 2.80  (# 0.0000 1531:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  97, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 106 GLU HN 106 GLU HA 3.50  (# 0.9967 1532:20 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 110 LYS HN 110 LYS HA 3.50  (# 0.9408 1533:20 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1604, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 104 LYS HN 104 LYS HA 3.50  (# 0.0000 1534:20 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 GLU HN 28 GLU HA 3.50  (# 0.0000 1537:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 396, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 71 GLU HN 71 GLU HA 3.50  (# 0.0000 1538:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 29 ALA HN 28 GLU HA 4.00  (# 0.0000 1539:20 3.31,)
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 396, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 21 HIS HN 21 HIS HA 3.50  (# 0.0000 1540:20 2.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 279, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 GLU HN 74 GLN HA 4.00  (# 0.0000 1543:20 3.32,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1062, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 42 GLU HN 42 GLU HA 3.50  (# 0.9984 1544:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 600, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 GLU HN 75 GLU HA 3.50  (# 0.9766 1545:20 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1079, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 43 ASP HN 42 GLU HA 3.00  (# 0.9368 1546:20 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat= 613, 600, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HE3 139 LEU HA 3.00  (# 0.9995 1547:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=2102,2048, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 108 GLU HN 108 GLU HA 3.50  (# 0.9910 1548:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1570, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 111 ASN HD22 108 GLU HA 3.50  (# 0.0000 1549:20 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1634,1570, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 147 LYS HN 147 LYS HA 3.50  (# 0.0000 1550:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat=2175,2177, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 111 ASN HN 108 GLU HA 4.00  (# 0.0000 1551:20 3.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1570, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 3 ASP HN 3 ASP HA 3.50  (# 0.0000 1552:20 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  33, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HN 3 ASP HA 4.00  (# 0.0000 1553:20 3.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  33, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HN 25 LYS HA 3.50  (# 0.0000 1554:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 95 TYR HN 94 GLU HA 3.50  (# 0.9988 1555:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=1376,1363, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HN 76 GLN HA 3.50  (# 0.0000 1556:20 2.90,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1094, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 47 SER HN 47 SER HA 3.50  (# 0.0000 1557:20 2.85,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 670, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 48 GLY HN 47 SER HA 2.80  (# 0.9625 1558:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 679, 670, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 77 LYS HN 77 LYS HA 3.00  (# 0.0000 1559:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 35 THR HN 34 GLU HA 2.80  (# 0.9984 1560:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 476, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 144 ASN HN 144 ASN HA 3.50  (# 0.0000 1564:20 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2125, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 130 ILE HN 129 ASP HA 4.00  (# 0.0000 1565:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1908,1898, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 107 ALA HN 107 ALA HA 3.50  (# 0.0000 1567:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1560, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 43 ASP HN 43 ASP HA 3.50  (# 0.0000 1568:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 613, 615, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 146 LEU HN 146 LEU HA 3.50  (# 0.9986 1570:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2158, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 122 LYS HN 121 LEU HA 3.00  (# 0.9995 1573:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1774,1757, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 41 LEU HN 40 LEU HA 4.00  (# 0.0000 1574:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 562, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 40 LEU HN 40 LEU HA 3.50  (# 0.0000 1575:20 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 562, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 37 HIS HN 36 LEU HA 3.00  (# 0.0000 1576:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 522, 505, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 114 ALA HN 114 ALA HA 3.50  (# 0.9940 1578:20 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat=1656,1658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 29 ALA HN 29 ALA HA 3.50  (# 0.9764 1579:20 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 411, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 46 ALA HN 46 ALA HA 3.50  (# 0.0000 1581:20 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 660, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 47 SER HN 46 ALA HA 3.20  (# 0.0000 1583:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 660, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 3 ASP HN 2 ALA HA 3.20  (# 0.9989 1584:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  23, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 77 LYS HN 78 PRO HD2 3.80  (# 0.0000 1585:20 2.63,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1132, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 67 SER HN 68 PRO HD2 3.00  (# 0.9981 1586:20 1.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 962, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 140 GLY HN 140 GLY HA2 3.00  (# 0.0000 1588:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2067, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 140 GLY HN 140 GLY HA3 3.00  (# 0.0000 1589:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2068, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30 GLY HN 30 GLY HA2 3.50  (# 0.0000 1592:20 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 421, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 113 GLY HN 113 GLY HA2 3.50  (# 0.9908 1594:20 2.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1651, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 118 GLY HN 118 GLY HA2 3.20  (# 0.0000 1595:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1719,1721, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 119 GLU HN 118 GLY HA3 3.20  (# 0.0000 1596:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1726,1722, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 119 GLU HN 118 GLY HA2 3.50  (# 0.0000 1597:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1726,1721, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 118 GLY HN 118 GLY HA3 3.10  (# 0.0000 1598:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1719,1722, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 69 PHE HN 69 PHE HB2 3.20  (# 0.0000 1599:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 979, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 89 GLY HN 89 GLY HA3 3.50  (# 0.0000 1600:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 TRP HN 49 ILE QG2 4.00  (# 0.0000 1604:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 705,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 692, 693, 694,
 &end
#
# 89 GLY HN 88 ILE QG2 4.00  (# 0.0000 1605:20 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1280,1281,1282,
 &end
#
# 84 ARG HG2 49 ILE HA 5.00  (# 0.9847 1611:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=1220, 688, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 33 THR HB 33 THR HA 3.00  (# 0.0000 1612:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 462, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 49 ILE QD1 49 ILE HA 4.00  (# 0.9237 1614:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 699, 700, 701,
 &end
#
# 85 PHE HB2 85 PHE HA 3.50  (# 0.9656 1616:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1241,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 85 PHE HB3 85 PHE HA 3.50  (# 0.0000 1617:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 84 ARG HB2 84 ARG HA 3.00  (# 0.9745 1618:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1215, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 50 TRP HB2 50 TRP HA 3.50  (# 0.0000 1620:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 TRP HB3 50 TRP HA 3.50  (# 0.9932 1621:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 710, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HN 33 THR HA 3.00  (# 0.0000 1628:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43, 462, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 34 GLU HN 33 THR HA 3.00  (# 0.9989 1629:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 462, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 86 GLY HN 85 PHE HA 3.00  (# 0.0000 1632:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=1257,1239, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 51 LEU HN 50 TRP HA 3.00  (# 0.0000 1635:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 729, 707, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 50 TRP HD1 50 TRP HA 3.20  (# 0.0000 1636:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 713, 707, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 5 THR HN 50 TRP HA 4.00  (# 0.0000 1637:20 3.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=  62, 707, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 52 VAL HN 87 ALA HA 4.50  (# 0.0000 1638:20 3.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 748,1266, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 88 ILE HN 87 ALA HA 3.00  (# 0.9987 1640:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1266, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 33 THR HA 33 THR HB 3.00  (# 0.0000 1644:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 464, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 56 THR HA 56 THR HB 3.00  (# 0.9992 1645:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 807, 809, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 32 THR HA 32 THR HB 3.20  (# 0.0000 1647:20 2.58,)
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 450, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 50 TRP HA 5 THR HB 5.00  (# 0.0000 1653:20 4.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 707,  66, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11 THR HA 11 THR HB 3.20  (# 0.0000 1656:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 145, 147, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 35 THR HA 35 THR HB 3.50  (# 0.0000 1659:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 491, 493, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 18 VAL HN 18 VAL HA 3.50  (# 0.0000 1660:20 2.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 238, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 146 LEU HG 143 VAL HA 4.00  (# 0.9885 1662:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat=2163,2109, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 92 SER HA 92 SER HB3 3.00  (# 0.0000 1667:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1328,1331, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 47 SER HA 47 SER HB3 3.00  (# 0.9791 1668:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 670, 673, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 47 SER HA 47 SER HB2 3.00  (# 0.9935 1669:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 670, 672, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 92 SER HA 92 SER HB2 3.00  (# 0.0000 1671:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1328,1330, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 47 SER HN 47 SER HB2 4.50  (# 0.0000 1672:20 3.59,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 112 SER HA 112 SER HB3 3.00  (# 0.9573 1674:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1640,1643, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 109 LEU HA 112 SER HB2 5.00  (# 0.0000 1679:20 3.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1585,1642, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 112 SER HA 112 SER HB2 3.00  (# 0.9947 1680:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1640,1642, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 131 PRO HB2 131 PRO HA 3.00  (# 0.9570 1685:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1934,1937, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 81 SER HA 81 SER HB2 3.50  (# 0.9980 1692:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1178,1180, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 142 TRP HB2 142 TRP HA 3.20  (# 0.0000 1694:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2087,2085, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 11 THR HB 11 THR HA 3.20  (# 0.9976 1695:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 147, 145, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 142 TRP HD1 142 TRP HA 4.00  (# 0.0000 1697:20 2.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=2091,2085, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 117 THR HN 117 THR HA 3.50  (# 0.0000 1700:20 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1705,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 THR HB 117 THR HA 3.50  (# 0.9539 1702:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat=1709,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 118 GLY HA2 117 THR HA 5.00  (# 0.0000 1703:20 4.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1721,1707, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 78 PRO HB3 78 PRO HA 3.20  (# 0.9747 1704:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1141, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 113 GLY HA3 81 SER HA 5.00  (# 0.0000 1712:20 3.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=1652,1178, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 82 ALA HN 81 SER HA 4.00  (# 0.0000 1715:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=1187,1178, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 70 TYR HB2 70 TYR HA 3.20  (# 0.9507 1716:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 999, 997, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 70 TYR HN 70 TYR HA 3.50  (# 0.9934 1718:20 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HB2 70 TYR HA 3.50  (# 0.9905 1719:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1045, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 72 ALA HN 69 PHE HA 5.00  (# 0.0000 1723:20 3.83,)
 &rst
  ixpk= 0, nxpk= 0, iat=1031, 977, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 124 ASN HN 123 ILE HA 2.80  (# 0.9970 1724:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1815,1798, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 144 ASN HN 141 SER HA 4.00  (# 0.0000 1726:20 3.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2074, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 139 LEU QD2 136 GLU HA 5.00  (# 0.9950 1730:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=2059,2060,2061,
 &end
#
# 84 ARG HN 49 ILE HA 3.50  (# 0.9964 1732:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=1213, 688, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 TRP HN 49 ILE HA 3.00  (# 0.0000 1733:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 688, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 33 THR HN 33 THR HA 4.00  (# 0.0000 1735:20 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 462, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 7 ILE HB 7 ILE HA 4.00  (# 0.9983 1736:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99,  97, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 89 GLY HN 88 ILE HA 2.80  (# 0.0000 1741:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1276, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 104 LYS HN 104 LYS HA 3.50  (# 0.0000 1743:20 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 71 GLU HA 4.50  (# 0.0000 1749:20 3.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1018, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21 HIS HD2 21 HIS HA 4.00  (# 0.0000 1752:20 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 279, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 24 GLU HB3 21 HIS HA 4.00  (# 0.9977 1754:20 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 328, 279, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 105 LEU QD1 105 LEU HA 4.00  (# 0.9948 1755:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1533,1534,1535,
 &end
#
# 41 LEU HB3 41 LEU HA 3.50  (# 0.9366 1756:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 584, 581, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU HN 41 LEU HA 5.50  (# 0.0000 1757:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 581, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 109 LEU HG 109 LEU HA 4.00  (# 0.0000 1762:20 3.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1590,1585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 112 SER HB3 109 LEU HA 5.00  (# 0.9823 1763:20 3.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1643,1585, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 109 LEU HN 109 LEU HA 4.00  (# 0.9953 1764:20 2.78,)
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 44 LEU HN 42 GLU HA 4.00  (# 0.0000 1766:20 3.26,)
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 600, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 73 LEU QD2 73 LEU HA 4.50  (# 0.0000 1769:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1054,1055,1056,
 &end
#
# 73 LEU HB2 73 LEU HA 3.50  (# 0.9698 1770:20 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1045,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 73 LEU HA 4.00  (# 0.0000 1772:20 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1043, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 73 LEU HG 73 LEU HA 3.50  (# 0.9809 1773:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=1048,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 147 LYS HB2 147 LYS HA 3.50  (# 0.9977 1774:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=2179,2177, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 147 LYS HG2 147 LYS HA 3.00  (# 0.0000 1775:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=2182,2177, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 56 THR HN 55 SER HA 2.80  (# 0.0000 1776:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 805, 796, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 22 LEU HN 22 LEU HA 3.20  (# 0.0000 1778:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 296, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 28 GLU HN 25 LYS HA 4.00  (# 0.9953 1779:20 3.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 340, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 77 LYS HN 76 GLN HA 4.00  (# 0.0000 1781:20 3.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1094, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 78 PRO HD3 77 LYS HA 3.00  (# 0.0000 1783:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 97 THR HN 96 ASP HA 3.20  (# 0.0000 1784:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1409,1399, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 116 GLN HG2 116 GLN HA 3.50  (# 0.9958 1786:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1695,1690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 145 LEU HN 145 LEU HA 3.50  (# 0.0000 1787:20 2.80,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2139, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 144 ASN HD21 144 ASN HA 5.00  (# 0.9322 1789:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=2132,2125, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 110 LYS HN 107 ALA HA 4.50  (# 0.0000 1792:20 3.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1560, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 83 VAL QG2 85 PHE HA 6.50  (# 0.0000 1794:20 4.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1207,1208,1209,
 &end
#
# 50 TRP HN 85 PHE HA 3.50  (# 0.0000 1796:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat= 705,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 GLU HG2 72 ALA HA 5.00  (# 0.0000 1798:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1084,1033, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13 GLY HA2 12 LEU HA 5.00  (# 0.9327 1800:20 4.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 159, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 75 GLU HN 72 ALA HA 4.00  (# 0.9910 1802:20 3.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1033, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 13 GLY HN 12 LEU HA 3.50  (# 0.0000 1803:20 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 159, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HN 72 ALA HA 4.50  (# 0.0000 1805:20 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1033, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 60 GLY HA3 65 ASN HA 4.50  (# 0.9824 1810:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 856, 919, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 83 VAL QG2 84 ARG HA 6.00  (# 0.0000 1814:20 4.05,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1207,1208,1209,
 &end
#
# 121 LEU HB3 121 LEU HA 3.50  (# 0.9807 1815:20 2.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=1760,1757, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 LEU HB3 80 LEU HA 3.50  (# 0.0000 1817:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1162,1159, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 5 THR HB 50 TRP HA 5.50  (# 0.9103 1823:20 4.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=  66, 707, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 50 TRP HD1 50 TRP HA 3.50  (# 0.0000 1824:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 713, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 TRP HN 50 TRP HA 3.50  (# 0.9850 1825:20 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 5 THR HB 50 TRP HA 5.50  (# 0.0000 1826:20 4.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=  66, 707, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 81 SER HA 114 ALA HA 4.50  (# 0.9570 1832:20 3.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1178,1658, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 45 PRO HD3 44 LEU HA 3.00  (# 0.0000 1833:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30 GLY HN 29 ALA HA 4.00  (# 0.0000 1835:20 3.48,)
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 411, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 114 ALA QB 114 ALA HA 3.00  (# 0.0000 1836:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1660,1661,1662,
 &end
#
# 44 LEU QD1 44 LEU HA 4.00  (# 0.0000 1837:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 634, 635, 636,
 &end
#
# 83 VAL HN 82 ALA HA 4.00  (# 0.9340 1841:20 3.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1197,1189, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 82 ALA HN 82 ALA HA 3.50  (# 0.9976 1842:20 2.80,)
 &rst
  ixpk= 0, nxpk= 0, iat=1187,1189, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 THR HB 2 ALA HA 3.00  (# 0.9985 1847:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  23, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 52 VAL QG1 87 ALA HA 5.00  (# 0.0000 1853:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1266, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 754, 755, 756,
 &end
#
# 130 ILE QG2 131 PRO HD2 4.20  (# 0.9987 1855:20 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1928, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1914,1915,1916,
 &end
#
# 73 LEU HA 78 PRO HD3 4.50  (# 0.9903 1861:20 3.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LYS HA 78 PRO HD3 3.00  (# 0.9992 1862:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1133, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 LEU HA 45 PRO HD2 3.00  (# 0.9901 1865:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 627, 645, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 77 LYS HN 78 PRO HD2 3.50  (# 0.0000 1866:20 2.63,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 68 PRO HG2 68 PRO HD3 3.20  (# 0.9989 1867:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 965, 963, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 44 LEU QD1 45 PRO HD2 5.00  (# 0.0000 1869:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 645, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 634, 635, 636,
 &end
#
# 44 LEU HB2 45 PRO HD3 5.00  (# 0.9997 1870:20 1.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 629, 646, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 68 PRO HG3 68 PRO HD3 3.20  (# 0.9989 1871:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 966, 963, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 143 VAL HB 140 GLY HA3 4.50  (# 0.9590 1878:20 2.84,)
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2068, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 141 SER HN 140 GLY HA3 3.50  (# 0.0000 1879:20 2.51,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2068, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 114 ALA HN 113 GLY HA3 4.00  (# 0.9224 1893:20 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1656,1652, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 114 ALA HN 113 GLY HA2 4.00  (# 0.9609 1894:20 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1656,1651, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 142 TRP HD1 118 GLY HA2 4.50  (# 0.0000 1903:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2091,1721, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 142 TRP HD1 118 GLY HA3 4.50  (# 0.0000 1907:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2091,1722, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 51 LEU HA 51 LEU HB2 3.50  (# 0.0000 1918:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731, 733, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 6 LEU HA 51 LEU HB2 4.00  (# 0.9827 1919:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78, 733, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 LEU HN 51 LEU HB2 4.00  (# 0.0000 1920:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 729, 733, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 LEU QD2 51 LEU HB3 4.00  (# 0.9782 1921:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 742, 743, 744,
 &end
#
# 51 LEU QD1 51 LEU HB3 4.00  (# 0.0000 1922:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 738, 739, 740,
 &end
#
# 51 LEU HA 51 LEU HB3 3.50  (# 0.0000 1923:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731, 734, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 90 ILE HA 89 GLY HA2 5.00  (# 0.0000 1933:20 4.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=1302,1295, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 36 LEU QD2 36 LEU HB2 4.00  (# 0.9996 1942:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 507, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 516, 517, 518,
 &end
#
# 36 LEU QD2 36 LEU HB3 4.00  (# 0.9996 1943:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 516, 517, 518,
 &end
#
# 36 LEU QD1 36 LEU HB3 4.00  (# 0.9982 1944:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 512, 513, 514,
 &end
#
# 36 LEU HN 36 LEU HB2 4.50  (# 0.9580 1947:20 3.01,)
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 507, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 51 LEU HA 86 GLY HA3 5.00  (# 0.0000 1949:20 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731,1260, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 86 GLY HN 86 GLY HA3 3.20  (# 0.9985 1951:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1257,1260, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 116 GLN HB3 110 LYS HE3 4.50  (# 0.0000 1955:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1693,1616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 87 ALA HN 86 GLY HA2 3.20  (# 0.0000 1958:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1264,1259, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU HA 86 GLY HA2 5.00  (# 0.0000 1960:20 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731,1259, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 116 GLN HB3 110 LYS HE2 4.50  (# 0.0000 1963:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1693,1615, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 139 LEU QD2 139 LEU HB3 4.00  (# 0.9026 1966:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2059,2060,2061,
 &end
#
# 139 LEU HN 139 LEU HB2 3.50  (# 0.9674 1967:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2050, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 146 LEU HA 146 LEU HB3 3.00  (# 0.0000 1969:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=2158,2161, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 146 LEU QD2 146 LEU HB2 4.00  (# 0.0000 1971:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2160, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2169,2170,2171,
 &end
#
# 146 LEU QD1 146 LEU HB2 4.00  (# 0.0000 1972:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2160, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2165,2166,2167,
 &end
#
# 146 LEU QD1 146 LEU HB3 4.00  (# 0.0000 1973:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2161, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2165,2166,2167,
 &end
#
# 146 LEU QD1 146 LEU HB2 4.00  (# 0.0000 1974:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2160, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2165,2166,2167,
 &end
#
# 25 LYS HD2 25 LYS HE3 3.50  (# 0.0000 1977:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 352, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 TYR HB3 105 LEU HB2 6.50  (# 0.0000 1982:20 3.65,)
 &rst
  ixpk= 0, nxpk= 0, iat=1000,1528, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 3 ASP HA 3 ASP HB3 3.50  (# 0.9028 1985:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  33,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 145 LEU HN 145 LEU HB2 3.50  (# 0.9943 1990:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2141, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 105 LEU HN 105 LEU HB3 3.50  (# 0.0000 1991:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1524,1529, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 105 LEU HN 105 LEU HB3 3.50  (# 0.9885 1992:20 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1524,1529, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HN 73 LEU HB3 3.50  (# 0.9883 1993:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU QD1 73 LEU HB2 4.00  (# 0.0000 1997:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1045, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1050,1051,1052,
 &end
#
# 73 LEU HA 73 LEU HB2 3.50  (# 0.9834 1999:20 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 73 LEU HB2 3.50  (# 0.0000 2000:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HN 73 LEU HB2 3.50  (# 0.9883 2001:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 145 LEU HN 145 LEU HB3 3.50  (# 0.9827 2002:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2142, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 THR HN 3 ASP HB2 4.00  (# 0.0000 2004:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  35, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 4 ILE HN 3 ASP HB2 4.00  (# 0.0000 2005:20 3.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  35, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 3 ASP HN 3 ASP HB2 3.50  (# 0.0000 2007:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HN 3 ASP HB3 4.00  (# 0.0000 2008:20 3.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  36, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 3 ASP HN 3 ASP HB3 3.50  (# 0.0000 2009:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 THR HN 3 ASP HB3 4.00  (# 0.0000 2010:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  36, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 73 LEU HA 73 LEU HB3 3.50  (# 0.0000 2014:20 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU HA 41 LEU HB3 3.50  (# 0.9572 2016:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 584, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 73 LEU HB3 3.50  (# 0.0000 2017:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 73 LEU HB3 3.50  (# 0.0000 2018:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HG 73 LEU HB3 3.50  (# 0.9977 2020:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1048,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 44 LEU QD1 44 LEU HB3 4.00  (# 0.0000 2021:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 630, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 634, 635, 636,
 &end
#
# 44 LEU QD1 44 LEU HB3 4.00  (# 0.0000 2022:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 630, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 634, 635, 636,
 &end
#
# 44 LEU QD2 44 LEU HB2 4.00  (# 0.9913 2024:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 629, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 638, 639, 640,
 &end
#
# 105 LEU QD2 105 LEU HB2 4.00  (# 0.0000 2028:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1528, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1537,1538,1539,
 &end
#
# 6 LEU QD1 6 LEU HB2 4.00  (# 0.9820 2029:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  80, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  85,  86,  87,
 &end
#
# 6 LEU HA 6 LEU HB2 3.50  (# 0.9985 2030:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  80, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 145 LEU HA 145 LEU HB3 3.50  (# 0.9979 2031:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=2139,2142, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 44 LEU HN 43 ASP HB2 4.00  (# 0.0000 2033:20 2.97,)
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 617, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 26 LEU HG 26 LEU HB2 3.00  (# 0.9840 2035:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 364, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26 LEU HN 26 LEU HB2 3.50  (# 0.9860 2037:20 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU QD1 41 LEU HB3 4.00  (# 0.9972 2043:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 584, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 588, 589, 590,
 &end
#
# 7 ILE QG2 7 ILE HB 4.00  (# 0.9965 2048:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 101, 102, 103,
 &end
#
# 7 ILE QD1 7 ILE HB 3.50  (# 0.0000 2049:20 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 108, 109, 110,
 &end
#
# 88 ILE QD1 88 ILE HB 4.00  (# 0.9943 2050:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1287,1288,1289,
 &end
#
# 109 LEU QD1 109 LEU HB2 4.00  (# 0.9879 2051:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1587, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1592,1593,1594,
 &end
#
# 33 THR QG2 4 ILE HB 3.50  (# 0.9942 2054:20 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 466, 467, 468,
 &end
#
# 109 LEU QD1 109 LEU HB3 4.00  (# 0.9950 2055:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1588, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1592,1593,1594,
 &end
#
# 88 ILE HG12 121 LEU HB2 4.00  (# 0.9932 2064:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1759, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 121 LEU HA 121 LEU HB3 3.50  (# 0.9925 2066:20 2.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=1757,1760, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 121 LEU HA 121 LEU HB3 3.50  (# 0.9925 2067:20 2.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=1757,1760, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 31 PHE HA 31 PHE HB2 3.50  (# 0.9906 2068:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 430, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 3 ASP HB2 31 PHE HB2 4.50  (# 0.9696 2070:20 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat=  35, 430, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 123 ILE HG12 123 ILE HB 3.50  (# 0.0000 2074:20 2.48,)
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1800, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 ILE HG12 123 ILE HB 3.50  (# 0.0000 2075:20 2.48,)
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1800, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 31 PHE HA 31 PHE HB3 3.20  (# 0.9906 2080:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 431, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 31 PHE HN 31 PHE HB3 4.00  (# 0.9937 2081:20 3.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 431, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 31 PHE HN 31 PHE HB2 4.00  (# 0.9937 2082:20 3.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 430, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 4 ILE QD1 31 PHE HB3 5.20  (# 0.0000 2083:20 3.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 431, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=  56,  57,  58,
 &end
#
# 4 ILE QD1 31 PHE HB2 5.20  (# 0.0000 2084:20 3.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=  56,  57,  58,
 &end
#
# 64 ASP HN 64 ASP HB2 4.50  (# 0.0000 2086:20 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 905, 909, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 22 LEU HA 22 LEU HB2 3.50  (# 0.9122 2089:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 296, 298, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 22 LEU HG 22 LEU HB3 3.50  (# 0.9969 2090:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 301, 299, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 22 LEU HA 22 LEU HB3 3.50  (# 0.9906 2091:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 296, 299, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 79 ASP HA 79 ASP HB2 3.50  (# 0.0000 2094:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1149, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 LEU HA 80 LEU HB3 3.50  (# 0.9764 2096:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1159,1162, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 LEU HA 80 LEU HB3 3.50  (# 0.9764 2098:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1159,1162, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 114 ALA QB 80 LEU HB2 4.00  (# 0.0000 2101:20 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1660,1661,1662,
 &end
#
# 114 ALA QB 80 LEU HB3 4.00  (# 0.0000 2102:20 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1162, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1660,1661,1662,
 &end
#
# 70 TYR HA 70 TYR HB2 3.50  (# 0.9777 2107:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 997, 999, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 TYR HN 70 TYR HB2 3.20  (# 0.9996 2116:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 999, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 4 ILE HG12 49 ILE HB 4.00  (# 0.9993 2121:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 690, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 49 ILE HG12 49 ILE HB 3.20  (# 0.9968 2122:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 696, 690, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 49 ILE HA 49 ILE HB 3.50  (# 0.0000 2124:20 2.68,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688, 690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 95 TYR HA 95 TYR HB3 3.50  (# 0.0000 2128:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=1378,1381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 TYR HN 69 PHE HB2 3.50  (# 0.0000 2134:20 1.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 PHE HA 69 PHE HB2 3.50  (# 0.9958 2135:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat= 977, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 PHE HA 69 PHE HB3 3.50  (# 0.9958 2138:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat= 977, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 66 LEU QD1 69 PHE HB3 5.00  (# 0.9928 2139:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 940, 941, 942,
 &end
#
# 130 ILE HG12 130 ILE HB 3.00  (# 0.0000 2155:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1918,1912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 130 ILE HA 130 ILE HB 3.50  (# 0.9045 2158:20 2.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=1910,1912, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 130 ILE HN 130 ILE HB 3.00  (# 0.0000 2160:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1908,1912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 111 ASN HD21 111 ASN HB2 4.00  (# 0.0000 2163:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1633,1628, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 111 ASN HD21 111 ASN HB3 4.00  (# 0.0000 2164:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1633,1629, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 112 SER HN 111 ASN HB2 4.50  (# 0.9894 2167:20 3.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1628, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 THR QG2 20 GLU HG2 6.00  (# 0.0000 2178:20 3.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 269, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 495, 496, 497,
 &end
#
# 136 GLU HA 136 GLU HG2 4.20  (# 0.9931 2180:20 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=1994,1999, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 20 GLU HN 20 GLU HG2 5.00  (# 0.9667 2185:20 3.69,)
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 269, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 137 GLU HN 136 GLU HG2 4.00  (# 0.9719 2186:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=2007,1999, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 70 TYR QD 71 GLU HG3 5.50  (# 0.0000 2188:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1024, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1003,1012,
 &end
#
# 71 GLU HN 71 GLU HG3 3.50  (# 0.0000 2192:20 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1024, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 65 ASN HD21 65 ASN HB3 4.00  (# 0.0000 2195:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat= 926, 922, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 65 ASN HD21 65 ASN HB2 4.00  (# 0.0000 2196:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat= 926, 921, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 66 LEU HN 65 ASN HB3 4.00  (# 0.9991 2197:20 1.86,)
 &rst
  ixpk= 0, nxpk= 0, iat= 931, 922, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 120 THR HN 119 GLU HG2 5.00  (# 0.0000 2203:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1733, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 27 GLU HN 28 GLU HG2 6.00  (# 0.0000 2207:20 4.08,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 401, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 108 GLU HN 108 GLU HG3 4.00  (# 0.9942 2208:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1576, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 108 GLU HA 108 GLU HG2 4.50  (# 0.0000 2210:20 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 71 GLU HA 71 GLU HG3 4.00  (# 0.9663 2216:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1018,1024, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 94 GLU HA 94 GLU HG3 4.20  (# 0.0000 2222:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1369, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 94 GLU HA 94 GLU HG2 4.20  (# 0.0000 2223:20 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1368, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 16 GLU HA 16 GLU HG2 4.00  (# 0.0000 2230:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 207, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 122 LYS HA 122 LYS HB2 3.50  (# 0.9981 2239:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1778, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HE21 74 GLN HG2 4.00  (# 0.0000 2243:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1072,1067, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 147 LYS HN 147 LYS HB3 3.50  (# 0.0000 2244:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2175,2180, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 74 GLN HG2 3.20  (# 0.0000 2245:20 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1067, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 74 GLN HN 74 GLN HG2 3.20  (# 0.0000 2246:20 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1067, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 75 GLU HN 74 GLN HG3 4.20  (# 0.9888 2247:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1068, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 147 LYS HA 147 LYS HB2 3.50  (# 0.0000 2249:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=2177,2179, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 GLN HN 74 GLN HG3 3.20  (# 0.0000 2250:20 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1068, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 5 THR HA 34 GLU HB3 4.00  (# 0.9950 2251:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=  64, 479, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 34 GLU HN 34 GLU HB3 3.50  (# 0.0000 2253:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 36 LEU QD2 34 GLU HB3 5.00  (# 0.9986 2254:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 479, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 516, 517, 518,
 &end
#
# 7 ILE QD1 50 TRP HB2 6.00  (# 0.0000 2256:20 3.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 108, 109, 110,
 &end
#
# 83 VAL QG2 50 TRP HB2 6.50  (# 0.0000 2258:20 3.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1207,1208,1209,
 &end
#
# 85 PHE HB3 50 TRP HB2 6.00  (# 0.0000 2259:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1242, 709, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 85 PHE HB3 50 TRP HB3 6.00  (# 0.0000 2260:20 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1242, 710, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 50 TRP HA 50 TRP HB2 3.50  (# 0.0000 2261:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 707, 709, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 TRP HA 50 TRP HB3 3.50  (# 0.0000 2262:20 2.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 707, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 51 LEU HN 50 TRP HB2 5.00  (# 0.0000 2263:20 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 729, 709, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 51 LEU HN 50 TRP HB3 5.00  (# 0.0000 2264:20 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 729, 710, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 116 GLN HB2 116 GLN HG2 3.50  (# 0.9796 2266:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1695, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 116 GLN HB2 116 GLN HG2 3.50  (# 0.9783 2267:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1695, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 THR HN 116 GLN HG2 4.00  (# 0.0000 2269:20 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1705,1695, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 116 GLN HB3 116 GLN HG3 3.50  (# 0.0000 2270:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1693,1696, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 131 PRO HA 131 PRO HB2 3.20  (# 0.9765 2274:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1937,1934, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 79 ASP HN 78 PRO HB3 3.50  (# 0.9993 2276:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=1145,1139, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 79 ASP HN 78 PRO HB2 3.50  (# 0.9996 2277:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=1145,1138, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 78 PRO HD2 78 PRO HB2 4.50  (# 0.0000 2278:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 40 LEU HN 39 PRO HB2 4.00  (# 0.0000 2279:20 2.85,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 553, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 131 PRO HA 131 PRO HB3 3.20  (# 0.9814 2280:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1937,1935, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 46 ALA HN 45 PRO HB3 3.50  (# 0.0000 2284:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 652, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 LEU HN 78 PRO HB2 6.00  (# 0.0000 2285:20 4.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1157,1138, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 120 THR HN 119 GLU HB2 4.00  (# 0.0000 2286:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1730, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 140 GLY HA3 143 VAL HB 4.50  (# 0.9926 2291:20 2.84,)
 &rst
  ixpk= 0, nxpk= 0, iat=2068,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 120 THR HN 119 GLU HB3 4.00  (# 0.0000 2292:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1731, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 45 PRO HD2 45 PRO HB3 4.50  (# 0.0000 2294:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 645, 652, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 45 PRO HD2 45 PRO HB2 4.50  (# 0.0000 2295:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 645, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 46 ALA HA 45 PRO HB3 6.00  (# 0.0000 2296:20 4.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 660, 652, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 47 SER HN 45 PRO HB3 5.20  (# 0.0000 2299:20 3.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 652, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 47 SER HN 45 PRO HB3 5.20  (# 0.0000 2300:20 3.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 652, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 45 PRO HD3 45 PRO HB3 4.50  (# 0.0000 2301:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 652, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 45 PRO HD3 45 PRO HB2 4.50  (# 0.0000 2302:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 46 ALA HN 45 PRO HB2 3.50  (# 0.0000 2303:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 651, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 144 ASN HN 143 VAL HB 3.20  (# 0.0000 2306:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2111, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HG2 25 LYS HB3 3.20  (# 0.0000 2308:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 343, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HG2 25 LYS HB2 3.20  (# 0.9766 2309:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 342, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HG3 25 LYS HB3 3.20  (# 0.0000 2311:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 343, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 139 LEU QD2 25 LYS HB3 5.20  (# 0.9969 2312:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 343, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=2059,2060,2061,
 &end
#
# 139 LEU QD2 25 LYS HB2 5.20  (# 0.9981 2313:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 342, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=2059,2060,2061,
 &end
#
# 128 HIS HA 128 HIS HB2 3.50  (# 0.0000 2322:20 2.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1881,1883, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 PHE HN 68 PRO HB2 4.50  (# 0.0000 2325:20 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 968, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 121 LEU QD1 138 TRP HB2 5.00  (# 0.9971 2328:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2026, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1764,1765,1766,
 &end
#
# 138 TRP HN 138 TRP HB2 3.50  (# 0.9894 2332:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2022,2026, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 94 GLU HN 94 GLU HB2 4.20  (# 0.0000 2335:20 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1361,1365, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 94 GLU HA 94 GLU HB2 3.20  (# 0.0000 2337:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1365, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 74 GLN HA 74 GLN HB2 3.20  (# 0.9752 2338:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1062,1064, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 77 LYS HA 77 LYS HB2 3.50  (# 0.9964 2340:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1113, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 136 GLU HA 136 GLU HB2 3.20  (# 0.9721 2347:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=1994,1996, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 21 HIS HA 24 GLU HB2 4.20  (# 0.0000 2352:20 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 327, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 73 LEU QD2 108 GLU HB3 5.20  (# 0.0000 2353:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1573, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1054,1055,1056,
 &end
#
# 73 LEU QD2 108 GLU HB2 5.20  (# 0.9951 2356:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1572, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1054,1055,1056,
 &end
#
# 74 GLN HE21 74 GLN HB2 4.20  (# 0.9936 2359:20 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1072,1064, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 24 GLU HN 24 GLU HB3 3.20  (# 0.9482 2361:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 328, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 73 LEU QD2 108 GLU HB3 5.20  (# 0.0000 2362:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1573, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1054,1055,1056,
 &end
#
# 109 LEU HN 108 GLU HB3 4.20  (# 0.0000 2368:20 2.64,)
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1573, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 109 LEU HN 108 GLU HB3 4.20  (# 0.0000 2369:20 2.64,)
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1573, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 20 GLU HN 20 GLU HB2 3.20  (# 0.9913 2370:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 266, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 106 GLU HN 106 GLU HB2 4.20  (# 0.9992 2372:20 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1547, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 18 VAL HA 21 HIS HB2 4.20  (# 0.0000 2374:20 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 281, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 18 VAL HA 21 HIS HB3 4.20  (# 0.0000 2375:20 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 282, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 21 HIS HA 21 HIS HB2 3.50  (# 0.0000 2376:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 281, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 HIS HA 21 HIS HB3 3.50  (# 0.0000 2377:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 HIS HN 21 HIS HB2 3.50  (# 0.0000 2378:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 281, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 GLU HA 24 GLU HB3 3.50  (# 0.9590 2379:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 325, 328, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 20 GLU HN 20 GLU HB3 3.50  (# 0.9838 2382:20 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 267, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 78 PRO HD3 76 GLN HB3 5.50  (# 0.0000 2383:20 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1097, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 78 PRO HD3 76 GLN HB2 5.50  (# 0.9994 2384:20 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1096, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 35 THR HA 6 LEU QD1 5.80  (# 0.0000 2388:20 4.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2=  85,  86,  87,
 &end
#
# 23 ALA HN 6 LEU QD1 6.00  (# 0.9500 2389:20 3.50,)
 &rst
  ixpk= 0, nxpk= 0, iat= 313,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  85,  86,  87,
 &end
#
# 27 GLU HA 27 GLU HB2 3.50  (# 0.9959 2396:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 116 GLN HG2 116 GLN HB3 3.50  (# 0.0000 2398:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1695,1693, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 110 LYS HE3 116 GLN HB3 4.50  (# 0.9970 2399:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1616,1693, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 GLN HG3 116 GLN HB2 3.50  (# 0.9944 2403:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1696,1692, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 142 TRP HA 142 TRP HB3 3.50  (# 0.0000 2407:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2088, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU HA 41 LEU HG 3.00  (# 0.9993 2408:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 586, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HA 142 TRP HB2 3.00  (# 0.0000 2411:20 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2087, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HE3 142 TRP HB2 4.20  (# 0.9931 2412:20 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=2102,2087, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 143 VAL HN 142 TRP HB2 4.50  (# 0.0000 2413:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2087, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 49 ILE HN 49 ILE HG12 4.20  (# 0.9783 2416:20 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 51 LEU QD2 51 LEU HG 3.20  (# 0.9410 2417:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 742, 743, 744,
 &end
#
# 49 ILE HB 4 ILE HG12 4.20  (# 0.0000 2419:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  53, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 49 ILE HN 49 ILE HG12 4.20  (# 0.9860 2420:20 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 4 ILE QD1 4 ILE HG12 3.20  (# 0.9505 2421:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=  56,  57,  58,
 &end
#
# 123 ILE QG2 123 ILE HG12 4.00  (# 0.9372 2422:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1806, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1802,1803,1804,
 &end
#
# 4 ILE HA 4 ILE HG12 3.20  (# 0.9787 2424:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45,  53, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 3 ASP HB3 4 ILE HG12 5.00  (# 0.0000 2425:20 2.68,)
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  53, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 49 ILE HB 49 ILE HG12 3.20  (# 0.0000 2427:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 696, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 49 ILE HA 49 ILE HG12 4.20  (# 0.0000 2428:20 3.11,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 25 LYS HE3 25 LYS HD2 3.20  (# 0.0000 2429:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 348, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HA 25 LYS HD2 4.00  (# 0.9993 2431:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 348, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 88 ILE QD1 53 ILE HG12 4.00  (# 0.9975 2437:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 774, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1287,1288,1289,
 &end
#
# 51 LEU QD1 51 LEU HG 3.20  (# 0.9978 2438:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 738, 739, 740,
 &end
#
# 51 LEU HB2 51 LEU HG 3.20  (# 0.9992 2439:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 736, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU HB2 51 LEU HG 3.20  (# 0.9992 2440:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 736, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 84 ARG HA 84 ARG HG3 4.50  (# 0.0000 2448:20 2.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=1215,1221, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25 LYS HN 25 LYS HD2 4.00  (# 0.0000 2449:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 348, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 123 ILE HA 123 ILE HG12 4.50  (# 0.0000 2451:20 3.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1798,1806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 36 LEU HN 36 LEU HG 3.20  (# 0.9573 2452:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 510, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 78 PRO HD3 78 PRO HG2 3.20  (# 0.0000 2455:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1135, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 40 LEU HA 40 LEU HG 3.50  (# 0.9730 2458:20 2.78,)
 &rst
  ixpk= 0, nxpk= 0, iat= 562, 567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 ILE HA 123 ILE HG12 4.50  (# 0.0000 2461:20 3.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1798,1806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 130 ILE HB 130 ILE HG12 3.20  (# 0.9371 2463:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1912,1918, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 84 ARG HD3 84 ARG HG3 3.20  (# 0.0000 2464:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1224,1221, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 130 ILE HA 130 ILE HG12 4.00  (# 0.9278 2465:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat=1910,1918, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 130 ILE HN 130 ILE HG12 4.50  (# 0.9960 2467:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1908,1918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 130 ILE HN 130 ILE HG12 4.50  (# 0.0000 2469:20 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1908,1918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 LEU HG 105 LEU QD1 3.20  (# 0.9775 2472:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=1533,1534,1535,
 &end
#
# 121 LEU HN 121 LEU QD2 5.80  (# 0.0000 2479:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=1755,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2=1768,1769,1770,
 &end
#
# 142 TRP HE3 139 LEU QD2 6.50  (# 0.9861 2480:20 2.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=2059,2060,2061,
 &end
#
# 145 LEU HN 145 LEU HG 5.00  (# 0.9782 2483:20 3.77,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2144, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 44 LEU QD1 44 LEU HG 3.50  (# 0.0000 2485:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 634, 635, 636,
 &end
#
# 73 LEU QD2 109 LEU HG 5.00  (# 0.0000 2487:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1054,1055,1056,
 &end
#
# 109 LEU HN 109 LEU HG 3.50  (# 0.9821 2490:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1590, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 104 LYS HN 104 LYS HG2 3.50  (# 0.0000 2494:20 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1509, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 104 LYS HN 104 LYS HG3 3.50  (# 0.0000 2497:20 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HN 73 LEU HG 3.50  (# 0.9848 2498:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1048, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 104 LYS HA 104 LYS HG3 4.00  (# 0.9921 2499:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1504,1510, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 36 LEU HG 36 LEU QD1 3.50  (# 0.9301 2501:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 512, 513, 514,
 &end
#
# 69 PHE HB2 41 LEU QD1 6.00  (# 0.9655 2509:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 588, 589, 590,
 &end
#
# 26 LEU HA 26 LEU QD2 4.20  (# 0.9930 2511:20 1.92,)
 &rst
  ixpk= 0, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 373, 374, 375,
 &end
#
# 108 GLU HB3 73 LEU QD2 5.50  (# 0.9030 2516:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=1573,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1054,1055,1056,
 &end
#
# 73 LEU HN 73 LEU QD2 5.50  (# 0.9320 2518:20 3.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1054,1055,1056,
 &end
#
# 6 LEU HA 6 LEU QD2 4.00  (# 0.9988 2523:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  89,  90,  91,
 &end
#
# 147 LYS HN 147 LYS HG2 4.50  (# 0.0000 2527:20 2.85,)
 &rst
  ixpk= 0, nxpk= 0, iat=2175,2182, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 147 LYS HN 147 LYS HG3 4.50  (# 0.0000 2528:20 2.85,)
 &rst
  ixpk= 0, nxpk= 0, iat=2175,2183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 88 ILE QG2 88 ILE HG12 4.50  (# 0.9932 2531:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1280,1281,1282,
 &end
#
# 77 LYS HE2 77 LYS HG3 3.50  (# 0.9988 2547:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=1122,1117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 77 LYS HA 77 LYS HG3 3.80  (# 0.0000 2548:20 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1117, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 77 LYS HN 77 LYS HG3 3.80  (# 0.0000 2549:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1117, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 77 LYS HN 77 LYS HG2 3.80  (# 0.0000 2550:20 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1116, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 111 ASN HD22 77 LYS HG3 6.20  (# 0.9042 2552:20 4.13,)
 &rst
  ixpk= 0, nxpk= 0, iat=1634,1117, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,  &end
#
# 109 LEU HA 73 LEU QD1 5.20  (# 0.9595 2553:20 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=1585,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2=1050,1051,1052,
 &end
#
# 73 LEU HN 73 LEU QD1 5.50  (# 0.9320 2556:20 3.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1050,1051,1052,
 &end
#
# 143 VAL HA 146 LEU QD2 5.00  (# 0.0000 2557:20 1.97,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2169,2170,2171,
 &end
#
# 105 LEU HB2 105 LEU QD2 4.50  (# 0.9694 2565:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1537,1538,1539,
 &end
#
# 25 LYS HB2 25 LYS HG2 3.20  (# 0.9875 2568:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 345, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HD2 25 LYS HG2 3.20  (# 0.0000 2570:20 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 345, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 115 LYS HB2 115 LYS HG2 3.20  (# 0.0000 2571:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1670,1673, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 22 LEU HA 25 LYS HG2 4.50  (# 0.9429 2572:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 296, 345, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 22 LEU HA 25 LYS HG3 4.50  (# 0.9480 2573:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 296, 346, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25 LYS HA 25 LYS HG3 4.00  (# 0.9948 2574:20 2.45,)
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 346, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HN 25 LYS HG3 3.50  (# 0.0000 2575:20 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 346, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 44 LEU HN 44 LEU QD1 5.50  (# 0.0000 2594:20 3.59,)
 &rst
  ixpk= 0, nxpk= 0, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 634, 635, 636,
 &end
#
# 73 LEU HA 41 LEU QD2 6.50  (# 0.9784 2596:20 3.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 592, 593, 594,
 &end
#
# 26 LEU HB2 26 LEU QD1 4.50  (# 0.9306 2604:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 369, 370, 371,
 &end
#
# 120 THR HN 120 THR QG2 4.50  (# 0.0000 2611:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1747,1748,1749,
 &end
#
# 118 GLY HN 117 THR QG2 4.20  (# 0.0000 2612:20 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1711,1712,1713,
 &end
#
# 120 THR HB 120 THR QG2 3.20  (# 0.9950 2613:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1745,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=1747,1748,1749,
 &end
#
# 18 VAL HN 18 VAL QG1 5.00  (# 0.9791 2614:20 2.63,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 242, 243, 244,
 &end
#
# 27 GLU HA 33 THR QG2 4.20  (# 0.9942 2617:20 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 466, 467, 468,
 &end
#
# 116 GLN HE21 87 ALA QB 4.50  (# 0.9748 2631:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1268,1269,1270,
 &end
#
# 116 GLN HE22 87 ALA QB 4.50  (# 0.0000 2632:20 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1701,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1268,1269,1270,
 &end
#
# 97 THR HN 97 THR QG2 4.20  (# 0.0000 2636:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=1409,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1415,1416,1417,
 &end
#
# 23 ALA QB 35 THR QG2 4.50  (# 0.9862 2644:20 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 317, 318, 319,
 igr2= 495, 496, 497,
 &end
#
# 80 LEU HN 80 LEU QD1 4.20  (# 0.0000 2648:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1166,1167,1168,
 &end
#
# 20 GLU HA 35 THR QG2 4.20  (# 0.9985 2649:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 495, 496, 497,
 &end
#
# 19 ALA HN 18 VAL QG2 5.20  (# 0.9829 2661:20 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat= 252,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 246, 247, 248,
 &end
#
# 50 TRP HD1 83 VAL QG1 4.60  (# 0.9760 2663:20 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2=1203,1204,1205,
 &end
#
# 47 SER HN 83 VAL QG1 5.50  (# 0.0000 2664:20 3.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1203,1204,1205,
 &end
#
# 84 ARG HN 83 VAL QG1 4.50  (# 0.9857 2665:20 1.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1203,1204,1205,
 &end
#
# 83 VAL HB 83 VAL QG1 3.30  (# 0.9584 2666:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1201,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2=1203,1204,1205,
 &end
#
# 82 ALA HN 83 VAL QG1 6.50  (# 0.9034 2667:20 3.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1203,1204,1205,
 &end
#
# 50 TRP HE1 83 VAL QG1 4.80  (# 0.0000 2668:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2=1203,1204,1205,
 &end
#
# 76 GLN HE21 72 ALA QB 5.00  (# 0.9994 2677:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1035,1036,1037,
 &end
#
# 76 GLN HE22 72 ALA QB 5.00  (# 0.0000 2678:20 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=1105,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1035,1036,1037,
 &end
#
# 4 ILE HB 2 ALA QB 6.00  (# 0.0000 2679:20 4.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  25,  26,  27,
 &end
#
# 33 THR HN 2 ALA QB 5.00  (# 0.0000 2681:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=  25,  26,  27,
 &end
#
# 49 ILE HA 83 VAL QG2 6.00  (# 0.0000 2685:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1207,1208,1209,
 &end
#
# 30 GLY HN 29 ALA QB 4.50  (# 0.0000 2690:20 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 413, 414, 415,
 &end
#
# 55 SER HA 90 ILE QG2 6.50  (# 0.0000 2694:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1306,1307,1308,
 &end
#
# 130 ILE HA 130 ILE QG2 4.20  (# 0.9788 2698:20 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat=1910,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1914,1915,1916,
 &end
#
# 6 LEU HB2 23 ALA QB 5.50  (# 0.9151 2704:20 3.65,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 317, 318, 319,
 &end
#
# 50 TRP HA 4 ILE QG2 5.30  (# 0.0000 2709:20 3.67,)
 &rst
  ixpk= 0, nxpk= 0, iat= 707,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=  49,  50,  51,
 &end
#
# 88 ILE QG2 123 ILE QG2 4.20  (# 0.9952 2710:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1=1280,1281,1282,
 igr2=1802,1803,1804,
 &end
#
# 122 LYS HA 123 ILE QG2 6.50  (# 0.0000 2711:20 4.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1802,1803,1804,
 &end
#
# 124 ASN HN 123 ILE QG2 5.80  (# 0.0000 2712:20 3.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2=1802,1803,1804,
 &end
#
# 8 SER HN 7 ILE QG2 5.00  (# 0.0000 2715:20 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 101, 102, 103,
 &end
#
# 121 LEU QD2 88 ILE QG2 6.00  (# 0.9922 2722:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=1768,1769,1770,
 igr2=1280,1281,1282,
 &end
#
# 7 ILE HG12 7 ILE QD1 3.20  (# 0.9974 2725:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 105,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 108, 109, 110,
 &end
#
# 90 ILE HA 90 ILE QD1 4.20  (# 0.9976 2734:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=1302,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1313,1314,1315,
 &end
#
# 49 ILE HA 49 ILE QD1 4.20  (# 0.0000 2740:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 699, 700, 701,
 &end
#
# 4 ILE HG12 4 ILE QD1 3.30  (# 0.9963 2750:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2=  56,  57,  58,
 &end
#
# 49 ILE HB 4 ILE QD1 4.50  (# 0.0000 2751:20 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  56,  57,  58,
 &end
#
# 4 ILE HA 4 ILE QD1 5.50  (# 0.9593 2752:20 4.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  56,  57,  58,
 &end
#
# 110 LYS HG2 110 LYS HA 3.50  (# 0.9566 2759:20 2.69,)
 &rst
  ixpk= 0, nxpk= 0, iat=1609,1604, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 46 ALA HN 45 PRO HA 3.20  (# 0.0000 2760:20 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 654, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 45 PRO HB3 45 PRO HA 3.20  (# 0.9907 2761:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 654, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 45 PRO HB2 45 PRO HA 3.20  (# 0.0000 2762:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 654, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 4 ILE HN 3 ASP HB3 4.50  (# 0.0000 2778:20 3.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  36, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3 ASP HN 3 ASP HB3 3.50  (# 0.0000 2779:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE QD1 4 ILE HB 4.20  (# 0.9355 2782:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=  56,  57,  58,
 &end
#
# 4 ILE HG12 4 ILE HB 3.50  (# 0.9984 2783:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HG12 4 ILE HB 3.50  (# 0.9687 2784:20 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HA 4 ILE HB 4.00  (# 0.9480 2785:20 3.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45,  47, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 4 ILE HN 4 ILE HB 3.50  (# 0.0000 2786:20 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 33 THR HA 4 ILE HB 3.50  (# 0.0000 2787:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462,  47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HA 4 ILE HG12 3.50  (# 0.9974 2794:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45,  53, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HN 4 ILE HG12 4.50  (# 0.9935 2796:20 3.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  53, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31 PHE HB3 4 ILE QD1 6.00  (# 0.9400 2799:20 3.20,)
 &rst
  ixpk= 0, nxpk= 0, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  56,  57,  58,
 &end
#
# 4 ILE HN 4 ILE QD1 6.00  (# 0.0000 2800:20 4.66,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  56,  57,  58,
 &end
#
# 4 ILE HN 4 ILE QG2 5.50  (# 0.9729 2807:20 4.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  49,  50,  51,
 &end
#
# 51 LEU QD1 4 ILE QG2 5.50  (# 0.0000 2808:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 738, 739, 740,
 igr2=  49,  50,  51,
 &end
#
# 6 LEU HB2 6 LEU HA 3.50  (# 0.9270 2815:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  78, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 6 LEU QD2 6 LEU HA 4.00  (# 0.9996 2816:20 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  78, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  89,  90,  91,
 &end
#
# 6 LEU HB3 6 LEU HA 3.50  (# 0.9585 2817:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  78, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 6 LEU HG 6 LEU HB2 3.20  (# 0.9962 2820:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  83,  80, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 6 LEU HB3 6 LEU HG 3.20  (# 0.9785 2824:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  83, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 6 LEU HB2 6 LEU HG 3.20  (# 0.9740 2826:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  83, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU QD1 6 LEU QD2 6.00  (# 0.9729 2835:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 738, 739, 740,
 igr2=  89,  90,  91,
 &end
#
# 7 ILE HG12 7 ILE HA 4.00  (# 0.9871 2838:20 2.44,)
 &rst
  ixpk= 0, nxpk= 0, iat= 105,  97, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 53 ILE QD1 7 ILE HA 6.00  (# 0.9044 2839:20 4.59,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 777, 778, 779,
 &end
#
# 8 SER HN 7 ILE HA 2.80  (# 0.0000 2843:20 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  97, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 7 ILE HB 7 ILE HG12 3.50  (# 0.9704 2853:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99, 105, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 7 ILE HA 7 ILE HG12 4.00  (# 0.0000 2857:20 2.44,)
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 105, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 7 ILE HB 7 ILE HG12 3.50  (# 0.9704 2861:20 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  99, 105, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 7 ILE HA 7 ILE HG12 4.00  (# 0.0000 2862:20 2.44,)
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 105, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 LEU HN 7 ILE QD1 5.50  (# 0.0000 2866:20 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 108, 109, 110,
 &end
#
# 41 LEU HN 7 ILE QG2 6.00  (# 0.9673 2871:20 3.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 101, 102, 103,
 &end
#
# 10 SER HA 10 SER HB3 3.20  (# 0.0000 2886:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 137, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 66 LEU HN 10 SER HB3 6.50  (# 0.9596 2887:20 3.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 931, 137, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 12 LEU HA 12 LEU HB2 3.50  (# 0.9912 2895:20 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 159, 161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU HN 40 LEU HB3 4.50  (# 0.0000 2897:20 1.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 565, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12 LEU HA 12 LEU HG 3.50  (# 0.0000 2900:20 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 159, 164, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 12 LEU HG 12 LEU QD1 3.30  (# 0.9958 2902:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 166, 167, 168,
 &end
#
# 146 LEU HB2 146 LEU HG 3.50  (# 0.9874 2904:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat=2160,2163, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 13 GLY HN 13 GLY HA3 3.50  (# 0.9320 2907:20 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 179, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 137 GLU HA 140 GLY HA3 5.50  (# 0.9493 2909:20 3.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=2009,2068, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 GLU HG2 16 GLU HA 4.50  (# 0.9994 2920:20 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16 GLU HB3 16 GLU HG2 3.50  (# 0.0000 2925:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 205, 207, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 16 GLU HA 16 GLU HB2 3.50  (# 0.9891 2926:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 16 GLU HA 16 GLU HB3 3.50  (# 0.0000 2927:20 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 205, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 17 TYR HB3 17 TYR HA 3.50  (# 0.9920 2928:20 2.46,)
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 217, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 18 VAL HN 17 TYR HA 4.50  (# 0.9842 2930:20 3.48,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 217, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18 VAL HB 18 VAL HA 3.50  (# 0.9896 2933:20 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 238, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 HIS HB3 18 VAL HA 4.20  (# 0.0000 2934:20 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 238, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 21 HIS HB2 18 VAL HA 4.20  (# 0.0000 2935:20 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 238, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 17 TYR HN 18 VAL HA 6.50  (# 0.0000 2937:20 5.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 238, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 19 ALA HA 18 VAL HA 5.80  (# 0.0000 2938:20 4.76,)
 &rst
  ixpk= 0, nxpk= 0, iat= 254, 238, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 18 VAL HN 18 VAL HB 3.20  (# 0.9885 2939:20 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 19 ALA HA 18 VAL QG2 5.80  (# 0.0000 2947:20 3.17,)
 &rst
  ixpk= 0, nxpk= 0, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2= 246, 247, 248,
 &end
#
# 22 LEU HB3 19 ALA HA 4.50  (# 0.9773 2954:20 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 254, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 THR HA 19 ALA QB 4.50  (# 0.9443 2957:20 3.82,)
 &rst
  ixpk= 0, nxpk= 0, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 256, 257, 258,
 &end
#
# 19 ALA QB 20 GLU HA 5.50  (# 0.9908 2962:20 3.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 256, 257, 258,
 &end
#
# 35 THR QG2 20 GLU HA 4.20  (# 0.9981 2964:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 495, 496, 497,
 &end
#
# 21 HIS HN 20 GLU HA 4.20  (# 0.9842 2965:20 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 264, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 20 GLU HN 20 GLU HA 3.30  (# 0.9813 2966:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 20 GLU HN 20 GLU HA 3.30  (# 0.9813 2967:20 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 100 GLY HN 99 CYS HA 3.30  (# 0.9542 2969:20 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1454,1445, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 35 THR QG2 20 GLU HG2 6.50  (# 0.0000 2971:20 3.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 269, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 495, 496, 497,
 &end
#
# 21 HIS HB3 21 HIS HA 3.50  (# 0.0000 2972:20 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 279, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 GLU HB3 21 HIS HA 4.20  (# 0.9977 2973:20 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 328, 279, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 18 VAL HN 21 HIS HB2 6.50  (# 0.0000 2977:20 5.08,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 281, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 22 LEU HB2 22 LEU HA 3.50  (# 0.9895 2978:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 22 LEU HB2 22 LEU HA 3.50  (# 0.9987 2979:20 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS HN 22 LEU HA 4.50  (# 0.0000 2982:20 3.46,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 296, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 82 ALA HA 82 ALA QB 3.30  (# 0.9757 2992:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2=1191,1192,1193,
 &end
#
# 25 LYS HN 24 GLU HA 4.50  (# 0.9763 2995:20 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 325, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21 HIS HA 24 GLU HB3 4.20  (# 0.9935 2996:20 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 328, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 25 LYS HB3 25 LYS HA 3.50  (# 0.9708 2997:20 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS HN 25 LYS HA 3.50  (# 0.0000 3000:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS HN 25 LYS HB3 4.00  (# 0.0000 3002:20 2.33,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 343, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HN 25 LYS HB2 4.00  (# 0.0000 3003:20 2.33,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 342, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 26 LEU HN 25 LYS HB2 4.00  (# 0.9961 3004:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 342, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 26 LEU HN 25 LYS HB3 4.00  (# 0.0000 3005:20 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 343, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HB3 25 LYS HG2 3.20  (# 0.9987 3006:20 2.32,)
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 345, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HG2 25 LYS HE3 4.20  (# 0.9752 3009:20 2.33,)
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 352, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 26 LEU HN 26 LEU HA 3.50  (# 0.9950 3014:20 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 362, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 26 LEU QD2 26 LEU HA 4.00  (# 0.9967 3015:20 1.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 373, 374, 375,
 &end
#
# 27 GLU HN 26 LEU HB2 4.00  (# 0.0000 3018:20 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 364, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 78 PRO HA 78 PRO HG2 4.50  (# 0.0000 3021:20 3.85,)
 &rst
  ixpk= 0, nxpk= 0, iat=1141,1135, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26 LEU HN 26 LEU QD2 4.50  (# 0.9950 3026:20 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 373, 374, 375,
 &end
#
# 27 GLU HN 27 GLU HA 3.50  (# 0.0000 3030:20 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 GLU HN 27 GLU HB3 4.00  (# 0.9842 3031:20 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 384, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 30 GLY HN 28 GLU HA 4.50  (# 0.0000 3034:20 3.64,)
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 396, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 GLU HG2 28 GLU HB3 3.20  (# 0.9690 3036:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 399, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 29 ALA HN 28 GLU HB3 4.50  (# 0.0000 3038:20 3.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 399, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 107 ALA HN 106 GLU HB2 4.00  (# 0.0000 3039:20 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1547, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 31 PHE HN 30 GLY HA2 4.50  (# 0.9889 3053:20 3.10,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 421, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31 PHE HN 30 GLY HA3 4.50  (# 0.9889 3054:20 3.10,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 422, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 32 THR HN 32 THR HA 3.50  (# 0.0000 3059:20 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 448, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 33 THR HN 32 THR HA 2.80  (# 0.0000 3061:20 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 448, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 32 THR HB 32 THR HA 3.20  (# 0.9973 3062:20 2.58,)
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 448, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 32 THR QG2 32 THR HA 3.50  (# 0.0000 3063:20 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 448, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 452, 453, 454,
 &end
#
# 3 ASP HN 33 THR HA 4.50  (# 0.9725 3068:20 3.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31, 462, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4 ILE HB 33 THR HA 3.20  (# 0.0000 3069:20 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=  47, 462, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 23 ALA QB 33 THR HB 6.00  (# 0.0000 3070:20 3.59,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 317, 318, 319,
 &end
#
# 33 THR HN 33 THR HB 4.50  (# 0.0000 3072:20 3.86,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 THR HA 33 THR HB 6.50  (# 0.0000 3073:20 5.16,)
 &rst
  ixpk= 0, nxpk= 0, iat= 491, 464, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 34 GLU HA 33 THR HB 5.50  (# 0.0000 3074:20 4.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 464, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 26 LEU HB2 33 THR HB 5.50  (# 0.9114 3075:20 3.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 464, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 34 GLU HN 34 GLU HA 3.50  (# 0.0000 3080:20 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 113 GLY HN 111 ASN HA 4.50  (# 0.9797 3081:20 3.66,)
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1626, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 34 GLU HG2 34 GLU HA 3.50  (# 0.9994 3083:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 481, 476, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 36 LEU QD2 34 GLU HB2 5.00  (# 0.9986 3086:20 1.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 516, 517, 518,
 &end
#
# 34 GLU HG3 34 GLU HB3 3.30  (# 0.0000 3087:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 479, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 34 GLU HG3 34 GLU HB2 3.30  (# 0.0000 3088:20 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 478, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 74 GLN HE22 74 GLN HG3 4.20  (# 0.0000 3091:20 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1073,1068, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 35 THR HN 34 GLU HG2 5.50  (# 0.0000 3097:20 3.63,)
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 5 THR HA 34 GLU HG2 6.50  (# 0.9332 3100:20 4.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=  64, 481, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 34 GLU HA 34 GLU HG3 3.50  (# 0.9939 3101:20 2.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 482, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,28,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=32,37,35,36, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=30,40,33,34, &end
#
#  chirality for residue 4 atoms:  CA CG2 CG1 HB
 &rst iat=44,48,52,47, &end
#
#  chirality for residue 4 atoms:  CB CD1 HG12 HG13
 &rst iat=46,55,53,54, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=42,59,45,46, &end
#
#  chirality for residue 5 atoms:  CA CG2 OG1 HB
 &rst iat=63,67,71,66, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=61,73,64,65, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=77,82,80,81, &end
#
#  chirality for residue 6 atoms:  CB CD1 CD2 HG
 &rst iat=79,84,88,83, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=75,92,78,79, &end
#
#  chirality for residue 7 atoms:  CA CG2 CG1 HB
 &rst iat=96,100,104,99, &end
#
#  chirality for residue 7 atoms:  CB CD1 HG12 HG13
 &rst iat=98,107,105,106, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=94,111,97,98, &end
#
#  chirality for residue 8 atoms:  CA OG HB2 HB3
 &rst iat=115,120,118,119, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=113,122,116,117, &end
#
#  chirality for residue 9 atoms:  N C HA2 HA3
 &rst iat=124,129,127,128, &end
#
#  chirality for residue 10 atoms:  CA OG HB2 HB3
 &rst iat=133,138,136,137, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=131,140,134,135, &end
#
#  chirality for residue 11 atoms:  CA CG2 OG1 HB
 &rst iat=144,148,152,147, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=142,154,145,146, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=158,163,161,162, &end
#
#  chirality for residue 12 atoms:  CB CD1 CD2 HG
 &rst iat=160,165,169,164, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=156,173,159,160, &end
#
#  chirality for residue 13 atoms:  N C HA2 HA3
 &rst iat=175,180,178,179, &end
#
#  chirality for residue 14 atoms:  N C HA2 HA3
 &rst iat=182,187,185,186, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=189,197,192,193, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=201,206,204,205, &end
#
#  chirality for residue 16 atoms:  CB CD HG2 HG3
 &rst iat=203,209,207,208, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=199,212,202,203, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=216,221,219,220, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=214,233,217,218, &end
#
#  chirality for residue 18 atoms:  CA CG1 CG2 HB
 &rst iat=237,241,245,240, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=235,249,238,239, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=251,259,254,255, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=263,268,266,267, &end
#
#  chirality for residue 20 atoms:  CB CD HG2 HG3
 &rst iat=265,271,269,270, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=261,274,264,265, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=278,283,281,282, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=276,291,279,280, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=295,300,298,299, &end
#
#  chirality for residue 22 atoms:  CB CD1 CD2 HG
 &rst iat=297,302,306,301, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=293,310,296,297, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=312,320,315,316, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=324,329,327,328, &end
#
#  chirality for residue 24 atoms:  CB CD HG2 HG3
 &rst iat=326,332,330,331, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=322,335,325,326, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=339,344,342,343, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=341,347,345,346, &end
#
#  chirality for residue 25 atoms:  CD NZ HE2 HE3
 &rst iat=347,353,351,352, &end
#
#  chirality for residue 25 atoms:  CG CE HD2 HD3
 &rst iat=344,350,348,349, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=337,357,340,341, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=361,366,364,365, &end
#
#  chirality for residue 26 atoms:  CB CD1 CD2 HG
 &rst iat=363,368,372,367, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=359,376,362,363, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=380,385,383,384, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=382,388,386,387, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=378,391,381,382, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=395,400,398,399, &end
#
#  chirality for residue 28 atoms:  CB CD HG2 HG3
 &rst iat=397,403,401,402, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=393,406,396,397, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=408,416,411,412, &end
#
#  chirality for residue 30 atoms:  N C HA2 HA3
 &rst iat=418,423,421,422, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=427,432,430,431, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=425,443,428,429, &end
#
#  chirality for residue 32 atoms:  CA CG2 OG1 HB
 &rst iat=447,451,455,450, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=445,457,448,449, &end
#
#  chirality for residue 33 atoms:  CA CG2 OG1 HB
 &rst iat=461,465,469,464, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=459,471,462,463, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=475,480,478,479, &end
#
#  chirality for residue 34 atoms:  CB CD HG2 HG3
 &rst iat=477,483,481,482, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=473,486,476,477, &end
#
#  chirality for residue 35 atoms:  CA CG2 OG1 HB
 &rst iat=490,494,498,493, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=488,500,491,492, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=504,509,507,508, &end
#
#  chirality for residue 36 atoms:  CB CD1 CD2 HG
 &rst iat=506,511,515,510, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=502,519,505,506, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=523,528,526,527, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=521,536,524,525, &end
#
#  chirality for residue 38 atoms:  N C HA2 HA3
 &rst iat=538,543,541,542, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=555,549,553,554, &end
#
#  chirality for residue 39 atoms:  CB CD HG2 HG3
 &rst iat=552,546,550,551, &end
#
#  chirality for residue 39 atoms:  CG N HD2 HD3
 &rst iat=549,545,547,548, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=545,557,556,552, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=561,566,564,565, &end
#
#  chirality for residue 40 atoms:  CB CD1 CD2 HG
 &rst iat=563,568,572,567, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=559,576,562,563, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=580,585,583,584, &end
#
#  chirality for residue 41 atoms:  CB CD1 CD2 HG
 &rst iat=582,587,591,586, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=578,595,581,582, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=599,604,602,603, &end
#
#  chirality for residue 42 atoms:  CB CD HG2 HG3
 &rst iat=601,607,605,606, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=597,610,600,601, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=614,619,617,618, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=612,622,615,616, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=626,631,629,630, &end
#
#  chirality for residue 44 atoms:  CB CD1 CD2 HG
 &rst iat=628,633,637,632, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=624,641,627,628, &end
#
#  chirality for residue 45 atoms:  CA CG HB2 HB3
 &rst iat=653,647,651,652, &end
#
#  chirality for residue 45 atoms:  CB CD HG2 HG3
 &rst iat=650,644,648,649, &end
#
#  chirality for residue 45 atoms:  CG N HD2 HD3
 &rst iat=647,643,645,646, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=643,655,654,650, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=657,665,660,661, &end
#
#  chirality for residue 47 atoms:  CA OG HB2 HB3
 &rst iat=669,674,672,673, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=667,676,670,671, &end
#
#  chirality for residue 48 atoms:  N C HA2 HA3
 &rst iat=678,683,681,682, &end
#
#  chirality for residue 49 atoms:  CA CG2 CG1 HB
 &rst iat=687,691,695,690, &end
#
#  chirality for residue 49 atoms:  CB CD1 HG12 HG13
 &rst iat=689,698,696,697, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=685,702,688,689, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=706,711,709,710, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=704,726,707,708, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=730,735,733,734, &end
#
#  chirality for residue 51 atoms:  CB CD1 CD2 HG
 &rst iat=732,737,741,736, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=728,745,731,732, &end
#
#  chirality for residue 52 atoms:  CA CG1 CG2 HB
 &rst iat=749,753,757,752, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=747,761,750,751, &end
#
#  chirality for residue 53 atoms:  CA CG2 CG1 HB
 &rst iat=765,769,773,768, &end
#
#  chirality for residue 53 atoms:  CB CD1 HG12 HG13
 &rst iat=767,776,774,775, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=763,780,766,767, &end
#
#  chirality for residue 54 atoms:  CA OG HB2 HB3
 &rst iat=784,789,787,788, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=782,791,785,786, &end
#
#  chirality for residue 55 atoms:  CA OG HB2 HB3
 &rst iat=795,800,798,799, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=793,802,796,797, &end
#
#  chirality for residue 56 atoms:  CA CG2 OG1 HB
 &rst iat=806,810,814,809, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=804,816,807,808, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=820,825,823,824, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=818,833,821,822, &end
#
#  chirality for residue 58 atoms:  N C HA2 HA3
 &rst iat=835,840,838,839, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=842,850,845,846, &end
#
#  chirality for residue 60 atoms:  N C HA2 HA3
 &rst iat=852,857,855,856, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=861,866,864,865, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=859,869,862,863, &end
#
#  chirality for residue 62 atoms:  CA CG2 CG1 HB
 &rst iat=873,877,881,876, &end
#
#  chirality for residue 62 atoms:  CB CD1 HG12 HG13
 &rst iat=875,884,882,883, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=871,888,874,875, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=900,894,898,899, &end
#
#  chirality for residue 63 atoms:  CB CD HG2 HG3
 &rst iat=897,891,895,896, &end
#
#  chirality for residue 63 atoms:  CG N HD2 HD3
 &rst iat=894,890,892,893, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=890,902,901,897, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=906,911,909,910, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=904,914,907,908, &end
#
#  chirality for residue 65 atoms:  CA CG HB2 HB3
 &rst iat=918,923,921,922, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=916,928,919,920, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=932,937,935,936, &end
#
#  chirality for residue 66 atoms:  CB CD1 CD2 HG
 &rst iat=934,939,943,938, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=930,947,933,934, &end
#
#  chirality for residue 67 atoms:  CA OG HB2 HB3
 &rst iat=951,956,954,955, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=949,958,952,953, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=970,964,968,969, &end
#
#  chirality for residue 68 atoms:  CB CD HG2 HG3
 &rst iat=967,961,965,966, &end
#
#  chirality for residue 68 atoms:  CG N HD2 HD3
 &rst iat=964,960,962,963, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=960,972,971,967, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=976,981,979,980, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=974,992,977,978, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=996,1001,999,1000, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=994,1013,997,998, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1017,1022,1020,1021, &end
#
#  chirality for residue 71 atoms:  CB CD HG2 HG3
 &rst iat=1019,1025,1023,1024, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1015,1028,1018,1019, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1030,1038,1033,1034, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1042,1047,1045,1046, &end
#
#  chirality for residue 73 atoms:  CB CD1 CD2 HG
 &rst iat=1044,1049,1053,1048, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1040,1057,1043,1044, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1061,1066,1064,1065, &end
#
#  chirality for residue 74 atoms:  CB CD HG2 HG3
 &rst iat=1063,1069,1067,1068, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1059,1074,1062,1063, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1078,1083,1081,1082, &end
#
#  chirality for residue 75 atoms:  CB CD HG2 HG3
 &rst iat=1080,1086,1084,1085, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1076,1089,1079,1080, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1093,1098,1096,1097, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1095,1101,1099,1100, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1091,1106,1094,1095, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1110,1115,1113,1114, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1112,1118,1116,1117, &end
#
#  chirality for residue 77 atoms:  CD NZ HE2 HE3
 &rst iat=1118,1124,1122,1123, &end
#
#  chirality for residue 77 atoms:  CG CE HD2 HD3
 &rst iat=1115,1121,1119,1120, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1108,1128,1111,1112, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1140,1134,1138,1139, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1137,1131,1135,1136, &end
#
#  chirality for residue 78 atoms:  CG N HD2 HD3
 &rst iat=1134,1130,1132,1133, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1130,1142,1141,1137, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1146,1151,1149,1150, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1144,1154,1147,1148, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1158,1163,1161,1162, &end
#
#  chirality for residue 80 atoms:  CB CD1 CD2 HG
 &rst iat=1160,1165,1169,1164, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1156,1173,1159,1160, &end
#
#  chirality for residue 81 atoms:  CA OG HB2 HB3
 &rst iat=1177,1182,1180,1181, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1175,1184,1178,1179, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1186,1194,1189,1190, &end
#
#  chirality for residue 83 atoms:  CA CG1 CG2 HB
 &rst iat=1198,1202,1206,1201, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1196,1210,1199,1200, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1214,1219,1217,1218, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1216,1222,1220,1221, &end
#
#  chirality for residue 84 atoms:  CG NE HD2 HD3
 &rst iat=1219,1225,1223,1224, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1212,1234,1215,1216, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1238,1243,1241,1242, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1236,1254,1239,1240, &end
#
#  chirality for residue 86 atoms:  N C HA2 HA3
 &rst iat=1256,1261,1259,1260, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1263,1271,1266,1267, &end
#
#  chirality for residue 88 atoms:  CA CG2 CG1 HB
 &rst iat=1275,1279,1283,1278, &end
#
#  chirality for residue 88 atoms:  CB CD1 HG12 HG13
 &rst iat=1277,1286,1284,1285, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1273,1290,1276,1277, &end
#
#  chirality for residue 89 atoms:  N C HA2 HA3
 &rst iat=1292,1297,1295,1296, &end
#
#  chirality for residue 90 atoms:  CA CG2 CG1 HB
 &rst iat=1301,1305,1309,1304, &end
#
#  chirality for residue 90 atoms:  CB CD1 HG12 HG13
 &rst iat=1303,1312,1310,1311, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1299,1316,1302,1303, &end
#
#  chirality for residue 91 atoms:  N C HA2 HA3
 &rst iat=1318,1323,1321,1322, &end
#
#  chirality for residue 92 atoms:  CA OG HB2 HB3
 &rst iat=1327,1332,1330,1331, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1325,1334,1328,1329, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1338,1343,1341,1342, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1340,1346,1344,1345, &end
#
#  chirality for residue 93 atoms:  CG NE HD2 HD3
 &rst iat=1343,1349,1347,1348, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1336,1358,1339,1340, &end
#
#  chirality for residue 94 atoms:  CA CG HB2 HB3
 &rst iat=1362,1367,1365,1366, &end
#
#  chirality for residue 94 atoms:  CB CD HG2 HG3
 &rst iat=1364,1370,1368,1369, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1360,1373,1363,1364, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1377,1382,1380,1381, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1375,1394,1378,1379, &end
#
#  chirality for residue 96 atoms:  CA CG HB2 HB3
 &rst iat=1398,1403,1401,1402, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1396,1406,1399,1400, &end
#
#  chirality for residue 97 atoms:  CA CG2 OG1 HB
 &rst iat=1410,1414,1418,1413, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1408,1420,1411,1412, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1424,1429,1427,1428, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1422,1440,1425,1426, &end
#
#  chirality for residue 99 atoms:  CA SG HB2 HB3
 &rst iat=1444,1449,1447,1448, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1442,1451,1445,1446, &end
#
#  chirality for residue 100 atoms:  N C HA2 HA3
 &rst iat=1453,1458,1456,1457, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1460,1468,1463,1464, &end
#
#  chirality for residue 102 atoms:  CA CG2 CG1 HB
 &rst iat=1472,1476,1480,1475, &end
#
#  chirality for residue 102 atoms:  CB CD1 HG12 HG13
 &rst iat=1474,1483,1481,1482, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1470,1487,1473,1474, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1491,1496,1494,1495, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1489,1499,1492,1493, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1503,1508,1506,1507, &end
#
#  chirality for residue 104 atoms:  CB CD HG2 HG3
 &rst iat=1505,1511,1509,1510, &end
#
#  chirality for residue 104 atoms:  CD NZ HE2 HE3
 &rst iat=1511,1517,1515,1516, &end
#
#  chirality for residue 104 atoms:  CG CE HD2 HD3
 &rst iat=1508,1514,1512,1513, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1501,1521,1504,1505, &end
#
#  chirality for residue 105 atoms:  CA CG HB2 HB3
 &rst iat=1525,1530,1528,1529, &end
#
#  chirality for residue 105 atoms:  CB CD1 CD2 HG
 &rst iat=1527,1532,1536,1531, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1523,1540,1526,1527, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=1544,1549,1547,1548, &end
#
#  chirality for residue 106 atoms:  CB CD HG2 HG3
 &rst iat=1546,1552,1550,1551, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1542,1555,1545,1546, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1557,1565,1560,1561, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1569,1574,1572,1573, &end
#
#  chirality for residue 108 atoms:  CB CD HG2 HG3
 &rst iat=1571,1577,1575,1576, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1567,1580,1570,1571, &end
#
#  chirality for residue 109 atoms:  CA CG HB2 HB3
 &rst iat=1584,1589,1587,1588, &end
#
#  chirality for residue 109 atoms:  CB CD1 CD2 HG
 &rst iat=1586,1591,1595,1590, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1582,1599,1585,1586, &end
#
#  chirality for residue 110 atoms:  CA CG HB2 HB3
 &rst iat=1603,1608,1606,1607, &end
#
#  chirality for residue 110 atoms:  CB CD HG2 HG3
 &rst iat=1605,1611,1609,1610, &end
#
#  chirality for residue 110 atoms:  CD NZ HE2 HE3
 &rst iat=1611,1617,1615,1616, &end
#
#  chirality for residue 110 atoms:  CG CE HD2 HD3
 &rst iat=1608,1614,1612,1613, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1601,1621,1604,1605, &end
#
#  chirality for residue 111 atoms:  CA CG HB2 HB3
 &rst iat=1625,1630,1628,1629, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1623,1635,1626,1627, &end
#
#  chirality for residue 112 atoms:  CA OG HB2 HB3
 &rst iat=1639,1644,1642,1643, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1637,1646,1640,1641, &end
#
#  chirality for residue 113 atoms:  N C HA2 HA3
 &rst iat=1648,1653,1651,1652, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1655,1663,1658,1659, &end
#
#  chirality for residue 115 atoms:  CA CG HB2 HB3
 &rst iat=1667,1672,1670,1671, &end
#
#  chirality for residue 115 atoms:  CB CD HG2 HG3
 &rst iat=1669,1675,1673,1674, &end
#
#  chirality for residue 115 atoms:  CD NZ HE2 HE3
 &rst iat=1675,1681,1679,1680, &end
#
#  chirality for residue 115 atoms:  CG CE HD2 HD3
 &rst iat=1672,1678,1676,1677, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1665,1685,1668,1669, &end
#
#  chirality for residue 116 atoms:  CA CG HB2 HB3
 &rst iat=1689,1694,1692,1693, &end
#
#  chirality for residue 116 atoms:  CB CD HG2 HG3
 &rst iat=1691,1697,1695,1696, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1687,1702,1690,1691, &end
#
#  chirality for residue 117 atoms:  CA CG2 OG1 HB
 &rst iat=1706,1710,1714,1709, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1704,1716,1707,1708, &end
#
#  chirality for residue 118 atoms:  N C HA2 HA3
 &rst iat=1718,1723,1721,1722, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1727,1732,1730,1731, &end
#
#  chirality for residue 119 atoms:  CB CD HG2 HG3
 &rst iat=1729,1735,1733,1734, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1725,1738,1728,1729, &end
#
#  chirality for residue 120 atoms:  CA CG2 OG1 HB
 &rst iat=1742,1746,1750,1745, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1740,1752,1743,1744, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1756,1761,1759,1760, &end
#
#  chirality for residue 121 atoms:  CB CD1 CD2 HG
 &rst iat=1758,1763,1767,1762, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1754,1771,1757,1758, &end
#
#  chirality for residue 122 atoms:  CA CG HB2 HB3
 &rst iat=1775,1780,1778,1779, &end
#
#  chirality for residue 122 atoms:  CB CD HG2 HG3
 &rst iat=1777,1783,1781,1782, &end
#
#  chirality for residue 122 atoms:  CD NZ HE2 HE3
 &rst iat=1783,1789,1787,1788, &end
#
#  chirality for residue 122 atoms:  CG CE HD2 HD3
 &rst iat=1780,1786,1784,1785, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1773,1793,1776,1777, &end
#
#  chirality for residue 123 atoms:  CA CG2 CG1 HB
 &rst iat=1797,1801,1805,1800, &end
#
#  chirality for residue 123 atoms:  CB CD1 HG12 HG13
 &rst iat=1799,1808,1806,1807, &end
#
#  chirality for residue 123 atoms:  N C HA CB
 &rst iat=1795,1812,1798,1799, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1816,1821,1819,1820, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1814,1826,1817,1818, &end
#
#  chirality for residue 125 atoms:  CA CG2 CG1 HB
 &rst iat=1830,1834,1838,1833, &end
#
#  chirality for residue 125 atoms:  CB CD1 HG12 HG13
 &rst iat=1832,1841,1839,1840, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=1828,1845,1831,1832, &end
#
#  chirality for residue 126 atoms:  CA CG HB2 HB3
 &rst iat=1849,1854,1852,1853, &end
#
#  chirality for residue 126 atoms:  CB CD1 CD2 HG
 &rst iat=1851,1856,1860,1855, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=1847,1864,1850,1851, &end
#
#  chirality for residue 127 atoms:  CA CG HB2 HB3
 &rst iat=1868,1873,1871,1872, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=1866,1876,1869,1870, &end
#
#  chirality for residue 128 atoms:  CA CG HB2 HB3
 &rst iat=1880,1885,1883,1884, &end
#
#  chirality for residue 128 atoms:  N C HA CB
 &rst iat=1878,1893,1881,1882, &end
#
#  chirality for residue 129 atoms:  CA CG HB2 HB3
 &rst iat=1897,1902,1900,1901, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=1895,1905,1898,1899, &end
#
#  chirality for residue 130 atoms:  CA CG2 CG1 HB
 &rst iat=1909,1913,1917,1912, &end
#
#  chirality for residue 130 atoms:  CB CD1 HG12 HG13
 &rst iat=1911,1920,1918,1919, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=1907,1924,1910,1911, &end
#
#  chirality for residue 131 atoms:  CA CG HB2 HB3
 &rst iat=1936,1930,1934,1935, &end
#
#  chirality for residue 131 atoms:  CB CD HG2 HG3
 &rst iat=1933,1927,1931,1932, &end
#
#  chirality for residue 131 atoms:  CG N HD2 HD3
 &rst iat=1930,1926,1928,1929, &end
#
#  chirality for residue 131 atoms:  N C HA CB
 &rst iat=1926,1938,1937,1933, &end
#
#  chirality for residue 132 atoms:  CA CG HB2 HB3
 &rst iat=1942,1947,1945,1946, &end
#
#  chirality for residue 132 atoms:  CB CD HG2 HG3
 &rst iat=1944,1950,1948,1949, &end
#
#  chirality for residue 132 atoms:  N C HA CB
 &rst iat=1940,1953,1943,1944, &end
#
#  chirality for residue 133 atoms:  CA CG HB2 HB3
 &rst iat=1957,1962,1960,1961, &end
#
#  chirality for residue 133 atoms:  N C HA CB
 &rst iat=1955,1965,1958,1959, &end
#
#  chirality for residue 134 atoms:  CA CG HB2 HB3
 &rst iat=1977,1971,1975,1976, &end
#
#  chirality for residue 134 atoms:  CB CD HG2 HG3
 &rst iat=1974,1968,1972,1973, &end
#
#  chirality for residue 134 atoms:  CG N HD2 HD3
 &rst iat=1971,1967,1969,1970, &end
#
#  chirality for residue 134 atoms:  N C HA CB
 &rst iat=1967,1979,1978,1974, &end
#
#  chirality for residue 135 atoms:  N C HA CB
 &rst iat=1981,1989,1984,1985, &end
#
#  chirality for residue 136 atoms:  CA CG HB2 HB3
 &rst iat=1993,1998,1996,1997, &end
#
#  chirality for residue 136 atoms:  CB CD HG2 HG3
 &rst iat=1995,2001,1999,2000, &end
#
#  chirality for residue 136 atoms:  N C HA CB
 &rst iat=1991,2004,1994,1995, &end
#
#  chirality for residue 137 atoms:  CA CG HB2 HB3
 &rst iat=2008,2013,2011,2012, &end
#
#  chirality for residue 137 atoms:  CB CD HG2 HG3
 &rst iat=2010,2016,2014,2015, &end
#
#  chirality for residue 137 atoms:  N C HA CB
 &rst iat=2006,2019,2009,2010, &end
#
#  chirality for residue 138 atoms:  CA CG HB2 HB3
 &rst iat=2023,2028,2026,2027, &end
#
#  chirality for residue 138 atoms:  N C HA CB
 &rst iat=2021,2043,2024,2025, &end
#
#  chirality for residue 139 atoms:  CA CG HB2 HB3
 &rst iat=2047,2052,2050,2051, &end
#
#  chirality for residue 139 atoms:  CB CD1 CD2 HG
 &rst iat=2049,2054,2058,2053, &end
#
#  chirality for residue 139 atoms:  N C HA CB
 &rst iat=2045,2062,2048,2049, &end
#
#  chirality for residue 140 atoms:  N C HA2 HA3
 &rst iat=2064,2069,2067,2068, &end
#
#  chirality for residue 141 atoms:  CA OG HB2 HB3
 &rst iat=2073,2078,2076,2077, &end
#
#  chirality for residue 141 atoms:  N C HA CB
 &rst iat=2071,2080,2074,2075, &end
#
#  chirality for residue 142 atoms:  CA CG HB2 HB3
 &rst iat=2084,2089,2087,2088, &end
#
#  chirality for residue 142 atoms:  N C HA CB
 &rst iat=2082,2104,2085,2086, &end
#
#  chirality for residue 143 atoms:  CA CG1 CG2 HB
 &rst iat=2108,2112,2116,2111, &end
#
#  chirality for residue 143 atoms:  N C HA CB
 &rst iat=2106,2120,2109,2110, &end
#
#  chirality for residue 144 atoms:  CA CG HB2 HB3
 &rst iat=2124,2129,2127,2128, &end
#
#  chirality for residue 144 atoms:  N C HA CB
 &rst iat=2122,2134,2125,2126, &end
#
#  chirality for residue 145 atoms:  CA CG HB2 HB3
 &rst iat=2138,2143,2141,2142, &end
#
#  chirality for residue 145 atoms:  CB CD1 CD2 HG
 &rst iat=2140,2145,2149,2144, &end
#
#  chirality for residue 145 atoms:  N C HA CB
 &rst iat=2136,2153,2139,2140, &end
#
#  chirality for residue 146 atoms:  CA CG HB2 HB3
 &rst iat=2157,2162,2160,2161, &end
#
#  chirality for residue 146 atoms:  CB CD1 CD2 HG
 &rst iat=2159,2164,2168,2163, &end
#
#  chirality for residue 146 atoms:  N C HA CB
 &rst iat=2155,2172,2158,2159, &end
#
#  chirality for residue 147 atoms:  CA CG HB2 HB3
 &rst iat=2176,2181,2179,2180, &end
#
#  chirality for residue 147 atoms:  CB CD HG2 HG3
 &rst iat=2178,2184,2182,2183, &end
#
#  chirality for residue 147 atoms:  CD NZ HE2 HE3
 &rst iat=2184,2190,2188,2189, &end
#
#  chirality for residue 147 atoms:  CG CE HD2 HD3
 &rst iat=2181,2187,2185,2186, &end
#
#  chirality for residue 147 atoms:  N C HA CB
 &rst iat=2174,2194,2177,2178, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=32,30,28,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=44,42,40,32, &end
#
#  trans-omega constraint for residue 5
 &rst iat=63,61,59,44, &end
#
#  trans-omega constraint for residue 6
 &rst iat=77,75,73,63, &end
#
#  trans-omega constraint for residue 7
 &rst iat=96,94,92,77, &end
#
#  trans-omega constraint for residue 8
 &rst iat=115,113,111,96, &end
#
#  trans-omega constraint for residue 9
 &rst iat=126,124,122,115, &end
#
#  trans-omega constraint for residue 10
 &rst iat=133,131,129,126, &end
#
#  trans-omega constraint for residue 11
 &rst iat=144,142,140,133, &end
#
#  trans-omega constraint for residue 12
 &rst iat=158,156,154,144, &end
#
#  trans-omega constraint for residue 13
 &rst iat=177,175,173,158, &end
#
#  trans-omega constraint for residue 14
 &rst iat=184,182,180,177, &end
#
#  trans-omega constraint for residue 15
 &rst iat=191,189,187,184, &end
#
#  trans-omega constraint for residue 16
 &rst iat=201,199,197,191, &end
#
#  trans-omega constraint for residue 17
 &rst iat=216,214,212,201, &end
#
#  trans-omega constraint for residue 18
 &rst iat=237,235,233,216, &end
#
#  trans-omega constraint for residue 19
 &rst iat=253,251,249,237, &end
#
#  trans-omega constraint for residue 20
 &rst iat=263,261,259,253, &end
#
#  trans-omega constraint for residue 21
 &rst iat=278,276,274,263, &end
#
#  trans-omega constraint for residue 22
 &rst iat=295,293,291,278, &end
#
#  trans-omega constraint for residue 23
 &rst iat=314,312,310,295, &end
#
#  trans-omega constraint for residue 24
 &rst iat=324,322,320,314, &end
#
#  trans-omega constraint for residue 25
 &rst iat=339,337,335,324, &end
#
#  trans-omega constraint for residue 26
 &rst iat=361,359,357,339, &end
#
#  trans-omega constraint for residue 27
 &rst iat=380,378,376,361, &end
#
#  trans-omega constraint for residue 28
 &rst iat=395,393,391,380, &end
#
#  trans-omega constraint for residue 29
 &rst iat=410,408,406,395, &end
#
#  trans-omega constraint for residue 30
 &rst iat=420,418,416,410, &end
#
#  trans-omega constraint for residue 31
 &rst iat=427,425,423,420, &end
#
#  trans-omega constraint for residue 32
 &rst iat=447,445,443,427, &end
#
#  trans-omega constraint for residue 33
 &rst iat=461,459,457,447, &end
#
#  trans-omega constraint for residue 34
 &rst iat=475,473,471,461, &end
#
#  trans-omega constraint for residue 35
 &rst iat=490,488,486,475, &end
#
#  trans-omega constraint for residue 36
 &rst iat=504,502,500,490, &end
#
#  trans-omega constraint for residue 37
 &rst iat=523,521,519,504, &end
#
#  trans-omega constraint for residue 38
 &rst iat=540,538,536,523, &end
#
#  trans-omega constraint for residue 39
 &rst iat=555,545,543,540, &end
#
#  trans-omega constraint for residue 40
 &rst iat=561,559,557,555, &end
#
#  trans-omega constraint for residue 41
 &rst iat=580,578,576,561, &end
#
#  trans-omega constraint for residue 42
 &rst iat=599,597,595,580, &end
#
#  trans-omega constraint for residue 43
 &rst iat=614,612,610,599, &end
#
#  trans-omega constraint for residue 44
 &rst iat=626,624,622,614, &end
#
#  trans-omega constraint for residue 45
 &rst iat=653,643,641,626, &end
#
#  trans-omega constraint for residue 46
 &rst iat=659,657,655,653, &end
#
#  trans-omega constraint for residue 47
 &rst iat=669,667,665,659, &end
#
#  trans-omega constraint for residue 48
 &rst iat=680,678,676,669, &end
#
#  trans-omega constraint for residue 49
 &rst iat=687,685,683,680, &end
#
#  trans-omega constraint for residue 50
 &rst iat=706,704,702,687, &end
#
#  trans-omega constraint for residue 51
 &rst iat=730,728,726,706, &end
#
#  trans-omega constraint for residue 52
 &rst iat=749,747,745,730, &end
#
#  trans-omega constraint for residue 53
 &rst iat=765,763,761,749, &end
#
#  trans-omega constraint for residue 54
 &rst iat=784,782,780,765, &end
#
#  trans-omega constraint for residue 55
 &rst iat=795,793,791,784, &end
#
#  trans-omega constraint for residue 56
 &rst iat=806,804,802,795, &end
#
#  trans-omega constraint for residue 57
 &rst iat=820,818,816,806, &end
#
#  trans-omega constraint for residue 58
 &rst iat=837,835,833,820, &end
#
#  trans-omega constraint for residue 59
 &rst iat=844,842,840,837, &end
#
#  trans-omega constraint for residue 60
 &rst iat=854,852,850,844, &end
#
#  trans-omega constraint for residue 61
 &rst iat=861,859,857,854, &end
#
#  trans-omega constraint for residue 62
 &rst iat=873,871,869,861, &end
#
#  trans-omega constraint for residue 63
 &rst iat=900,890,888,873, &end
#
#  trans-omega constraint for residue 64
 &rst iat=906,904,902,900, &end
#
#  trans-omega constraint for residue 65
 &rst iat=918,916,914,906, &end
#
#  trans-omega constraint for residue 66
 &rst iat=932,930,928,918, &end
#
#  trans-omega constraint for residue 67
 &rst iat=951,949,947,932, &end
#
#  trans-omega constraint for residue 68
 &rst iat=970,960,958,951, &end
#
#  trans-omega constraint for residue 69
 &rst iat=976,974,972,970, &end
#
#  trans-omega constraint for residue 70
 &rst iat=996,994,992,976, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1017,1015,1013,996, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1032,1030,1028,1017, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1042,1040,1038,1032, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1061,1059,1057,1042, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1078,1076,1074,1061, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1093,1091,1089,1078, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1110,1108,1106,1093, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1140,1130,1128,1110, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1146,1144,1142,1140, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1158,1156,1154,1146, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1177,1175,1173,1158, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1188,1186,1184,1177, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1198,1196,1194,1188, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1214,1212,1210,1198, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1238,1236,1234,1214, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1258,1256,1254,1238, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1265,1263,1261,1258, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1275,1273,1271,1265, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1294,1292,1290,1275, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1301,1299,1297,1294, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1320,1318,1316,1301, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1327,1325,1323,1320, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1338,1336,1334,1327, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1362,1360,1358,1338, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1377,1375,1373,1362, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1398,1396,1394,1377, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1410,1408,1406,1398, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1424,1422,1420,1410, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1444,1442,1440,1424, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1455,1453,1451,1444, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1462,1460,1458,1455, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1472,1470,1468,1462, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1491,1489,1487,1472, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1503,1501,1499,1491, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1525,1523,1521,1503, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1544,1542,1540,1525, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1559,1557,1555,1544, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1569,1567,1565,1559, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1584,1582,1580,1569, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1603,1601,1599,1584, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1625,1623,1621,1603, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1639,1637,1635,1625, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1650,1648,1646,1639, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1657,1655,1653,1650, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1667,1665,1663,1657, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1689,1687,1685,1667, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1706,1704,1702,1689, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1720,1718,1716,1706, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1727,1725,1723,1720, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1742,1740,1738,1727, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1756,1754,1752,1742, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1775,1773,1771,1756, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1797,1795,1793,1775, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1816,1814,1812,1797, &end
#
#  trans-omega constraint for residue 125
 &rst iat=1830,1828,1826,1816, &end
#
#  trans-omega constraint for residue 126
 &rst iat=1849,1847,1845,1830, &end
#
#  trans-omega constraint for residue 127
 &rst iat=1868,1866,1864,1849, &end
#
#  trans-omega constraint for residue 128
 &rst iat=1880,1878,1876,1868, &end
#
#  trans-omega constraint for residue 129
 &rst iat=1897,1895,1893,1880, &end
#
#  trans-omega constraint for residue 130
 &rst iat=1909,1907,1905,1897, &end
#
#  trans-omega constraint for residue 131
 &rst iat=1936,1926,1924,1909, &end
#
#  trans-omega constraint for residue 132
 &rst iat=1942,1940,1938,1936, &end
#
#  trans-omega constraint for residue 133
 &rst iat=1957,1955,1953,1942, &end
#
#  trans-omega constraint for residue 134
 &rst iat=1977,1967,1965,1957, &end
#
#  trans-omega constraint for residue 135
 &rst iat=1983,1981,1979,1977, &end
#
#  trans-omega constraint for residue 136
 &rst iat=1993,1991,1989,1983, &end
#
#  trans-omega constraint for residue 137
 &rst iat=2008,2006,2004,1993, &end
#
#  trans-omega constraint for residue 138
 &rst iat=2023,2021,2019,2008, &end
#
#  trans-omega constraint for residue 139
 &rst iat=2047,2045,2043,2023, &end
#
#  trans-omega constraint for residue 140
 &rst iat=2066,2064,2062,2047, &end
#
#  trans-omega constraint for residue 141
 &rst iat=2073,2071,2069,2066, &end
#
#  trans-omega constraint for residue 142
 &rst iat=2084,2082,2080,2073, &end
#
#  trans-omega constraint for residue 143
 &rst iat=2108,2106,2104,2084, &end
#
#  trans-omega constraint for residue 144
 &rst iat=2124,2122,2120,2108, &end
#
#  trans-omega constraint for residue 145
 &rst iat=2138,2136,2134,2124, &end
#
#  trans-omega constraint for residue 146
 &rst iat=2157,2155,2153,2138, &end
#
#  trans-omega constraint for residue 147
 &rst iat=2176,2174,2172,2157, &end
#
#   33 THR  MG2          33 THR  HB          4.50    (#      0:20  Unique         2.25, 2.64 A)
 &rst
  ixpk= 0, nxpk= 20, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1= 466, 467, 468,
 &end
#
#    6 LEU  MDY          33 THR  HB          4.50    (#      1:20  Unique         1.97, 4.04 A)
 &rst
  ixpk= 1, nxpk= 20, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  85,  86,  87,  89,  90,  91,
 &end
#
#   56 THR  MG2          56 THR  HB          4.50    (#      2:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2, nxpk= 20, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 811, 812, 813,
 &end
#
#   32 THR  MG2          32 THR  HB          3.50    (#      3:20  Unique         2.41, 2.64 A)
 &rst
  ixpk= 3, nxpk= 20, iat=  -1, 450, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 452, 453, 454,
 &end
#
#  117 THR  MG2         117 THR  HB          3.50    (#      4:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 4, nxpk= 20, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1711,1712,1713,
 &end
#
#   97 THR  MG2          97 THR  HB          3.50    (#      5:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 5, nxpk= 20, iat=  -1,1413, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1415,1416,1417,
 &end
#
#    5 THR  MG2           5 THR  HB          4.50    (#      6:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 6, nxpk= 20, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  68,  69,  70,
 &end
#
#   11 THR  MG2          11 THR  HB          3.50    (#      7:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 7, nxpk= 20, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 149, 150, 151,
 &end
#
#  120 THR  MG2         120 THR  HB          3.50    (#      8:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 8, nxpk= 20, iat=  -1,1745, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1747,1748,1749,
 &end
#
#   35 THR  MG2          35 THR  HB          3.50    (#      9:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 9, nxpk= 20, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 495, 496, 497,
 &end
#
#   18 VAL  MGX          18 VAL  HA          4.50    (#     10:20  Unique         2.30, 3.42 A)
 &rst
  ixpk= 10, nxpk= 20, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#   18 VAL  MGY          18 VAL  HA          4.50    (#     11:20  Unique         2.30, 3.42 A)
 &rst
  ixpk= 11, nxpk= 20, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:12      68 PRO  HA          4.50    (#     12:20  Single Ambig)
 &rst
  ixpk= 12, nxpk= 20, iat=  -1, 971, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 968, 969,1023,1024,
 &end
#
#    0 AMB  20-2:13      68 PRO  HA          3.50    (#     13:20  Single Ambig)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1, 971, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 968, 969,1020,1021,
 &end
#
#   66 LEU  MDY          54 SER  HB+         5.50    (#     14:20  Unique         1.99, 4.01 A)
 &rst
  ixpk= 14, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 787, 788,
 &end
#
#   66 LEU  MDY          54 SER  HB-         5.50    (#     16:20  Unique         1.99, 4.01 A)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 787, 788,
 &end
#
#    0 AMB  20-2:18     143 VAL  HA          3.50    (#     18:20  Single Ambig)
 &rst
  ixpk= 18, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#  143 VAL  HB          143 VAL  HA          4.50    (#     19:20  Unique         2.99, 3.00 A)
 &rst
  ixpk= 19, nxpk= 20, iat=2111,2109, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  146 LEU  MDY         143 VAL  HA          4.50    (#     20:20  Unique         1.97, 4.02 A)
 &rst
  ixpk= 20, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   82 ALA  MB           47 SER  HB-         4.50    (#     23:20  Unique         2.77, 4.84 A)
 &rst
  ixpk= 23, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1191,1192,1193,
 igr2= 672, 673,
 &end
#
#   82 ALA  MB           47 SER  HB+         4.50    (#     24:20  Unique         2.77, 4.84 A)
 &rst
  ixpk= 24, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1191,1192,1193,
 igr2= 672, 673,
 &end
#
#   48 GLY  HA-          47 SER  HB+         4.50    (#     26:20  Unique         4.50, 4.87 A)
 &rst
  ixpk= 26, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 681, 682,
 igr2= 672, 673,
 &end
#
#   80 LEU  HG          112 SER  HB+         7.00    (#     28:20  Unique         3.83, 4.78 A)
 &rst
  ixpk= 28, nxpk= 20, iat=1164,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1642,1643,
 &end
#
#   80 LEU  MDY         112 SER  HB-         4.50    (#     29:20  Unique         2.07, 4.79 A)
 &rst
  ixpk= 29, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1166,1167,1168,1170,1171,1172,
 igr2=1642,1643,
 &end
#
#   87 ALA  MB          120 THR  HA          4.50    (#     35:20  Unique         2.29, 3.67 A)
 &rst
  ixpk= 35, nxpk= 20, iat=  -1,1743, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1268,1269,1270,
 &end
#
#  120 THR  MG2         120 THR  HA          3.50    (#     36:20  Unique         2.47, 3.66 A)
 &rst
  ixpk= 36, nxpk= 20, iat=  -1,1743, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1747,1748,1749,
 &end
#
#  131 PRO  HB-         131 PRO  HA          5.50    (#     37:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 37, nxpk= 20, iat=  -1,1937, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1934,1935,
 &end
#
#   39 PRO  HB+          39 PRO  HA          3.50    (#     39:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1, 556, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 553, 554,
 &end
#
#   11 THR  MG2          11 THR  HA          4.50    (#     40:20  Unique         2.23, 3.73 A)
 &rst
  ixpk= 40, nxpk= 20, iat=  -1, 145, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 149, 150, 151,
 &end
#
#    0 AMB  20-2:41     142 TRP  HA          4.50    (#     41:20  Single Ambig)
 &rst
  ixpk= 41, nxpk= 20, iat=  -1,2085, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2076,2077,2076,2077,
 &end
#
#  142 TRP  HB-         142 TRP  HA          4.50    (#     42:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 42, nxpk= 20, iat=  -1,2085, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2087,2088,
 &end
#
#  145 LEU  MDX         142 TRP  HA          4.50    (#     45:20  Unique         2.70, 4.06 A)
 &rst
  ixpk= 45, nxpk= 20, iat=  -1,2085, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2146,2147,2148,2150,2151,2152,
 &end
#
#   78 PRO  HB+          78 PRO  HA          3.50    (#     46:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 46, nxpk= 20, iat=  -1,1141, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1138,1139,
 &end
#
#   78 PRO  HB-          78 PRO  HA          4.50    (#     47:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 47, nxpk= 20, iat=  -1,1141, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1138,1139,
 &end
#
#  117 THR  MG2         117 THR  HA          3.50    (#     48:20  Unique         2.34, 3.14 A)
 &rst
  ixpk= 48, nxpk= 20, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1711,1712,1713,
 &end
#
#   83 VAL  MGY          83 VAL  HA          4.50    (#     51:20  Unique         2.33, 3.50 A)
 &rst
  ixpk= 51, nxpk= 20, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   83 VAL  HB           83 VAL  HA          7.00    (#     52:20  Unique         2.40, 2.42 A)
 &rst
  ixpk= 52, nxpk= 20, iat=1201,1199, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   83 VAL  MGX          83 VAL  HA          4.50    (#     54:20  Unique         2.33, 3.50 A)
 &rst
  ixpk= 54, nxpk= 20, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    7 ILE  HB           52 VAL  HA          4.50    (#     55:20  Unique         2.11, 2.29 A)
 &rst
  ixpk= 55, nxpk= 20, iat=  99, 750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:56      52 VAL  HA          4.50    (#     56:20  Single Ambig)
 &rst
  ixpk= 56, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 754, 755, 756, 758, 759, 760, 105, 106,
 &end
#
#   52 VAL  MGY          52 VAL  HA          4.50    (#     57:20  Unique         2.37, 3.52 A)
 &rst
  ixpk= 57, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#  141 SER  HB-         138 TRP  HA          7.00    (#     58:20  Unique         2.94, 3.66 A)
 &rst
  ixpk= 58, nxpk= 20, iat=  -1,2024, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2076,2077,
 &end
#
#  138 TRP  HB+         138 TRP  HA          3.50    (#     59:20  Unique         2.62, 2.84 A)
 &rst
  ixpk= 59, nxpk= 20, iat=  -1,2024, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2026,2027,
 &end
#
#    0 AMB  20-2:60       0 AMB  20-1:60     4.50    (#     60:20  Double Ambig)
 &rst
  ixpk= 60, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 962, 963, 962, 963,
 igr2= 954, 955, 954, 955,
 &end
#
#    0 AMB  20-2:61       0 AMB  20-1:61     4.50    (#     61:20  Double Ambig)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 962, 963, 962, 963,
 igr2= 954, 955, 954, 955,
 &end
#
#    0 AMB  20-2:62      81 SER  HA          3.50    (#     62:20  Single Ambig)
 &rst
  ixpk= 62, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1180,1181,1180,1181,
 &end
#
#    0 AMB  20-2:63       0 AMB  20-1:63     5.50    (#     63:20  Double Ambig)
 &rst
  ixpk= 63, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 940, 941, 942, 944, 945, 946, 166, 167, 168, 170,
       171, 172,
 igr2= 954, 955, 954, 955, 954, 955,
 &end
#
#   73 LEU  MDY          70 TYR  HA          4.50    (#     64:20  Unique         1.99, 4.25 A)
 &rst
  ixpk= 64, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#   70 TYR  HB-          70 TYR  HA          4.50    (#     65:20  Unique         2.23, 2.56 A)
 &rst
  ixpk= 65, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 999,1000,
 &end
#
#   97 THR  HB           97 THR  HA          4.50    (#     66:20  Unique         2.38, 2.51 A)
 &rst
  ixpk= 66, nxpk= 20, iat=1413,1411, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 THR  MG2          97 THR  HA          3.50    (#     67:20  Unique         2.14, 3.27 A)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1,1411, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1415,1416,1417,
 &end
#
#   72 ALA  MB           69 PHE  HA          4.50    (#     68:20  Unique         3.23, 4.18 A)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1, 977, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1035,1036,1037,
 &end
#
#   70 TYR  HB+          70 TYR  HA          5.50    (#     69:20  Unique         2.23, 2.56 A)
 &rst
  ixpk= 69, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 999,1000,
 &end
#
#   69 PHE  HB+          69 PHE  HA          5.50    (#     70:20  Unique         2.71, 2.84 A)
 &rst
  ixpk= 70, nxpk= 20, iat=  -1, 977, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 979, 980,
 &end
#
#   69 PHE  HB-          69 PHE  HA          7.00    (#     71:20  Unique         2.71, 2.84 A)
 &rst
  ixpk= 71, nxpk= 20, iat=  -1, 977, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 979, 980,
 &end
#
#    0 AMB  20-2:72     141 SER  HA          5.50    (#     72:20  Single Ambig)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:73     141 SER  HA          3.50    (#     73:20  Single Ambig)
 &rst
  ixpk= 73, nxpk= 20, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2076,2077,2076,2077,
 &end
#
#  123 ILE  MG2         123 ILE  HA          4.50    (#     74:20  Unique         2.26, 2.93 A)
 &rst
  ixpk= 74, nxpk= 20, iat=  -1,1798, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1802,1803,1804,
 &end
#
#  136 GLU  HG+         136 GLU  HA          4.50    (#     75:20  Unique         3.56, 3.76 A)
 &rst
  ixpk= 75, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1999,2000,
 &end
#
#  136 GLU  HB+         136 GLU  HA          3.50    (#     76:20  Unique         2.38, 2.45 A)
 &rst
  ixpk= 76, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1996,1997,
 &end
#
#    7 ILE  MG2           7 ILE  HA          7.00    (#     77:20  Unique         2.22, 2.90 A)
 &rst
  ixpk= 77, nxpk= 20, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 101, 102, 103,
 &end
#
#  139 LEU  HB+         136 GLU  HA          4.50    (#     78:20  Unique         2.82, 3.82 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2050,2051,
 &end
#
#  139 LEU  HB-         136 GLU  HA          4.50    (#     79:20  Unique         2.82, 3.82 A)
 &rst
  ixpk= 79, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2050,2051,
 &end
#
#  109 LEU  MDY         106 GLU  HA          4.50    (#     80:20  Unique         2.23, 4.25 A)
 &rst
  ixpk= 80, nxpk= 20, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:81     110 LYS  HA          3.50    (#     81:20  Single Ambig)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,1604, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1606,1607,1606,1607,
 &end
#
#  110 LYS  HG+         110 LYS  HA          4.50    (#     82:20  Unique         2.81, 2.94 A)
 &rst
  ixpk= 82, nxpk= 20, iat=  -1,1604, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1609,1610,
 &end
#
#  109 LEU  MDY         106 GLU  HA          5.50    (#     83:20  Unique         2.23, 4.25 A)
 &rst
  ixpk= 83, nxpk= 20, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:84     106 GLU  HA          3.50    (#     84:20  Single Ambig)
 &rst
  ixpk= 84, nxpk= 20, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1550,1551,1547,1548,
 &end
#
#  109 LEU  HB+         106 GLU  HA          5.50    (#     85:20  Unique         2.13, 2.97 A)
 &rst
  ixpk= 85, nxpk= 20, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1587,1588,
 &end
#
#  106 GLU  HG+         106 GLU  HA          7.00    (#     86:20  Unique         2.07, 3.01 A)
 &rst
  ixpk= 86, nxpk= 20, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1550,1551,
 &end
#
#    0 AMB  20-2:87       0 AMB  20-1:87     3.50    (#     87:20  Double Ambig)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 269, 270, 330, 331,
 igr2= 264, 325,
 &end
#
#   23 ALA  MB            0 AMB  20-1:88     4.50    (#     88:20  Single Ambig)
 &rst
  ixpk= 88, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 317, 318, 319,
 igr2= 264, 325,
 &end
#
#   88 ILE  MG2          88 ILE  HA          5.50    (#     89:20  Unique         2.29, 3.05 A)
 &rst
  ixpk= 89, nxpk= 20, iat=  -1,1276, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1280,1281,1282,
 &end
#
#  104 LYS  HB+         104 LYS  HA          4.50    (#     90:20  Unique         2.46, 2.77 A)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1506,1507,
 &end
#
#  107 ALA  MB          104 LYS  HA          4.50    (#     91:20  Unique         2.09, 2.96 A)
 &rst
  ixpk= 91, nxpk= 20, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1562,1563,1564,
 &end
#
#  104 LYS  HG-         104 LYS  HA          4.50    (#     95:20  Unique         2.29, 2.92 A)
 &rst
  ixpk= 95, nxpk= 20, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1509,1510,
 &end
#
#    0 AMB  20-2:96      24 GLU  HA          2.80    (#     96:20  Single Ambig)
 &rst
  ixpk= 96, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 327, 328, 383, 384, 383, 384,
 &end
#
#  108 GLU  HG+         104 LYS  HA          4.50    (#     98:20  Unique         4.51, 5.34 A)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1575,1576,
 &end
#
#  137 GLU  HB+         137 GLU  HA          3.50    (#     99:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 99, nxpk= 20, iat=  -1,2009, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2011,2012,
 &end
#
#    0 AMB  20-2:100      0 AMB  20-1:100    5.50    (#    100:20  Double Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1447,1448, 386, 387,
 igr2=1445, 325,
 &end
#
#  121 LEU  HB+          88 ILE  HA          4.50    (#    101:20  Unique         2.09, 2.65 A)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1,1276, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1759,1760,
 &end
#
#   71 GLU  HG+          71 GLU  HA          5.50    (#    102:20  Unique         2.16, 2.83 A)
 &rst
  ixpk= 102, nxpk= 20, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1023,1024,
 &end
#
#   28 GLU  HG+          28 GLU  HA          5.50    (#    103:20  Unique         2.86, 3.34 A)
 &rst
  ixpk= 103, nxpk= 20, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 401, 402,
 &end
#
#   28 GLU  HB-          28 GLU  HA          3.50    (#    104:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 398, 399,
 &end
#
#   71 GLU  HG-          71 GLU  HA          4.50    (#    105:20  Unique         2.16, 2.83 A)
 &rst
  ixpk= 105, nxpk= 20, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1023,1024,
 &end
#
#    0 AMB  20-2:106     71 GLU  HA          3.50    (#    106:20  Single Ambig)
 &rst
  ixpk= 106, nxpk= 20, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1020,1021,1081,1082,
 &end
#
#   21 HIS  HB+          21 HIS  HA          4.50    (#    107:20  Unique         2.40, 2.73 A)
 &rst
  ixpk= 107, nxpk= 20, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 281, 282,
 &end
#
#   21 HIS  HB-          21 HIS  HA          5.50    (#    108:20  Unique         2.40, 2.73 A)
 &rst
  ixpk= 108, nxpk= 20, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 281, 282,
 &end
#
#    0 AMB  20-2:109    105 LEU  HA          4.50    (#    109:20  Single Ambig)
 &rst
  ixpk= 109, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1528,1529,1572,1573,
 &end
#
#    0 AMB  20-2:110    105 LEU  HA          5.50    (#    110:20  Single Ambig)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1531,1045,1046,
 &end
#
#  105 LEU  HB-         105 LEU  HA          5.50    (#    111:20  Unique         2.57, 2.80 A)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1528,1529,
 &end
#
#  105 LEU  MDY         105 LEU  HA          4.50    (#    112:20  Unique         1.96, 3.17 A)
 &rst
  ixpk= 112, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:113     74 GLN  HA          3.50    (#    113:20  Single Ambig)
 &rst
  ixpk= 113, nxpk= 20, iat=  -1,1062, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1064,1065,1067,1068,
 &end
#
#   41 LEU  HB+          41 LEU  HA          5.50    (#    114:20  Unique         2.61, 2.84 A)
 &rst
  ixpk= 114, nxpk= 20, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 583, 584,
 &end
#
#   41 LEU  HG           41 LEU  HA          5.50    (#    115:20  Unique         2.15, 2.18 A)
 &rst
  ixpk= 115, nxpk= 20, iat= 586, 581, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 LEU  MDY          41 LEU  HA          4.50    (#    116:20  Unique         3.32, 4.06 A)
 &rst
  ixpk= 116, nxpk= 20, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:118      0 AMB  20-1:118    2.80    (#    118:20  Double Ambig)
 &rst
  ixpk= 118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1064,1065,1067,1068,1067,1068,
 igr2=1062,1018,
 &end
#
#  109 LEU  MDX         109 LEU  HA          4.50    (#    119:20  Unique         1.97, 3.62 A)
 &rst
  ixpk= 119, nxpk= 20, iat=  -1,1585, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  HB-         109 LEU  HA          4.50    (#    120:20  Unique         2.50, 2.76 A)
 &rst
  ixpk= 120, nxpk= 20, iat=  -1,1585, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1587,1588,
 &end
#
#  130 ILE  MG2         130 ILE  HA          4.50    (#    121:20  Unique         2.74, 3.39 A)
 &rst
  ixpk= 121, nxpk= 20, iat=  -1,1910, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1914,1915,1916,
 &end
#
#  131 PRO  HD-         130 ILE  HA          4.50    (#    122:20  Unique         3.77, 3.91 A)
 &rst
  ixpk= 122, nxpk= 20, iat=  -1,1910, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1928,1929,
 &end
#
#  130 ILE  HB          130 ILE  HA          5.50    (#    123:20  Unique         2.97, 2.98 A)
 &rst
  ixpk= 123, nxpk= 20, iat=1912,1910, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  147 LYS  HG+         147 LYS  HA          4.50    (#    124:20  Unique         2.15, 2.54 A)
 &rst
  ixpk= 124, nxpk= 20, iat=  -1,2177, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2182,2183,
 &end
#
#    0 AMB  20-2:126     73 LEU  HA          5.50    (#    126:20  Single Ambig)
 &rst
  ixpk= 126, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1572,1573,1067,1068,1096,1097,1135,1136,
 &end
#
#   73 LEU  HB-          73 LEU  HA          5.50    (#    127:20  Unique         2.58, 2.79 A)
 &rst
  ixpk= 127, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1045,1046,
 &end
#
#   41 LEU  MDX          73 LEU  HA          5.50    (#    128:20  Unique         3.21, 5.06 A)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:129      0 AMB  20-1:129    3.50    (#    129:20  Double Ambig)
 &rst
  ixpk= 129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1084,1085, 364, 365, 605, 606,
 igr2=1079, 362, 600,
 &end
#
#    0 AMB  20-2:130      0 AMB  20-1:130    2.80    (#    130:20  Double Ambig)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 602, 603,1081,1082,
 igr2= 600,1079,
 &end
#
#    0 AMB  20-2:131     26 LEU  HA          4.50    (#    131:20  Single Ambig)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 413, 414, 415, 342, 343,
 &end
#
#  146 LEU  HG          147 LYS  HA          7.00    (#    132:20  Unique         3.13, 3.48 A)
 &rst
  ixpk= 132, nxpk= 20, iat=2163,2177, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   78 PRO  HD+          73 LEU  HA          4.50    (#    134:20  Unique         4.09, 4.38 A)
 &rst
  ixpk= 134, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1132,1133,
 &end
#
#   73 LEU  MDX          73 LEU  HA          4.50    (#    135:20  Unique         1.92, 3.76 A)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:136      0 AMB  20-1:136    5.50    (#    136:20  Double Ambig)
 &rst
  ixpk= 136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1= 466, 467, 468,1116,1117, 298, 299,
 igr2= 362,1079,
 &end
#
#    0 AMB  20-2:137      0 AMB  20-1:137    3.50    (#    137:20  Double Ambig)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 369, 370, 371, 373, 374, 375,  68,  69,  70,
 igr2= 362, 600,
 &end
#
#  147 LYS  HB-         147 LYS  HA          4.50    (#    138:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 138, nxpk= 20, iat=  -1,2177, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2179,2180,
 &end
#
#  108 GLU  HB+         108 GLU  HA          3.50    (#    139:20  Unique         2.54, 2.79 A)
 &rst
  ixpk= 139, nxpk= 20, iat=  -1,1570, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1572,1573,
 &end
#
#  111 ASN  HB-         108 GLU  HA          3.50    (#    140:20  Unique         2.12, 3.07 A)
 &rst
  ixpk= 140, nxpk= 20, iat=  -1,1570, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1628,1629,
 &end
#
#  139 LEU  MDX         139 LEU  HA          4.50    (#    141:20  Unique         2.14, 3.56 A)
 &rst
  ixpk= 141, nxpk= 20, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:142      0 AMB  20-1:142    3.50    (#    142:20  Double Ambig)
 &rst
  ixpk= 142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2050,2051, 342, 343,
 igr2=2048, 296,
 &end
#
#    3 ASP  HB+           3 ASP  HA          4.50    (#    143:20  Unique         2.69, 2.83 A)
 &rst
  ixpk= 143, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  35,  36,
 &end
#
#    3 ASP  HB-           3 ASP  HA          3.50    (#    144:20  Unique         2.69, 2.83 A)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  35,  36,
 &end
#
#    0 AMB  20-2:145    139 LEU  HA          5.50    (#    145:20  Single Ambig)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
      1769,1770,2113,2114,2115,2117,2118,2119,
 &end
#
#    0 AMB  20-2:146      0 AMB  20-1:146    3.50    (#    146:20  Double Ambig)
 &rst
  ixpk= 146, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770, 369, 370, 371, 373, 374, 375,
 igr2= 296,2048,
 &end
#
#    0 AMB  20-2:147     22 LEU  HA          5.50    (#    147:20  Single Ambig)
 &rst
  ixpk= 147, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 298, 299, 342, 343,
 &end
#
#   25 LYS  HB-          25 LYS  HA          4.50    (#    148:20  Unique         2.39, 2.71 A)
 &rst
  ixpk= 148, nxpk= 20, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 342, 343,
 &end
#
#   94 GLU  HG-          94 GLU  HA          4.50    (#    149:20  Unique         2.06, 3.08 A)
 &rst
  ixpk= 149, nxpk= 20, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1368,1369,
 &end
#
#    0 AMB  20-2:150      0 AMB  20-1:150    3.50    (#    150:20  Double Ambig)
 &rst
  ixpk= 150, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 909, 910,1494,1495,
 igr2= 907,1492,
 &end
#
#    0 AMB  20-2:151    103 ASP  HA          4.50    (#    151:20  Single Ambig)
 &rst
  ixpk= 151, nxpk= 20, iat=  -1,1492, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1550,1551,1547,1548,
 &end
#
#    0 AMB  20-2:152     25 LYS  HA          4.50    (#    152:20  Single Ambig)
 &rst
  ixpk= 152, nxpk= 20, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 398, 399, 330, 331,
 &end
#
#   25 LYS  HD+          25 LYS  HA          4.50    (#    153:20  Unique         2.21, 2.99 A)
 &rst
  ixpk= 153, nxpk= 20, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 348, 349,
 &end
#
#   94 GLU  HB+          94 GLU  HA          3.50    (#    154:20  Unique         2.24, 2.76 A)
 &rst
  ixpk= 154, nxpk= 20, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1365,1366,
 &end
#
#   76 GLN  HB+          76 GLN  HA          3.50    (#    155:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 155, nxpk= 20, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1096,1097,
 &end
#
#    0 AMB  20-2:156     76 GLN  HA          3.50    (#    156:20  Single Ambig)
 &rst
  ixpk= 156, nxpk= 20, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1099,1100,1099,1100,
 &end
#
#    0 AMB  20-2:157      0 AMB  20-1:157    3.50    (#    157:20  Double Ambig)
 &rst
  ixpk= 157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1096,1097, 342, 343,
 igr2=1094, 340,
 &end
#
#   83 VAL  MGX          47 SER  HA          3.50    (#    159:20  Unique         3.76, 4.46 A)
 &rst
  ixpk= 159, nxpk= 20, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:160     47 SER  HA          3.50    (#    160:20  Single Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 672, 673, 672, 673,
 &end
#
#   82 ALA  MB           47 SER  HA          3.50    (#    161:20  Unique         2.25, 3.77 A)
 &rst
  ixpk= 161, nxpk= 20, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1191,1192,1193,
 &end
#
#   78 PRO  HD+          77 LYS  HA          4.50    (#    162:20  Unique         2.19, 2.64 A)
 &rst
  ixpk= 162, nxpk= 20, iat=  -1,1111, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1132,1133,
 &end
#
#   77 LYS  HB+          77 LYS  HA          3.50    (#    163:20  Unique         2.61, 2.81 A)
 &rst
  ixpk= 163, nxpk= 20, iat=  -1,1111, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1113,1114,
 &end
#
#   77 LYS  HG+          77 LYS  HA          4.50    (#    164:20  Unique         2.15, 2.78 A)
 &rst
  ixpk= 164, nxpk= 20, iat=  -1,1111, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1116,1117,
 &end
#
#   23 ALA  MB           23 ALA  HA          3.50    (#    165:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 165, nxpk= 20, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 317, 318, 319,
 &end
#
#    0 AMB  20-2:166     23 ALA  HA          3.50    (#    166:20  Single Ambig)
 &rst
  ixpk= 166, nxpk= 20, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 466, 467, 468, 298, 299,
 &end
#
#    0 AMB  20-2:167     23 ALA  HA          3.50    (#    167:20  Single Ambig)
 &rst
  ixpk= 167, nxpk= 20, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 &end
#
#   26 LEU  HB+          23 ALA  HA          5.50    (#    168:20  Unique         2.58, 3.25 A)
 &rst
  ixpk= 168, nxpk= 20, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 364, 365,
 &end
#
#   34 GLU  HG-          34 GLU  HA          4.50    (#    169:20  Unique         2.06, 2.59 A)
 &rst
  ixpk= 169, nxpk= 20, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 481, 482,
 &end
#
#   34 GLU  HB+          34 GLU  HA          3.50    (#    170:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 170, nxpk= 20, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   96 ASP  HB+          96 ASP  HA          2.80    (#    171:20  Unique         2.28, 2.68 A)
 &rst
  ixpk= 171, nxpk= 20, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1401,1402,
 &end
#
#    0 AMB  20-2:172     19 ALA  HA          5.50    (#    172:20  Single Ambig)
 &rst
  ixpk= 172, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 296, 315,
 &end
#
#  116 GLN  HG-         116 GLN  HA          4.50    (#    173:20  Unique         2.34, 2.83 A)
 &rst
  ixpk= 173, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1695,1696,
 &end
#
#    0 AMB  20-2:174    111 ASN  HA          3.50    (#    174:20  Single Ambig)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1628,1629,1628,1629,
 &end
#
#    0 AMB  20-2:176     19 ALA  HA          4.50    (#    176:20  Single Ambig)
 &rst
  ixpk= 176, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 242, 243, 244, 246, 247, 248,  85,  86,  87,  89,
        90,  91,
 &end
#
#    0 AMB  20-2:177     19 ALA  HA          3.50    (#    177:20  Single Ambig)
 &rst
  ixpk= 177, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 777, 778, 779, 242, 243, 244, 246, 247, 248, 774,
       775,
 &end
#
#    0 AMB  20-2:178    116 GLN  HA          5.50    (#    178:20  Single Ambig)
 &rst
  ixpk= 178, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1692,1693,1217,1218,
 &end
#
#  116 GLN  HB-         116 GLN  HA          5.50    (#    179:20  Unique         2.45, 2.76 A)
 &rst
  ixpk= 179, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1692,1693,
 &end
#
#  145 LEU  HB-         145 LEU  HA          4.50    (#    180:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 180, nxpk= 20, iat=  -1,2139, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2141,2142,
 &end
#
#  145 LEU  HB+         145 LEU  HA          4.50    (#    181:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 181, nxpk= 20, iat=  -1,2139, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2141,2142,
 &end
#
#   19 ALA  MB           19 ALA  HA          3.50    (#    182:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 182, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 256, 257, 258,
 &end
#
#    0 AMB  20-2:183    144 ASN  HA          2.80    (#    183:20  Single Ambig)
 &rst
  ixpk= 183, nxpk= 20, iat=  -1,2125, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:184    145 LEU  HA          3.50    (#    184:20  Single Ambig)
 &rst
  ixpk= 184, nxpk= 20, iat=  -1,2139, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=2144,2146,2147,2148,2150,2151,2152,
 &end
#
#  146 LEU  HB+         146 LEU  HA          4.50    (#    185:20  Unique         2.25, 2.44 A)
 &rst
  ixpk= 185, nxpk= 20, iat=  -1,2158, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2160,2161,
 &end
#
#  147 LYS  HD+         144 ASN  HA          7.00    (#    187:20  Unique         2.13, 3.63 A)
 &rst
  ixpk= 187, nxpk= 20, iat=  -1,2125, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2185,2186,
 &end
#
#    0 AMB  20-2:188    107 ALA  HA          4.50    (#    188:20  Single Ambig)
 &rst
  ixpk= 188, nxpk= 20, iat=  -1,1560, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1606,1607,1606,1607,
 &end
#
#  146 LEU  HB-         146 LEU  HA          4.50    (#    189:20  Unique         2.25, 2.44 A)
 &rst
  ixpk= 189, nxpk= 20, iat=  -1,2158, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2160,2161,
 &end
#
#    0 AMB  20-2:190    146 LEU  HA          4.50    (#    190:20  Single Ambig)
 &rst
  ixpk= 190, nxpk= 20, iat=  -1,2158, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2163,1711,1712,1713,
 &end
#
#   43 ASP  HB+          43 ASP  HA          2.80    (#    191:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 191, nxpk= 20, iat=  -1, 615, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 617, 618,
 &end
#
#   12 LEU  HB+          12 LEU  HA          3.50    (#    192:20  Unique         2.43, 2.82 A)
 &rst
  ixpk= 192, nxpk= 20, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 161, 162,
 &end
#
#   76 GLN  HG+          72 ALA  HA          4.50    (#    193:20  Unique         4.55, 5.18 A)
 &rst
  ixpk= 193, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1099,1100,
 &end
#
#    0 AMB  20-2:194     72 ALA  HA          4.50    (#    194:20  Single Ambig)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1081,1082,1081,1082,
 &end
#
#   72 ALA  MB           72 ALA  HA          3.50    (#    195:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 195, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1035,1036,1037,
 &end
#
#  107 ALA  MB          107 ALA  HA          2.80    (#    196:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 196, nxpk= 20, iat=  -1,1560, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1562,1563,1564,
 &end
#
#  146 LEU  MDX         146 LEU  HA          4.50    (#    199:20  Unique         3.78, 4.71 A)
 &rst
  ixpk= 199, nxpk= 20, iat=  -1,2158, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   61 ASP  HB+          65 ASN  HA          4.50    (#    200:20  Unique         2.05, 3.43 A)
 &rst
  ixpk= 200, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 864, 865,
 &end
#
#   65 ASN  HB+          65 ASN  HA          4.50    (#    201:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 201, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 921, 922,
 &end
#
#   65 ASN  HB-          65 ASN  HA          4.50    (#    202:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 202, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 921, 922,
 &end
#
#  121 LEU  HG          121 LEU  HA          4.50    (#    207:20  Unique         2.17, 2.32 A)
 &rst
  ixpk= 207, nxpk= 20, iat=1762,1757, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 LEU  MDX         121 LEU  HA          3.50    (#    208:20  Unique         2.54, 4.12 A)
 &rst
  ixpk= 208, nxpk= 20, iat=  -1,1757, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#    0 AMB  20-2:209     40 LEU  HA          7.00    (#    209:20  Single Ambig)
 &rst
  ixpk= 209, nxpk= 20, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 567, 583, 584,
 &end
#
#   40 LEU  HB-          40 LEU  HA          4.50    (#    210:20  Unique         2.59, 2.79 A)
 &rst
  ixpk= 210, nxpk= 20, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 564, 565,
 &end
#
#    0 AMB  20-2:211     40 LEU  HA          3.50    (#    211:20  Single Ambig)
 &rst
  ixpk= 211, nxpk= 20, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 569, 570, 571, 573, 574, 575, 569, 570, 571, 573,
       574, 575,
 &end
#
#   36 LEU  HG           36 LEU  HA          5.50    (#    212:20  Unique         3.43, 3.44 A)
 &rst
  ixpk= 212, nxpk= 20, iat= 510, 505, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   36 LEU  HB-          36 LEU  HA          5.50    (#    213:20  Unique         2.21, 2.55 A)
 &rst
  ixpk= 213, nxpk= 20, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 507, 508,
 &end
#
#   36 LEU  MDY          36 LEU  HA          4.50    (#    214:20  Unique         3.09, 4.40 A)
 &rst
  ixpk= 214, nxpk= 20, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#   40 LEU  HB+          40 LEU  HA          4.50    (#    215:20  Unique         2.59, 2.79 A)
 &rst
  ixpk= 215, nxpk= 20, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 564, 565,
 &end
#
#   59 ALA  MB           59 ALA  HA          3.50    (#    217:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 217, nxpk= 20, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 847, 848, 849,
 &end
#
#    0 AMB  20-2:218      0 AMB  20-1:218    2.80    (#    218:20  Double Ambig)
 &rst
  ixpk= 218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 413, 414, 415, 629, 630,
 igr2= 411, 627,
 &end
#
#   44 LEU  MDX          44 LEU  HA          4.50    (#    220:20  Unique         2.00, 3.65 A)
 &rst
  ixpk= 220, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#   45 PRO  HD+          44 LEU  HA          3.50    (#    221:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 221, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 645, 646,
 &end
#
#   45 PRO  HD-          44 LEU  HA          4.50    (#    222:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 222, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 645, 646,
 &end
#
#    0 AMB  20-2:223      0 AMB  20-1:223    5.50    (#    223:20  Double Ambig)
 &rst
  ixpk= 223, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.58, r4=10.08,
 igr1= 629, 630,2113,2114,2115,2117,2118,2119,2113,2114,
      2115,2117,2118,2119,
 igr2= 627, 411,
 &end
#
#   46 ALA  MB           46 ALA  HA          3.50    (#    224:20  Unique         2.29, 2.63 A)
 &rst
  ixpk= 224, nxpk= 20, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 662, 663, 664,
 &end
#
#   80 LEU  MDX          46 ALA  HA          4.50    (#    225:20  Unique         2.21, 4.29 A)
 &rst
  ixpk= 225, nxpk= 20, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   83 VAL  MGX          46 ALA  HA          4.50    (#    226:20  Unique         1.99, 4.05 A)
 &rst
  ixpk= 226, nxpk= 20, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    2 ALA  MB            2 ALA  HA          3.50    (#    230:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 230, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  25,  26,  27,
 &end
#
#   55 SER  HB+         131 PRO  HD-         4.50    (#    231:20  Unique         4.97, 7.70 A)
 &rst
  ixpk= 231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 798, 799,
 igr2=1928,1929,
 &end
#
#  130 ILE  MG2         131 PRO  HD-         4.50    (#    233:20  Unique         1.90, 3.47 A)
 &rst
  ixpk= 233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1914,1915,1916,
 igr2=1928,1929,
 &end
#
#  130 ILE  HB          131 PRO  HD+         4.50    (#    234:20  Unique         1.81, 2.11 A)
 &rst
  ixpk= 234, nxpk= 20, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1928,1929,
 &end
#
#   76 GLN  HB+          78 PRO  HD-         7.00    (#    236:20  Unique         2.21, 3.95 A)
 &rst
  ixpk= 236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1096,1097,
 igr2=1132,1133,
 &end
#
#    0 AMB  20-2:237      0 AMB  20-1:237    3.50    (#    237:20  Double Ambig)
 &rst
  ixpk= 237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 954, 955,1111,
 igr2= 962, 963,1132,1133,
 &end
#
#    0 AMB  20-2:239      0 AMB  20-1:239    3.50    (#    239:20  Double Ambig)
 &rst
  ixpk= 239, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1096,1097,1135,1136, 965, 966,
 igr2=1132,1133,1132,1133, 962, 963,
 &end
#
#    0 AMB  20-2:241     78 PRO  HD-         3.50    (#    241:20  Single Ambig)
 &rst
  ixpk= 241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1096,1097,1135,1136,
 igr2=1132,1133,
 &end
#
#   44 LEU  HB+          45 PRO  HD+         5.50    (#    242:20  Unique         1.83, 3.33 A)
 &rst
  ixpk= 242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 629, 630,
 igr2= 645, 646,
 &end
#
#   68 PRO  HG+          68 PRO  HD+         4.50    (#    243:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 965, 966,
 igr2= 962, 963,
 &end
#
#    0 AMB  20-2:245      0 AMB  20-1:245    4.50    (#    245:20  Double Ambig)
 &rst
  ixpk= 245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 648, 649, 968, 969,
 igr2= 645, 646, 962, 963,
 &end
#
#   44 LEU  HB-          45 PRO  HD+         7.00    (#    246:20  Unique         1.83, 3.33 A)
 &rst
  ixpk= 246, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 629, 630,
 igr2= 645, 646,
 &end
#
#    0 AMB  20-2:248      0 AMB  20-1:248    4.50    (#    248:20  Double Ambig)
 &rst
  ixpk= 248, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 648, 649, 968, 969,
 igr2= 645, 646, 962, 963,
 &end
#
#   44 LEU  MDX          45 PRO  HD-         4.50    (#    249:20  Unique         2.45, 4.38 A)
 &rst
  ixpk= 249, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 634, 635, 636, 638, 639, 640,
 igr2= 645, 646,
 &end
#
#   45 PRO  HG-          45 PRO  HD-         4.50    (#    250:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 648, 649,
 igr2= 645, 646,
 &end
#
#   45 PRO  HG-          45 PRO  HD+         5.50    (#    251:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 251, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 648, 649,
 igr2= 645, 646,
 &end
#
#   44 LEU  HB-          45 PRO  HD-         7.00    (#    252:20  Unique         1.83, 3.33 A)
 &rst
  ixpk= 252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 629, 630,
 igr2= 645, 646,
 &end
#
#  143 VAL  MGX         140 GLY  HA-         5.50    (#    261:20  Unique         3.65, 5.61 A)
 &rst
  ixpk= 261, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2113,2114,2115,2117,2118,2119,
 igr2=2067,2068,
 &end
#
#   56 THR  MG2          60 GLY  HA-         5.50    (#    266:20  Unique         4.26, 5.80 A)
 &rst
  ixpk= 266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 811, 812, 813,
 igr2= 855, 856,
 &end
#
#   56 THR  MG2          60 GLY  HA-         5.50    (#    267:20  Unique         4.26, 5.80 A)
 &rst
  ixpk= 267, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 811, 812, 813,
 igr2= 855, 856,
 &end
#
#   56 THR  HB           60 GLY  HA+         5.50    (#    271:20  Unique         3.91, 5.08 A)
 &rst
  ixpk= 271, nxpk= 20, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 855, 856,
 &end
#
#    0 AMB  20-2:282    118 GLY  HA-         4.50    (#    282:20  Single Ambig)
 &rst
  ixpk= 282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1711,1712,1713,2146,2147,2148,2150,2151,2152,
 igr2=1721,1722,
 &end
#
#    0 AMB  20-2:284      0 AMB  20-1:284    4.50    (#    284:20  Double Ambig)
 &rst
  ixpk= 284, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1711,1712,1713,2146,2147,2148,2150,2151,2152,
 igr2=1721,1722,1721,1722,
 &end
#
#    0 AMB  20-2:285      0 AMB  20-1:285    4.50    (#    285:20  Double Ambig)
 &rst
  ixpk= 285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1711,1712,1713,2146,2147,2148,2150,2151,2152,
 igr2=1721,1722,1721,1722,
 &end
#
#    6 LEU  MDX          51 LEU  HB+         4.50    (#    287:20  Unique         1.97, 3.49 A)
 &rst
  ixpk= 287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  85,  86,  87,  89,  90,  91,
 igr2= 733, 734,
 &end
#
#    0 AMB  20-2:289      0 AMB  20-1:289    3.50    (#    289:20  Double Ambig)
 &rst
  ixpk= 289, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1217,1218,1220,1221,1220,1221,
 igr2=1223,1224,1223,1224,1223,1224,
 &end
#
#    0 AMB  20-2:291     84 ARG  HD-         3.50    (#    291:20  Single Ambig)
 &rst
  ixpk= 291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1217,1218,1220,1221,1220,1221,
 igr2=1223,1224,
 &end
#
#   51 LEU  MDX          51 LEU  HB+         5.50    (#    294:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 294, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 733, 734,
 &end
#
#    6 LEU  MDX          51 LEU  HB-         5.50    (#    296:20  Unique         1.97, 3.49 A)
 &rst
  ixpk= 296, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  85,  86,  87,  89,  90,  91,
 igr2= 733, 734,
 &end
#
#  130 ILE  MG2          89 GLY  HA-         5.50    (#    298:20  Unique         4.27, 6.21 A)
 &rst
  ixpk= 298, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1914,1915,1916,
 igr2=1295,1296,
 &end
#
#   36 LEU  MDX          36 LEU  HB+         5.50    (#    299:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 507, 508,
 &end
#
#   36 LEU  HG           36 LEU  HB+         5.50    (#    300:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 300, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 507, 508,
 &end
#
#   36 LEU  HG           36 LEU  HB-         5.50    (#    303:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 303, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 507, 508,
 &end
#
#    0 AMB  20-2:304      0 AMB  20-1:304    5.50    (#    304:20  Double Ambig)
 &rst
  ixpk= 304, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1609,1610,1692,1693,
 igr2=1615,1616,1615,1616,
 &end
#
#    0 AMB  20-2:305      0 AMB  20-1:305    4.50    (#    305:20  Double Ambig)
 &rst
  ixpk= 305, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1612,1613,1612,1613,
 igr2=1615,1616,1615,1616,
 &end
#
#    0 AMB  20-2:306    110 LYS  HE-         4.50    (#    306:20  Single Ambig)
 &rst
  ixpk= 306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1612,1613,1612,1613,
 igr2=1615,1616,
 &end
#
#    0 AMB  20-2:307    139 LEU  HB-         4.50    (#    307:20  Single Ambig)
 &rst
  ixpk= 307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2048,1994,
 igr2=2050,2051,
 &end
#
#    0 AMB  20-2:308      0 AMB  20-1:308    7.00    (#    308:20  Double Ambig)
 &rst
  ixpk= 308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=2048,1994,
 igr2=2050,2051,2050,2051,
 &end
#
#  139 LEU  MDY         139 LEU  HB+         4.50    (#    310:20  Unique         2.16, 3.34 A)
 &rst
  ixpk= 310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2055,2056,2057,2059,2060,2061,
 igr2=2050,2051,
 &end
#
#  146 LEU  HA          146 LEU  HB+         5.50    (#    311:20  Unique         2.25, 2.44 A)
 &rst
  ixpk= 311, nxpk= 20, iat=2158,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2160,2161,
 &end
#
#  146 LEU  HA          146 LEU  HB+         5.50    (#    312:20  Unique         2.25, 2.44 A)
 &rst
  ixpk= 312, nxpk= 20, iat=2158,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2160,2161,
 &end
#
#  146 LEU  MDY         146 LEU  HB-         5.50    (#    313:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2160,2161,
 &end
#
#    0 AMB  20-2:316      0 AMB  20-1:316    5.50    (#    316:20  Double Ambig)
 &rst
  ixpk= 316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2055,2056,2057,2059,2060,2061,1533,1534,1535,1537,
      1538,1539,
 igr2=2050,2051,1528,1529,
 &end
#
#  115 LYS  HG+         115 LYS  HE+         5.50    (#    317:20  Unique         2.00, 2.97 A)
 &rst
  ixpk= 317, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1673,1674,
 igr2=1679,1680,
 &end
#
#   77 LYS  HG-          77 LYS  HE+         5.50    (#    318:20  Unique         2.07, 3.05 A)
 &rst
  ixpk= 318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1116,1117,
 igr2=1122,1123,
 &end
#
#    0 AMB  20-2:320      0 AMB  20-1:320    4.50    (#    320:20  Double Ambig)
 &rst
  ixpk= 320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1526,2048,1994,
 igr2=1528,1529,2050,2051,
 &end
#
#   73 LEU  HA           77 LYS  HE+         7.00    (#    321:20  Unique         7.02, 7.57 A)
 &rst
  ixpk= 321, nxpk= 20, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1122,1123,
 &end
#
#    0 AMB  20-2:322      0 AMB  20-1:322    3.50    (#    322:20  Double Ambig)
 &rst
  ixpk= 322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1676,1677,1119,1120,
 igr2=1679,1680,1122,1123,
 &end
#
#  147 LYS  HD+         147 LYS  HE+         3.50    (#    323:20  Unique         2.33, 2.57 A)
 &rst
  ixpk= 323, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2185,2186,
 igr2=2188,2189,
 &end
#
#    0 AMB  20-2:324      0 AMB  20-1:324    4.50    (#    324:20  Double Ambig)
 &rst
  ixpk= 324, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2182,2183, 345, 346,
 igr2=2188,2189, 351, 352,
 &end
#
#    0 AMB  20-2:325     25 LYS  HE-         3.50    (#    325:20  Single Ambig)
 &rst
  ixpk= 325, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 401, 402, 330, 331,
 igr2= 351, 352,
 &end
#
#    0 AMB  20-2:328      0 AMB  20-1:328    4.50    (#    328:20  Double Ambig)
 &rst
  ixpk= 328, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1533,1534,1535,1537,1538,1539, 940, 941, 942, 944,
       945, 946,
 igr2=1528,1529,1528,1529,
 &end
#
#    0 AMB  20-2:330      0 AMB  20-1:330    4.50    (#    330:20  Double Ambig)
 &rst
  ixpk= 330, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1526,2158,
 igr2=1528,1529,2141,2142,
 &end
#
#   32 THR  MG2           3 ASP  HB-         5.50    (#    332:20  Unique         4.46, 5.68 A)
 &rst
  ixpk= 332, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 452, 453, 454,
 igr2=  35,  36,
 &end
#
#  147 LYS  HG-         147 LYS  HE+         4.50    (#    333:20  Unique         2.21, 3.40 A)
 &rst
  ixpk= 333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2182,2183,
 igr2=2188,2189,
 &end
#
#    6 LEU  HG            6 LEU  HB-         4.50    (#    336:20  Unique         2.37, 2.43 A)
 &rst
  ixpk= 336, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  80,  81,
 &end
#
#  105 LEU  MDY         105 LEU  HB-         5.50    (#    337:20  Unique         2.23, 3.48 A)
 &rst
  ixpk= 337, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1533,1534,1535,1537,1538,1539,
 igr2=1528,1529,
 &end
#
#    0 AMB  20-2:338     73 LEU  HB-         5.50    (#    338:20  Single Ambig)
 &rst
  ixpk= 338, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1572,1573,1067,1068,
 igr2=1045,1046,
 &end
#
#   25 LYS  HD+          25 LYS  HE+         4.50    (#    339:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 348, 349,
 igr2= 351, 352,
 &end
#
#   25 LYS  HD+          25 LYS  HE-         5.50    (#    340:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 348, 349,
 igr2= 351, 352,
 &end
#
#    0 AMB  20-2:341      0 AMB  20-1:341    4.50    (#    341:20  Double Ambig)
 &rst
  ixpk= 341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91, 940, 941, 942, 944, 945, 946,
 igr2=  80,  81,  80,  81,1528,1529,
 &end
#
#    0 AMB  20-2:342      0 AMB  20-1:342    7.00    (#    342:20  Double Ambig)
 &rst
  ixpk= 342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1572,1573,1067,1068,
 igr2=1045,1046,1045,1046,
 &end
#
#   73 LEU  MDY          73 LEU  HB+         5.50    (#    344:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1045,1046,
 &end
#
#   41 LEU  MDX          41 LEU  HB-         5.50    (#    346:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2= 583, 584,
 &end
#
#    0 AMB  20-2:347      6 LEU  HB-         4.50    (#    347:20  Single Ambig)
 &rst
  ixpk= 347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 igr2=  80,  81,
 &end
#
#    0 AMB  20-2:348      0 AMB  20-1:348    2.80    (#    348:20  Double Ambig)
 &rst
  ixpk= 348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1=2146,2147,2148,2150,2151,2152,1533,1534,1535,1537,
      1538,1539,2144,
 igr2=2141,2142,1528,1529,2141,2142,
 &end
#
#   73 LEU  MDY          73 LEU  HB-         5.50    (#    351:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1045,1046,
 &end
#
#  105 LEU  MDX          73 LEU  HB-         5.50    (#    352:20  Unique         4.22, 6.13 A)
 &rst
  ixpk= 352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1533,1534,1535,1537,1538,1539,
 igr2=1045,1046,
 &end
#
#   73 LEU  MDX          73 LEU  HB-         5.50    (#    353:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1045,1046,
 &end
#
#   41 LEU  HG           41 LEU  HB+         3.50    (#    357:20  Unique         2.73, 2.84 A)
 &rst
  ixpk= 357, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 583, 584,
 &end
#
#    0 AMB  20-2:358      0 AMB  20-1:358    4.50    (#    358:20  Double Ambig)
 &rst
  ixpk= 358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 588, 589, 590, 592, 593, 594,  68,  69,  70,
 igr2= 583, 584, 629, 630,
 &end
#
#    0 AMB  20-2:359      0 AMB  20-1:359    5.50    (#    359:20  Double Ambig)
 &rst
  ixpk= 359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  66, 581,
 igr2= 629, 630, 583, 584,
 &end
#
#    0 AMB  20-2:362      0 AMB  20-1:362    2.80    (#    362:20  Double Ambig)
 &rst
  ixpk= 362, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 166, 167, 168, 170, 171, 172, 569, 570, 571, 573,
       574, 575, 569, 570, 571, 573, 574, 575,
 igr2= 161, 162, 564, 565,
 &end
#
#   41 LEU  MDY          41 LEU  HB-         5.50    (#    365:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 365, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2= 583, 584,
 &end
#
#    0 AMB  20-2:366     88 ILE  HB          3.50    (#    366:20  Single Ambig)
 &rst
  ixpk= 366, nxpk= 20, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 774, 775, 770, 771, 772,1284,1285,
 &end
#
#   88 ILE  MG2          88 ILE  HB          5.50    (#    367:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 367, nxpk= 20, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1280,1281,1282,
 &end
#
#   44 LEU  MDY          44 LEU  HB-         5.50    (#    368:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 634, 635, 636, 638, 639, 640,
 igr2= 629, 630,
 &end
#
#    0 AMB  20-2:370      0 AMB  20-1:370    5.50    (#    370:20  Double Ambig)
 &rst
  ixpk= 370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 478, 479,2053,
 igr2= 617, 618, 351, 352,
 &end
#
#   33 THR  MG2          26 LEU  HB+         3.50    (#    371:20  Unique         2.10, 3.50 A)
 &rst
  ixpk= 371, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 466, 467, 468,
 igr2= 364, 365,
 &end
#
#   26 LEU  MDY          26 LEU  HB+         5.50    (#    372:20  Unique         2.10, 3.48 A)
 &rst
  ixpk= 372, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 369, 370, 371, 373, 374, 375,
 igr2= 364, 365,
 &end
#
#   40 LEU  MDX          40 LEU  HB+         3.50    (#    373:20  Unique         2.33, 3.28 A)
 &rst
  ixpk= 373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 569, 570, 571, 573, 574, 575,
 igr2= 564, 565,
 &end
#
#   88 ILE  MG2          88 ILE  HB          4.50    (#    374:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 374, nxpk= 20, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1280,1281,1282,
 &end
#
#    4 ILE  MG2           4 ILE  HB          2.80    (#    376:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 376, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  49,  50,  51,
 &end
#
#    0 AMB  20-2:377     90 ILE  HB          3.50    (#    377:20  Single Ambig)
 &rst
  ixpk= 377, nxpk= 20, iat=  -1,1304, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1306,1307,1308,1747,1748,1749,
 &end
#
#  109 LEU  HG          109 LEU  HB+         4.50    (#    378:20  Unique         2.34, 2.68 A)
 &rst
  ixpk= 378, nxpk= 20, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1587,1588,
 &end
#
#  109 LEU  MDY         109 LEU  HB+         4.50    (#    379:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 379, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1592,1593,1594,1596,1597,1598,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:380      0 AMB  20-1:380    5.50    (#    380:20  Double Ambig)
 &rst
  ixpk= 380, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1280,1281,1282,1762,
 igr2=1759,1760,1759,1760,
 &end
#
#  109 LEU  MDY         109 LEU  HB-         5.50    (#    383:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1592,1593,1594,1596,1597,1598,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:384    109 LEU  HB-         5.50    (#    384:20  Single Ambig)
 &rst
  ixpk= 384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1545,1585,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:386    123 ILE  HB          4.50    (#    386:20  Single Ambig)
 &rst
  ixpk= 386, nxpk= 20, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1802,1803,1804, 303, 304, 305, 307, 308, 309,
 &end
#
#    0 AMB  20-2:387    123 ILE  HB          4.50    (#    387:20  Single Ambig)
 &rst
  ixpk= 387, nxpk= 20, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 242, 243, 244, 246, 247, 248,1809,1810,1811,
 &end
#
#    0 AMB  20-2:388     53 ILE  HB          3.50    (#    388:20  Single Ambig)
 &rst
  ixpk= 388, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 777, 778, 779, 770, 771, 772, 774, 775,
 &end
#
#    0 AMB  20-2:390      0 AMB  20-1:390    5.50    (#    390:20  Double Ambig)
 &rst
  ixpk= 390, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1545,1585,
 igr2=1587,1588,1587,1588,
 &end
#
#    0 AMB  20-2:391    109 LEU  HB-         5.50    (#    391:20  Single Ambig)
 &rst
  ixpk= 391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1545,1585,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:393      0 AMB  20-1:393    4.50    (#    393:20  Double Ambig)
 &rst
  ixpk= 393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.36, r4= 9.86,
 igr1= 303, 304, 305, 307, 308, 309,1802,1803,1804, 369,
       370, 371, 373, 374, 375, 369, 370, 371, 373, 374,
       375,  85,  86,  87,  89,  90,  91,
 igr2= 298, 299,1800,
 &end
#
#   53 ILE  HG1+         53 ILE  HB          4.50    (#    394:20  Unique         2.68, 2.83 A)
 &rst
  ixpk= 394, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 774, 775,
 &end
#
#    0 AMB  20-2:396      0 AMB  20-1:396    7.00    (#    396:20  Double Ambig)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1201,1138,1139,
 igr2=1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:397      0 AMB  20-1:397    4.50    (#    397:20  Double Ambig)
 &rst
  ixpk= 397, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.05, r4= 9.55,
 igr1= 242, 243, 244, 246, 247, 248, 774, 775, 777, 778,
       779,
 igr2= 298, 299, 298, 299, 298, 299,
 &end
#
#    0 AMB  20-2:399     22 LEU  HB-         5.50    (#    399:20  Single Ambig)
 &rst
  ixpk= 399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 303, 304, 305, 307, 308, 309, 369, 370, 371, 373,
       374, 375, 369, 370, 371, 373, 374, 375,  85,  86,
        87,  89,  90,  91,
 igr2= 298, 299,
 &end
#
#    0 AMB  20-2:400     22 LEU  HB-         4.50    (#    400:20  Single Ambig)
 &rst
  ixpk= 400, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.53, r4= 8.03,
 igr1= 242, 243, 244, 246, 247, 248, 774, 775, 777, 778,
       779,
 igr2= 298, 299,
 &end
#
#    0 AMB  20-2:401      0 AMB  20-1:401    4.50    (#    401:20  Double Ambig)
 &rst
  ixpk= 401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 296, 315,
 igr2= 298, 299, 298, 299,
 &end
#
#   80 LEU  MDY          80 LEU  HB-         4.50    (#    403:20  Unique         2.11, 3.47 A)
 &rst
  ixpk= 403, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1166,1167,1168,1170,1171,1172,
 igr2=1161,1162,
 &end
#
#    0 AMB  20-2:404      0 AMB  20-1:404    4.50    (#    404:20  Double Ambig)
 &rst
  ixpk= 404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 igr2=1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:405      0 AMB  20-1:405    4.50    (#    405:20  Double Ambig)
 &rst
  ixpk= 405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1= 303, 304, 305, 307, 308, 309,1166,1167,1168,1170,
      1171,1172, 369, 370, 371, 373, 374, 375,
 igr2= 298, 299,1161,1162, 298, 299,
 &end
#
#   70 TYR  HA           70 TYR  HB-         4.50    (#    409:20  Unique         2.23, 2.56 A)
 &rst
  ixpk= 409, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 999,1000,
 &end
#
#    0 AMB  20-2:411     49 ILE  HB          3.50    (#    411:20  Single Ambig)
 &rst
  ixpk= 411, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  49,  50,  51, 692, 693, 694,
 &end
#
#    0 AMB  20-2:412     49 ILE  HB          4.50    (#    412:20  Single Ambig)
 &rst
  ixpk= 412, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 696, 697, 699, 700, 701,
 &end
#
#  130 ILE  MG2         130 ILE  HB          3.50    (#    422:20  Unique         2.31, 2.63 A)
 &rst
  ixpk= 422, nxpk= 20, iat=  -1,1912, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1914,1915,1916,
 &end
#
#  130 ILE  HG1+        130 ILE  HB          7.00    (#    424:20  Unique         2.44, 2.62 A)
 &rst
  ixpk= 424, nxpk= 20, iat=  -1,1912, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1918,1919,
 &end
#
#   20 GLU  HA           20 GLU  HG+         4.50    (#    430:20  Unique         2.04, 2.74 A)
 &rst
  ixpk= 430, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 269, 270,
 &end
#
#   20 GLU  HB-          20 GLU  HG+         3.50    (#    431:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 431, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 266, 267,
 igr2= 269, 270,
 &end
#
#    0 AMB  20-2:432      0 AMB  20-1:432    5.50    (#    432:20  Double Ambig)
 &rst
  ixpk= 432, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 962, 963, 296, 315,
 igr2=1023,1024, 330, 331,
 &end
#
#   71 GLU  HB+          71 GLU  HG+         2.80    (#    433:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 433, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1020,1021,
 igr2=1023,1024,
 &end
#
#   71 GLU  HA           71 GLU  HG-         4.50    (#    435:20  Unique         2.16, 2.83 A)
 &rst
  ixpk= 435, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1023,1024,
 &end
#
#   71 GLU  HA           71 GLU  HG+         7.00    (#    436:20  Unique         2.16, 2.83 A)
 &rst
  ixpk= 436, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:441      0 AMB  20-1:441    3.50    (#    441:20  Double Ambig)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 383, 384, 383, 384, 383, 384,
 igr2= 386, 387, 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:442      0 AMB  20-1:442    3.50    (#    442:20  Double Ambig)
 &rst
  ixpk= 442, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 383, 384, 383, 384,
 igr2= 386, 387, 386, 387,
 &end
#
#   33 THR  MG2          27 GLU  HG+         4.50    (#    443:20  Unique         1.98, 3.30 A)
 &rst
  ixpk= 443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 466, 467, 468,
 igr2= 386, 387,
 &end
#
#    0 AMB  20-2:444      0 AMB  20-1:444    4.50    (#    444:20  Double Ambig)
 &rst
  ixpk= 444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 340, 396,
 igr2= 401, 402, 401, 402,
 &end
#
#    0 AMB  20-2:447      0 AMB  20-1:447    2.80    (#    447:20  Double Ambig)
 &rst
  ixpk= 447, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1730,1731,1081,1082,
 igr2=1733,1734,1084,1085,
 &end
#
#    0 AMB  20-2:448      0 AMB  20-1:448    3.50    (#    448:20  Double Ambig)
 &rst
  ixpk= 448, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2009,1079,
 igr2=2014,2015,1084,1085,
 &end
#
#    0 AMB  20-2:449      0 AMB  20-1:449    4.50    (#    449:20  Double Ambig)
 &rst
  ixpk= 449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1745, 581,
 igr2=1344,1345, 605, 606, 605, 606,
 &end
#
#   73 LEU  HB-         108 GLU  HG-         7.00    (#    451:20  Unique         3.42, 4.57 A)
 &rst
  ixpk= 451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1045,1046,
 igr2=1575,1576,
 &end
#
#    0 AMB  20-2:454      0 AMB  20-1:454    5.50    (#    454:20  Double Ambig)
 &rst
  ixpk= 454, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 564, 565, 586,
 igr2= 605, 606, 605, 606, 605, 606,
 &end
#
#    0 AMB  20-2:455      0 AMB  20-1:455    5.50    (#    455:20  Double Ambig)
 &rst
  ixpk= 455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1304,1035,1036,1037,
 igr2=1550,1551,1084,1085,
 &end
#
#   94 GLU  HB+          94 GLU  HG+         2.80    (#    456:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 456, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1365,1366,
 igr2=1368,1369,
 &end
#
#    0 AMB  20-2:457      0 AMB  20-1:457    3.50    (#    457:20  Double Ambig)
 &rst
  ixpk= 457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1344,1345,1344,1345,
 igr2=1368,1369,1368,1369,
 &end
#
#    0 AMB  20-2:458      0 AMB  20-1:458    2.80    (#    458:20  Double Ambig)
 &rst
  ixpk= 458, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1365,1366,1365,1366,
 igr2=1368,1369,1368,1369,
 &end
#
#    2 ALA  MB           34 GLU  HG-         5.50    (#    460:20  Unique         2.60, 4.16 A)
 &rst
  ixpk= 460, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  25,  26,  27,
 igr2= 481, 482,
 &end
#
#    0 AMB  20-2:461      0 AMB  20-1:461    4.50    (#    461:20  Double Ambig)
 &rst
  ixpk= 461, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 588, 589, 590, 592, 593, 594, 512, 513, 514, 516,
       517, 518,
 igr2= 605, 606, 481, 482,
 &end
#
#    2 ALA  MB           34 GLU  HG+         4.50    (#    464:20  Unique         2.60, 4.16 A)
 &rst
  ixpk= 464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  25,  26,  27,
 igr2= 481, 482,
 &end
#
#   36 LEU  MDY          34 GLU  HG+         4.50    (#    465:20  Unique         3.45, 5.63 A)
 &rst
  ixpk= 465, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 481, 482,
 &end
#
#  106 GLU  HA          106 GLU  HG+         5.50    (#    466:20  Unique         2.07, 3.01 A)
 &rst
  ixpk= 466, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1550,1551,
 &end
#
#  106 GLU  HA          106 GLU  HG-         4.50    (#    467:20  Unique         2.07, 3.01 A)
 &rst
  ixpk= 467, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1550,1551,
 &end
#
#  122 LYS  HG+         122 LYS  HB+         4.50    (#    468:20  Unique         2.23, 2.69 A)
 &rst
  ixpk= 468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1781,1782,
 igr2=1778,1779,
 &end
#
#   72 ALA  HA           76 GLN  HG+         5.50    (#    470:20  Unique         4.55, 5.18 A)
 &rst
  ixpk= 470, nxpk= 20, iat=1033,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#   76 GLN  HB+          76 GLN  HG+         3.50    (#    471:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1096,1097,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:472      0 AMB  20-1:472    3.50    (#    472:20  Double Ambig)
 &rst
  ixpk= 472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1096,1097,1135,1136,
 igr2=1099,1100,1099,1100,
 &end
#
#   72 ALA  HA           76 GLN  HG-         7.00    (#    473:20  Unique         4.55, 5.18 A)
 &rst
  ixpk= 473, nxpk= 20, iat=1033,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:474     76 GLN  HG-         5.50    (#    474:20  Single Ambig)
 &rst
  ixpk= 474, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1138,1139, 605, 606, 605, 606,1084,1085,
 igr2=1099,1100,
 &end
#
#   76 GLN  HB+          76 GLN  HG-         3.50    (#    475:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 475, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1096,1097,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:476      0 AMB  20-1:476    5.50    (#    476:20  Double Ambig)
 &rst
  ixpk= 476, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1=1138,1139, 605, 606, 605, 606,1084,1085,
 igr2=1099,1100,1099,1100,1099,1100,1099,1100,
 &end
#
#    0 AMB  20-2:477     76 GLN  HG-         3.50    (#    477:20  Single Ambig)
 &rst
  ixpk= 477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1096,1097,1135,1136,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:479     74 GLN  HG-         4.50    (#    479:20  Single Ambig)
 &rst
  ixpk= 479, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1062,1018,
 igr2=1067,1068,
 &end
#
#    0 AMB  20-2:480      0 AMB  20-1:480    4.50    (#    480:20  Double Ambig)
 &rst
  ixpk= 480, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1062,1018,
 igr2=1067,1068,1067,1068,
 &end
#
#  147 LYS  HA          147 LYS  HB-         5.50    (#    483:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 483, nxpk= 20, iat=2177,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2179,2180,
 &end
#
#  146 LEU  HB-         147 LYS  HB-         7.00    (#    485:20  Unique         5.63, 6.42 A)
 &rst
  ixpk= 485, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=2160,2161,
 igr2=2179,2180,
 &end
#
#  147 LYS  HG+         147 LYS  HB-         5.50    (#    486:20  Unique         2.24, 2.71 A)
 &rst
  ixpk= 486, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2182,2183,
 igr2=2179,2180,
 &end
#
#   34 GLU  HG+          34 GLU  HB-         3.50    (#    488:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 488, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 481, 482,
 igr2= 478, 479,
 &end
#
#   36 LEU  MDY          34 GLU  HB-         7.00    (#    489:20  Unique         2.27, 4.34 A)
 &rst
  ixpk= 489, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 478, 479,
 &end
#
#    2 ALA  MB           34 GLU  HB-         4.50    (#    490:20  Unique         2.06, 3.85 A)
 &rst
  ixpk= 490, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  25,  26,  27,
 igr2= 478, 479,
 &end
#
#   34 GLU  HG+          34 GLU  HB+         3.50    (#    491:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 481, 482,
 igr2= 478, 479,
 &end
#
#    2 ALA  MB           34 GLU  HB+         4.50    (#    492:20  Unique         2.06, 3.85 A)
 &rst
  ixpk= 492, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  25,  26,  27,
 igr2= 478, 479,
 &end
#
#  116 GLN  HB-         116 GLN  HG+         5.50    (#    495:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1692,1693,
 igr2=1695,1696,
 &end
#
#    0 AMB  20-2:496     52 VAL  HB          4.50    (#    496:20  Single Ambig)
 &rst
  ixpk= 496, nxpk= 20, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 754, 755, 756, 758, 759, 760, 105, 106,
 &end
#
#   52 VAL  MGY          52 VAL  HB          3.50    (#    497:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 497, nxpk= 20, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#    0 AMB  20-2:498     52 VAL  HB          4.50    (#    498:20  Single Ambig)
 &rst
  ixpk= 498, nxpk= 20, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 754, 755, 756, 758, 759, 760, 105, 106,
 &end
#
#  104 LYS  HA          104 LYS  HB+         7.00    (#    499:20  Unique         2.46, 2.77 A)
 &rst
  ixpk= 499, nxpk= 20, iat=1504,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1506,1507,
 &end
#
#    0 AMB  20-2:500    116 GLN  HG-         5.50    (#    500:20  Single Ambig)
 &rst
  ixpk= 500, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1690,1259,1260,
 igr2=1695,1696,
 &end
#
#  116 GLN  HB+         116 GLN  HG-         5.50    (#    502:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 502, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1692,1693,
 igr2=1695,1696,
 &end
#
#    0 AMB  20-2:503      0 AMB  20-1:503    7.00    (#    503:20  Double Ambig)
 &rst
  ixpk= 503, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1164,1918,1919,
 igr2=1138,1139,1934,1935,
 &end
#
#  104 LYS  HG-         104 LYS  HB+         4.50    (#    504:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 504, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1509,1510,
 igr2=1506,1507,
 &end
#
#   78 PRO  HG+          78 PRO  HB-         2.80    (#    505:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 505, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1135,1136,
 igr2=1138,1139,
 &end
#
#    0 AMB  20-2:506      0 AMB  20-1:506    4.50    (#    506:20  Double Ambig)
 &rst
  ixpk= 506, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 igr2=1138,1139,1138,1139,
 &end
#
#    0 AMB  20-2:508     78 PRO  HB-         4.50    (#    508:20  Single Ambig)
 &rst
  ixpk= 508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 igr2=1138,1139,
 &end
#
#    0 AMB  20-2:510      0 AMB  20-1:510    4.50    (#    510:20  Double Ambig)
 &rst
  ixpk= 510, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1609,1610,1609,1610,
 igr2=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:511      0 AMB  20-1:511    4.50    (#    511:20  Double Ambig)
 &rst
  ixpk= 511, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1365,1366,1692,1693,1692,1693,1670,1671,1670,1671,
      
 igr2=1730,1731,1606,1607,1606,1607,1606,1607,
 &end
#
#  122 LYS  HG+         131 PRO  HB+         5.50    (#    513:20  Unique         1.96, 3.63 A)
 &rst
  ixpk= 513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1781,1782,
 igr2=1934,1935,
 &end
#
#   83 VAL  MGX          83 VAL  HB          4.50    (#    514:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 514, nxpk= 20, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#  119 GLU  HG+         119 GLU  HB+         2.80    (#    516:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 516, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1733,1734,
 igr2=1730,1731,
 &end
#
#  119 GLU  HG+         119 GLU  HB-         3.50    (#    519:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1733,1734,
 igr2=1730,1731,
 &end
#
#   83 VAL  MGY          83 VAL  HB          4.50    (#    521:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 521, nxpk= 20, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#  114 ALA  MB           83 VAL  HB          5.50    (#    524:20  Unique         5.27, 6.29 A)
 &rst
  ixpk= 524, nxpk= 20, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1660,1661,1662,
 &end
#
#  143 VAL  HA          143 VAL  HB          4.50    (#    527:20  Unique         2.99, 3.00 A)
 &rst
  ixpk= 527, nxpk= 20, iat=2109,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:528    143 VAL  HB          3.50    (#    528:20  Single Ambig)
 &rst
  ixpk= 528, nxpk= 20, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#    0 AMB  20-2:530    143 VAL  HB          4.50    (#    530:20  Single Ambig)
 &rst
  ixpk= 530, nxpk= 20, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 413, 414, 415,2179,2180,
 &end
#
#    0 AMB  20-2:533      0 AMB  20-1:533    5.50    (#    533:20  Double Ambig)
 &rst
  ixpk= 533, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 238, 962, 963,
 igr2= 240, 968, 969,
 &end
#
#    0 AMB  20-2:534     18 VAL  HB          3.50    (#    534:20  Single Ambig)
 &rst
  ixpk= 534, nxpk= 20, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 242, 243, 244, 246, 247, 248,1809,1810,1811,
 &end
#
#    0 AMB  20-2:537      6 LEU  HG          3.50    (#    537:20  Single Ambig)
 &rst
  ixpk= 537, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 &end
#
#   75 GLU  HA           75 GLU  HB-         3.50    (#    538:20  Unique         2.43, 2.74 A)
 &rst
  ixpk= 538, nxpk= 20, iat=1079,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1081,1082,
 &end
#
#   75 GLU  HG+          75 GLU  HB-         2.80    (#    539:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 539, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1084,1085,
 igr2=1081,1082,
 &end
#
#    0 AMB  20-2:540      0 AMB  20-1:540    4.50    (#    540:20  Double Ambig)
 &rst
  ixpk= 540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 340,1079,
 igr2= 342, 343,1081,1082,
 &end
#
#   75 GLU  HG+          75 GLU  HB+         3.50    (#    541:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 541, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1084,1085,
 igr2=1081,1082,
 &end
#
#    0 AMB  20-2:542      0 AMB  20-1:542    3.50    (#    542:20  Double Ambig)
 &rst
  ixpk= 542, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 166, 167, 168, 170, 171, 172, 242, 243, 244, 246,
       247, 248, 369, 370, 371, 373, 374, 375,
 igr2= 968, 969, 240, 342, 343,
 &end
#
#    0 AMB  20-2:545      6 LEU  HG          4.50    (#    545:20  Single Ambig)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 298, 299, 733, 734,
 &end
#
#   12 LEU  MDX          68 PRO  HB+         4.50    (#    548:20  Unique         2.15, 4.64 A)
 &rst
  ixpk= 548, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 166, 167, 168, 170, 171, 172,
 igr2= 968, 969,
 &end
#
#  138 TRP  HA          138 TRP  HB+         4.50    (#    549:20  Unique         2.62, 2.84 A)
 &rst
  ixpk= 549, nxpk= 20, iat=2024,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2026,2027,
 &end
#
#  121 LEU  HG          138 TRP  HB+         5.50    (#    550:20  Unique         2.11, 2.63 A)
 &rst
  ixpk= 550, nxpk= 20, iat=1762,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2026,2027,
 &end
#
#  121 LEU  HG          138 TRP  HB+         5.50    (#    551:20  Unique         2.11, 2.63 A)
 &rst
  ixpk= 551, nxpk= 20, iat=1762,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2026,2027,
 &end
#
#   77 LYS  HG+          77 LYS  HB+         2.80    (#    552:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1116,1117,
 igr2=1113,1114,
 &end
#
#   94 GLU  HA           94 GLU  HB+         4.50    (#    553:20  Unique         2.24, 2.76 A)
 &rst
  ixpk= 553, nxpk= 20, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1365,1366,
 &end
#
#    0 AMB  20-2:554      0 AMB  20-1:554    2.80    (#    554:20  Double Ambig)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1368,1369,1368,1369,
 igr2=1365,1366,1365,1366,
 &end
#
#  106 GLU  HA          106 GLU  HB+         4.50    (#    559:20  Unique         2.42, 2.77 A)
 &rst
  ixpk= 559, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1547,1548,
 &end
#
#   74 GLN  HA           74 GLN  HB-         3.50    (#    560:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 560, nxpk= 20, iat=1062,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1064,1065,
 &end
#
#    0 AMB  20-2:564      0 AMB  20-1:564    2.80    (#    564:20  Double Ambig)
 &rst
  ixpk= 564, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1999,2000,1550,1551,
 igr2=1996,1997,1547,1548,
 &end
#
#    0 AMB  20-2:566      0 AMB  20-1:566    4.50    (#    566:20  Double Ambig)
 &rst
  ixpk= 566, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1062,1330,1331,
 igr2=1064,1065,1341,1342,
 &end
#
#    0 AMB  20-2:567      0 AMB  20-1:567    5.50    (#    567:20  Double Ambig)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1615,1616,1615,1616,
 igr2=1612,1613,1612,1613,
 &end
#
#    0 AMB  20-2:570     28 GLU  HB-         3.50    (#    570:20  Single Ambig)
 &rst
  ixpk= 570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 340, 396,
 igr2= 398, 399,
 &end
#
#    0 AMB  20-2:571      0 AMB  20-1:571    3.50    (#    571:20  Double Ambig)
 &rst
  ixpk= 571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1547,1548,1547,1548,
 igr2=1612,1613,1612,1613,
 &end
#
#  106 GLU  HB+         110 LYS  HD+         4.50    (#    572:20  Unique         2.03, 3.75 A)
 &rst
  ixpk= 572, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1547,1548,
 igr2=1612,1613,
 &end
#
#   24 GLU  HG+          24 GLU  HB+         4.50    (#    574:20  Unique         2.22, 2.72 A)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 330, 331,
 igr2= 327, 328,
 &end
#
#   24 GLU  HA           24 GLU  HB+         4.50    (#    575:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 575, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#   71 GLU  HG-          71 GLU  HB+         2.80    (#    576:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1023,1024,
 igr2=1020,1021,
 &end
#
#  147 LYS  HE+         147 LYS  HD+         5.50    (#    577:20  Unique         2.33, 2.57 A)
 &rst
  ixpk= 577, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2188,2189,
 igr2=2185,2186,
 &end
#
#   71 GLU  HA           71 GLU  HB+         3.50    (#    578:20  Unique         2.61, 2.81 A)
 &rst
  ixpk= 578, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1020,1021,
 &end
#
#   71 GLU  HG+          71 GLU  HB+         3.50    (#    579:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 579, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1023,1024,
 igr2=1020,1021,
 &end
#
#  147 LYS  HB-         147 LYS  HD+         3.50    (#    580:20  Unique         1.99, 2.88 A)
 &rst
  ixpk= 580, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2179,2180,
 igr2=2185,2186,
 &end
#
#   24 GLU  HA           24 GLU  HB+         4.50    (#    584:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 584, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#    0 AMB  20-2:585      0 AMB  20-1:585    4.50    (#    585:20  Double Ambig)
 &rst
  ixpk= 585, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1116,1117, 256, 257, 258,
 igr2=1119,1120, 204, 205,
 &end
#
#  108 GLU  HG-          77 LYS  HD-         4.50    (#    586:20  Unique         4.53, 5.97 A)
 &rst
  ixpk= 586, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1575,1576,
 igr2=1119,1120,
 &end
#
#    0 AMB  20-2:587      0 AMB  20-1:587    5.50    (#    587:20  Double Ambig)
 &rst
  ixpk= 587, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1679,1680,1122,1123,
 igr2=1676,1677,1119,1120,
 &end
#
#   77 LYS  HG-          77 LYS  HD-         4.50    (#    588:20  Unique         2.23, 2.66 A)
 &rst
  ixpk= 588, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1116,1117,
 igr2=1119,1120,
 &end
#
#   20 GLU  HA           20 GLU  HB-         4.50    (#    589:20  Unique         2.55, 2.82 A)
 &rst
  ixpk= 589, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 266, 267,
 &end
#
#   20 GLU  HA            0 AMB  20-1:590    4.50    (#    590:20  Single Ambig)
 &rst
  ixpk= 590, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:591      0 AMB  20-1:591    3.50    (#    591:20  Double Ambig)
 &rst
  ixpk= 591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1099,1100,1099,1100,
 igr2=1096,1097,1096,1097,
 &end
#
#    0 AMB  20-2:592     76 GLN  HB-         3.50    (#    592:20  Single Ambig)
 &rst
  ixpk= 592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1099,1100,1099,1100,
 igr2=1096,1097,
 &end
#
#   77 LYS  HE+          77 LYS  HD+         3.50    (#    594:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 594, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1122,1123,
 igr2=1119,1120,
 &end
#
#   23 ALA  HA            6 LEU  MDX         5.50    (#    595:20  Unique         3.05, 4.51 A)
 &rst
  ixpk= 595, nxpk= 20, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HB+           6 LEU  MDX         4.50    (#    596:20  Unique         2.24, 3.48 A)
 &rst
  ixpk= 596, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  80,  81,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HG            6 LEU  MDX         3.50    (#    597:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 597, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HB-           6 LEU  MDX         3.50    (#    598:20  Unique         2.24, 3.48 A)
 &rst
  ixpk= 598, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  80,  81,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:599      6 LEU  MDX         4.50    (#    599:20  Single Ambig)
 &rst
  ixpk= 599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 733, 734, 298, 299,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#   53 ILE  MD1           6 LEU  MDX         3.50    (#    600:20  Unique         2.02, 4.64 A)
 &rst
  ixpk= 600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 777, 778, 779,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:601      0 AMB  20-1:601    2.80    (#    601:20  Double Ambig)
 &rst
  ixpk= 601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 605, 606, 605, 606,
 igr2= 602, 603, 602, 603,
 &end
#
#   19 ALA  HA            6 LEU  MDX         5.50    (#    602:20  Unique         3.52, 5.99 A)
 &rst
  ixpk= 602, nxpk= 20, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:603      0 AMB  20-1:603    5.50    (#    603:20  Double Ambig)
 &rst
  ixpk= 603, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1132,1133, 962, 963,
 igr2=1096,1097, 965, 966,
 &end
#
#   24 GLU  HA            0 AMB  20-1:604    4.50    (#    604:20  Single Ambig)
 &rst
  ixpk= 604, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 383, 384, 383, 384,
 &end
#
#    0 AMB  20-2:605      0 AMB  20-1:605    3.50    (#    605:20  Double Ambig)
 &rst
  ixpk= 605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 386, 387, 386, 387, 386, 387,
 igr2= 383, 384, 383, 384, 383, 384,
 &end
#
#   90 ILE  MD1          90 ILE  HG1+        3.50    (#    612:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1313,1314,1315,
 igr2=1310,1311,
 &end
#
#  139 LEU  HA          142 TRP  HB+         7.00    (#    613:20  Unique         2.83, 3.61 A)
 &rst
  ixpk= 613, nxpk= 20, iat=2048,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2087,2088,
 &end
#
#   90 ILE  HB           90 ILE  HG1-        4.50    (#    617:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 617, nxpk= 20, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1310,1311,
 &end
#
#  142 TRP  HA          142 TRP  HB+         5.50    (#    618:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 618, nxpk= 20, iat=2085,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2087,2088,
 &end
#
#   45 PRO  HD+          45 PRO  HG+         4.50    (#    619:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 645, 646,
 igr2= 648, 649,
 &end
#
#    0 AMB  20-2:620      0 AMB  20-1:620    4.50    (#    620:20  Double Ambig)
 &rst
  ixpk= 620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1695,1696, 690,
 igr2=1692,1693, 696, 697,
 &end
#
#  139 LEU  HA          142 TRP  HB-         5.50    (#    621:20  Unique         2.83, 3.61 A)
 &rst
  ixpk= 621, nxpk= 20, iat=2048,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2087,2088,
 &end
#
#   51 LEU  HG            4 ILE  HG1-        4.50    (#    622:20  Unique         4.53, 5.14 A)
 &rst
  ixpk= 622, nxpk= 20, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  53,  54,
 &end
#
#    4 ILE  MD1           4 ILE  HG1-        4.50    (#    623:20  Unique         2.35, 2.62 A)
 &rst
  ixpk= 623, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  56,  57,  58,
 igr2=  53,  54,
 &end
#
#   45 PRO  HD+          45 PRO  HG-         4.50    (#    624:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 624, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 645, 646,
 igr2= 648, 649,
 &end
#
#   45 PRO  HD-          45 PRO  HG-         5.50    (#    625:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 645, 646,
 igr2= 648, 649,
 &end
#
#   45 PRO  HD-          45 PRO  HG+         4.50    (#    627:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 627, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 645, 646,
 igr2= 648, 649,
 &end
#
#    4 ILE  MD1           4 ILE  HG1+        7.00    (#    630:20  Unique         2.35, 2.62 A)
 &rst
  ixpk= 630, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  56,  57,  58,
 igr2=  53,  54,
 &end
#
#    7 ILE  MD1           7 ILE  HG1+        4.50    (#    631:20  Unique         2.23, 2.62 A)
 &rst
  ixpk= 631, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 108, 109, 110,
 igr2= 105, 106,
 &end
#
#    7 ILE  MD1           7 ILE  HG1-        3.50    (#    636:20  Unique         2.23, 2.62 A)
 &rst
  ixpk= 636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 108, 109, 110,
 igr2= 105, 106,
 &end
#
#   53 ILE  HB           53 ILE  HG1+        4.50    (#    639:20  Unique         2.68, 2.83 A)
 &rst
  ixpk= 639, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 774, 775,
 &end
#
#    7 ILE  MD1           7 ILE  HG1-        5.50    (#    642:20  Unique         2.23, 2.62 A)
 &rst
  ixpk= 642, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 108, 109, 110,
 igr2= 105, 106,
 &end
#
#    7 ILE  HB            7 ILE  HG1-        5.50    (#    643:20  Unique         2.46, 2.75 A)
 &rst
  ixpk= 643, nxpk= 20, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 105, 106,
 &end
#
#    0 AMB  20-2:646      0 AMB  20-1:646    4.50    (#    646:20  Double Ambig)
 &rst
  ixpk= 646, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1533,1534,1535,1537,1538,1539,  53,  54,
 igr2=1531, 696, 697,
 &end
#
#   41 LEU  MDY          41 LEU  HG          4.50    (#    647:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 647, nxpk= 20, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:648     36 LEU  HG          4.50    (#    648:20  Single Ambig)
 &rst
  ixpk= 648, nxpk= 20, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  80,  81, 478, 479,
 &end
#
#   36 LEU  HB-          36 LEU  HG          4.50    (#    649:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 649, nxpk= 20, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 507, 508,
 &end
#
#   51 LEU  MDX          51 LEU  HG          4.50    (#    650:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 650, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 738, 739, 740, 742, 743, 744,
 &end
#
#   78 PRO  HB-          78 PRO  HG+         3.50    (#    656:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1138,1139,
 igr2=1135,1136,
 &end
#
#   80 LEU  HG           78 PRO  HG+         4.50    (#    657:20  Unique         3.78, 4.66 A)
 &rst
  ixpk= 657, nxpk= 20, iat=1164,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1135,1136,
 &end
#
#    0 AMB  20-2:658      0 AMB  20-1:658    4.50    (#    658:20  Double Ambig)
 &rst
  ixpk= 658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1132,1133,1642,1643,
 igr2=1135,1136,1135,1136,
 &end
#
#    0 AMB  20-2:659      0 AMB  20-1:659    3.50    (#    659:20  Double Ambig)
 &rst
  ixpk= 659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 364, 365,1138,1139,
 igr2= 367,1135,1136,
 &end
#
#    0 AMB  20-2:660      0 AMB  20-1:660    3.50    (#    660:20  Double Ambig)
 &rst
  ixpk= 660, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 692, 693, 694, 940, 941, 942, 944, 945, 946,
 igr2=1220,1221,1531,
 &end
#
#    0 AMB  20-2:661      0 AMB  20-1:661    3.50    (#    661:20  Double Ambig)
 &rst
  ixpk= 661, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 699, 700, 701, 588, 589, 590, 592, 593, 594,
 igr2=1220,1221, 586,
 &end
#
#    0 AMB  20-2:662      0 AMB  20-1:662    2.80    (#    662:20  Double Ambig)
 &rst
  ixpk= 662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 345, 346, 583, 584,
 igr2= 348, 349, 586,
 &end
#
#   25 LYS  HA           25 LYS  HD+         4.50    (#    663:20  Unique         2.21, 2.99 A)
 &rst
  ixpk= 663, nxpk= 20, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 348, 349,
 &end
#
#    0 AMB  20-2:664      0 AMB  20-1:664    5.50    (#    664:20  Double Ambig)
 &rst
  ixpk= 664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1223,1224, 351, 352,
 igr2=1220,1221, 348, 349,
 &end
#
#   25 LYS  HG-          25 LYS  HD+         4.50    (#    665:20  Unique         2.41, 2.58 A)
 &rst
  ixpk= 665, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 345, 346,
 igr2= 348, 349,
 &end
#
#   88 ILE  MD1          53 ILE  HG1+        4.50    (#    667:20  Unique         2.05, 3.28 A)
 &rst
  ixpk= 667, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1287,1288,1289,
 igr2= 774, 775,
 &end
#
#   36 LEU  HB-          36 LEU  HG          4.50    (#    668:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 668, nxpk= 20, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 507, 508,
 &end
#
#    0 AMB  20-2:669      0 AMB  20-1:669    3.50    (#    669:20  Double Ambig)
 &rst
  ixpk= 669, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 303, 304, 305, 307, 308, 309, 512, 513, 514, 516,
       517, 518,
 igr2= 774, 775, 510,
 &end
#
#   18 VAL  MGX         123 ILE  HG1+        3.50    (#    671:20  Unique         2.18, 4.69 A)
 &rst
  ixpk= 671, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 242, 243, 244, 246, 247, 248,
 igr2=1806,1807,
 &end
#
#    0 AMB  20-2:673     51 LEU  HG          5.50    (#    673:20  Single Ambig)
 &rst
  ixpk= 673, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1284,1285, 777, 778, 779, 774, 775,
 &end
#
#   26 LEU  MDY          26 LEU  HG          3.50    (#    674:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:675     26 LEU  HG          7.00    (#    675:20  Single Ambig)
 &rst
  ixpk= 675, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
 igr1=1284,1285, 777, 778, 779, 774, 775,
 &end
#
#    0 AMB  20-2:676      0 AMB  20-1:676    3.50    (#    676:20  Double Ambig)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1606,1607,1528,1529,
 igr2=1609,1610,1531,
 &end
#
#  110 LYS  HD+         110 LYS  HG+         3.50    (#    677:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1612,1613,
 igr2=1609,1610,
 &end
#
#   49 ILE  MG2           0 AMB  20-1:678    3.50    (#    678:20  Single Ambig)
 &rst
  ixpk= 678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 692, 693, 694,
 igr2=1220,1221,1220,1221,
 &end
#
#   18 VAL  MGX         123 ILE  HG1-        3.50    (#    679:20  Unique         2.18, 4.69 A)
 &rst
  ixpk= 679, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 242, 243, 244, 246, 247, 248,
 igr2=1806,1807,
 &end
#
#   40 LEU  HB-          40 LEU  HG          3.50    (#    682:20  Unique         2.44, 2.73 A)
 &rst
  ixpk= 682, nxpk= 20, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 564, 565,
 &end
#
#   40 LEU  MDX          40 LEU  HG          3.50    (#    683:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 683, nxpk= 20, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 569, 570, 571, 573, 574, 575,
 &end
#
#   40 LEU  HB+          40 LEU  HG          4.50    (#    684:20  Unique         2.44, 2.73 A)
 &rst
  ixpk= 684, nxpk= 20, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 564, 565,
 &end
#
#    0 AMB  20-2:685     12 LEU  HG          3.50    (#    685:20  Single Ambig)
 &rst
  ixpk= 685, nxpk= 20, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 166, 167, 168, 170, 171, 172, 166, 167, 168, 170,
       171, 172,
 &end
#
#    0 AMB  20-2:687    123 ILE  HG1-        3.50    (#    687:20  Single Ambig)
 &rst
  ixpk= 687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 242, 243, 244, 246, 247, 248,1809,1810,1811,
 igr2=1806,1807,
 &end
#
#    0 AMB  20-2:692      0 AMB  20-1:692    3.50    (#    692:20  Double Ambig)
 &rst
  ixpk= 692, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1914,1915,1916,1921,1922,1923,
 igr2=1918,1919,1918,1919,
 &end
#
#    0 AMB  20-2:693    121 LEU  MDY         5.50    (#    693:20  Single Ambig)
 &rst
  ixpk= 693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1280,1281,1282,1762,
 igr2=1764,1765,1766,1768,1769,1770,
 &end
#
#   18 VAL  MGY          22 LEU  HG          4.50    (#    698:20  Unique         2.04, 4.04 A)
 &rst
  ixpk= 698, nxpk= 20, iat=  -1, 301, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#  109 LEU  MDX         109 LEU  HG          4.50    (#    699:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 699, nxpk= 20, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:700      0 AMB  20-1:700    3.50    (#    700:20  Double Ambig)
 &rst
  ixpk= 700, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1=1533,1534,1535,1537,1538,1539,1921,1922,1923,
 igr2=1590,1918,1919,
 &end
#
#  105 LEU  HB+         105 LEU  MDX         5.50    (#    702:20  Unique         2.23, 3.48 A)
 &rst
  ixpk= 702, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1528,1529,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:704    139 LEU  HG          4.50    (#    704:20  Single Ambig)
 &rst
  ixpk= 704, nxpk= 20, iat=  -1,2053, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2055,2056,2057,2059,2060,2061,2113,2114,2115,2117,
      2118,2119,
 &end
#
#    0 AMB  20-2:705    139 LEU  MDY         3.50    (#    705:20  Single Ambig)
 &rst
  ixpk= 705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 342, 343,2050,2051,2053,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#  109 LEU  HG          105 LEU  MDX         7.00    (#    707:20  Unique         2.00, 3.74 A)
 &rst
  ixpk= 707, nxpk= 20, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#  109 LEU  MDY         109 LEU  HG          5.50    (#    709:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 709, nxpk= 20, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#   44 LEU  MDY          44 LEU  HG          4.50    (#    710:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 710, nxpk= 20, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#  139 LEU  HA          139 LEU  MDY         5.50    (#    711:20  Unique         2.14, 3.56 A)
 &rst
  ixpk= 711, nxpk= 20, iat=2048,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:712      0 AMB  20-1:712    5.50    (#    712:20  Double Ambig)
 &rst
  ixpk= 712, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 345, 346,1278,
 igr2=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
      1769,1770,
 &end
#
#   43 ASP  HB+          36 LEU  MDX         7.00    (#    713:20  Unique         1.98, 3.66 A)
 &rst
  ixpk= 713, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 617, 618,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#    0 AMB  20-2:714     44 LEU  MDY         4.50    (#    714:20  Single Ambig)
 &rst
  ixpk= 714, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=  66, 681, 682,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   44 LEU  HG           44 LEU  MDY         3.50    (#    715:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 715, nxpk= 20, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   44 LEU  HB-          44 LEU  MDY         4.50    (#    716:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 716, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 629, 630,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#  104 LYS  HB+         104 LYS  HG+         5.50    (#    718:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1506,1507,
 igr2=1509,1510,
 &end
#
#    0 AMB  20-2:720      0 AMB  20-1:720    4.50    (#    720:20  Double Ambig)
 &rst
  ixpk= 720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1506,1507, 629, 630,
 igr2=1509,1510, 632,
 &end
#
#    0 AMB  20-2:721      0 AMB  20-1:721    4.50    (#    721:20  Double Ambig)
 &rst
  ixpk= 721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 367,1528,1529, 342, 343,
 igr2= 369, 370, 371, 373, 374, 375,1533,1534,1535,1537,
      1538,1539,
 &end
#
#   34 GLU  HB+          36 LEU  MDX         5.50    (#    723:20  Unique         2.27, 4.34 A)
 &rst
  ixpk= 723, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 478, 479,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   36 LEU  HB+          36 LEU  MDX         4.50    (#    724:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 507, 508,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   36 LEU  HB-          36 LEU  MDX         5.50    (#    725:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 507, 508,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#    7 ILE  MG2          36 LEU  MDX         4.50    (#    727:20  Unique         3.92, 7.43 A)
 &rst
  ixpk= 727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 101, 102, 103,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   44 LEU  HB+          44 LEU  MDY         5.50    (#    728:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 728, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 629, 630,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#  104 LYS  HB+         104 LYS  HG+         5.50    (#    730:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 730, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1506,1507,
 igr2=1509,1510,
 &end
#
#    0 AMB  20-2:733      0 AMB  20-1:733    3.50    (#    733:20  Double Ambig)
 &rst
  ixpk= 733, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1=1528,1529,2141,2142,
 igr2=1533,1534,1535,1537,1538,1539,2144,
 &end
#
#   73 LEU  MDY          73 LEU  HG          4.50    (#    736:20  Unique         2.34, 2.63 A)
 &rst
  ixpk= 736, nxpk= 20, iat=  -1,1048, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:737      0 AMB  20-1:737    4.50    (#    737:20  Double Ambig)
 &rst
  ixpk= 737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 629, 630,1045,1046,
 igr2= 632,1048,
 &end
#
#    0 AMB  20-2:738      0 AMB  20-1:738    4.50    (#    738:20  Double Ambig)
 &rst
  ixpk= 738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1526, 296,
 igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
       374, 375,
 &end
#
#   26 LEU  HB+          26 LEU  MDY         4.50    (#    739:20  Unique         2.10, 3.48 A)
 &rst
  ixpk= 739, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 364, 365,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:740     26 LEU  MDY         4.50    (#    740:20  Single Ambig)
 &rst
  ixpk= 740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2053, 367,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#   51 LEU  MDX          26 LEU  MDY         4.50    (#    741:20  Unique         1.99, 5.27 A)
 &rst
  ixpk= 741, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#   51 LEU  MDY          26 LEU  MDY         4.50    (#    742:20  Unique         1.99, 5.27 A)
 &rst
  ixpk= 742, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#  105 LEU  HG          105 LEU  MDX         3.50    (#    743:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 743, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:744    105 LEU  MDX         4.50    (#    744:20  Single Ambig)
 &rst
  ixpk= 744, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 997,1545,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:745     41 LEU  MDX         5.50    (#    745:20  Single Ambig)
 &rst
  ixpk= 745, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 965, 966,1135,1136,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   41 LEU  HB+          41 LEU  MDX         4.50    (#    746:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 746, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 583, 584,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   72 ALA  MB           41 LEU  MDX         2.80    (#    747:20  Unique         2.00, 4.09 A)
 &rst
  ixpk= 747, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1035,1036,1037,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   70 TYR  HA           73 LEU  MDY         5.50    (#    749:20  Unique         1.99, 4.25 A)
 &rst
  ixpk= 749, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HB+          73 LEU  MDY         5.50    (#    750:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1045,1046,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HG           73 LEU  MDY         4.50    (#    751:20  Unique         2.34, 2.63 A)
 &rst
  ixpk= 751, nxpk= 20, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:754      0 AMB  20-1:754    3.50    (#    754:20  Double Ambig)
 &rst
  ixpk= 754, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1528,1529, 298, 299,
 igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
       374, 375,
 &end
#
#  142 TRP  HA          145 LEU  HG          5.50    (#    755:20  Unique         4.79, 4.89 A)
 &rst
  ixpk= 755, nxpk= 20, iat=2085,2144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 LEU  HB-          73 LEU  MDY         7.00    (#    756:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 756, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1045,1046,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:757     73 LEU  MDY         5.50    (#    757:20  Single Ambig)
 &rst
  ixpk= 757, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1592,1593,1594,1596,1597,1598, 588, 589, 590, 592,
       593, 594,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:758    121 LEU  HG          7.00    (#    758:20  Single Ambig)
 &rst
  ixpk= 758, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1=1268,1269,1270, 774, 775,
 &end
#
#  121 LEU  MDY         121 LEU  HG          4.50    (#    759:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 759, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#  138 TRP  HB+         121 LEU  HG          4.50    (#    761:20  Unique         2.11, 2.63 A)
 &rst
  ixpk= 761, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2026,2027,
 &end
#
#  121 LEU  MDX         121 LEU  HG          3.50    (#    762:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 762, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#   88 ILE  HG1-        121 LEU  HG          5.50    (#    763:20  Unique         4.48, 5.80 A)
 &rst
  ixpk= 763, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1284,1285,
 &end
#
#  121 LEU  HB-         121 LEU  HG          4.50    (#    764:20  Unique         2.59, 2.81 A)
 &rst
  ixpk= 764, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1759,1760,
 &end
#
#    0 AMB  20-2:767      0 AMB  20-1:767    3.50    (#    767:20  Double Ambig)
 &rst
  ixpk= 767, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 464, 541, 542,
 igr2=  85,  86,  87,  89,  90,  91, 166, 167, 168, 170,
       171, 172,
 &end
#
#    6 LEU  HB+           6 LEU  MDY         3.50    (#    768:20  Unique         2.24, 3.48 A)
 &rst
  ixpk= 768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  80,  81,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#   40 LEU  HB-          40 LEU  MDX         2.80    (#    769:20  Unique         2.33, 3.28 A)
 &rst
  ixpk= 769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 564, 565,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    6 LEU  HG            6 LEU  MDY         2.80    (#    770:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 770, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:771      6 LEU  MDY         3.50    (#    771:20  Single Ambig)
 &rst
  ixpk= 771, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 733, 734, 298, 299,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:772      0 AMB  20-1:772    5.50    (#    772:20  Double Ambig)
 &rst
  ixpk= 772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 364, 365, 605, 606, 605, 606,
 igr2=  85,  86,  87,  89,  90,  91, 569, 570, 571, 573,
       574, 575,
 &end
#
#    0 AMB  20-2:773      0 AMB  20-1:773    3.50    (#    773:20  Double Ambig)
 &rst
  ixpk= 773, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 733, 734, 567,
 igr2=  85,  86,  87,  89,  90,  91, 569, 570, 571, 573,
       574, 575,
 &end
#
#  139 LEU  HA          139 LEU  MDX         4.50    (#    777:20  Unique         2.14, 3.56 A)
 &rst
  ixpk= 777, nxpk= 20, iat=2048,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:778    139 LEU  MDX         3.50    (#    778:20  Single Ambig)
 &rst
  ixpk= 778, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 342, 343,2050,2051,2053,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:779    139 LEU  MDX         3.50    (#    779:20  Single Ambig)
 &rst
  ixpk= 779, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1764,1765,1766,1768,1769,1770, 369, 370, 371, 373,
       374, 375,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#   88 ILE  HG1-        139 LEU  MDX         5.50    (#    780:20  Unique         5.01, 7.79 A)
 &rst
  ixpk= 780, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1284,1285,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#   88 ILE  MD1          88 ILE  HG1-        7.00    (#    781:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 781, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1287,1288,1289,
 igr2=1284,1285,
 &end
#
#   51 LEU  HB+          51 LEU  MDX         4.50    (#    782:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 733, 734,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  20-2:783     51 LEU  MDX         4.50    (#    783:20  Single Ambig)
 &rst
  ixpk= 783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=  83,1220,1221,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#   51 LEU  HG           51 LEU  MDX         3.50    (#    784:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 784, nxpk= 20, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  20-2:785     51 LEU  MDX         2.80    (#    785:20  Single Ambig)
 &rst
  ixpk= 785, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=  85,  86,  87,  89,  90,  91, 369, 370, 371, 373,
       374, 375,  49,  50,  51, 692, 693, 694,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#  147 LYS  HD+         147 LYS  HG+         3.50    (#    789:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 789, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2185,2186,
 igr2=2182,2183,
 &end
#
#  146 LEU  MDX         146 LEU  HG          5.50    (#    791:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 791, nxpk= 20, iat=  -1,2163, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   88 ILE  MD1          88 ILE  HG1-        4.50    (#    792:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 792, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1287,1288,1289,
 igr2=1284,1285,
 &end
#
#    0 AMB  20-2:794    109 LEU  MDY         4.50    (#    794:20  Single Ambig)
 &rst
  ixpk= 794, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1585,1545,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  HG          109 LEU  MDY         4.50    (#    795:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 795, nxpk= 20, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  HB+         109 LEU  MDY         4.50    (#    796:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 796, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1587,1588,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#   52 VAL  MGX         109 LEU  MDY         4.50    (#    797:20  Unique         2.29, 5.22 A)
 &rst
  ixpk= 797, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 754, 755, 756, 758, 759, 760,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  HB-         109 LEU  MDY         4.50    (#    799:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1587,1588,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  146 LEU  MDY         146 LEU  HG          5.50    (#    801:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 801, nxpk= 20, iat=  -1,2163, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   52 VAL  MGX         109 LEU  MDX         5.50    (#    802:20  Unique         2.29, 5.22 A)
 &rst
  ixpk= 802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 754, 755, 756, 758, 759, 760,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:803    115 LYS  HG-         2.80    (#    803:20  Single Ambig)
 &rst
  ixpk= 803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1676,1677,1217,1218,
 igr2=1673,1674,
 &end
#
#    0 AMB  20-2:804      0 AMB  20-1:804    3.50    (#    804:20  Double Ambig)
 &rst
  ixpk= 804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1676,1677,1217,1218,
 igr2=1673,1674,1673,1674,
 &end
#
#    0 AMB  20-2:805    109 LEU  MDX         3.50    (#    805:20  Single Ambig)
 &rst
  ixpk= 805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1585,1545,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  HG          109 LEU  MDX         3.50    (#    806:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 806, nxpk= 20, iat=1590,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  HB+         109 LEU  MDX         4.50    (#    807:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 807, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1587,1588,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  105 LEU  MDY         109 LEU  MDX         4.50    (#    808:20  Unique         2.03, 4.74 A)
 &rst
  ixpk= 808, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1533,1534,1535,1537,1538,1539,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:809    109 LEU  MDX         4.50    (#    809:20  Single Ambig)
 &rst
  ixpk= 809, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1050,1051,1052,1054,1055,1056,1587,1588,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#  146 LEU  HB-         146 LEU  MDY         7.00    (#    812:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 812, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2160,2161,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#  146 LEU  HG          146 LEU  MDY         3.50    (#    813:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 813, nxpk= 20, iat=2163,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#   77 LYS  HD-          77 LYS  HG+         4.50    (#    815:20  Unique         2.23, 2.66 A)
 &rst
  ixpk= 815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1119,1120,
 igr2=1116,1117,
 &end
#
#   77 LYS  HD-          77 LYS  HG-         4.50    (#    816:20  Unique         2.23, 2.66 A)
 &rst
  ixpk= 816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1119,1120,
 igr2=1116,1117,
 &end
#
#    0 AMB  20-2:817     73 LEU  MDX         5.50    (#    817:20  Single Ambig)
 &rst
  ixpk= 817, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=1526,1642,1643,1132,1133,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HA           73 LEU  MDX         4.50    (#    818:20  Unique         1.92, 3.76 A)
 &rst
  ixpk= 818, nxpk= 20, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:819     73 LEU  MDX         5.50    (#    819:20  Single Ambig)
 &rst
  ixpk= 819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1067,1068,1135,1136,1096,1097,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HB-          73 LEU  MDX         4.50    (#    820:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 820, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1045,1046,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:821     73 LEU  MDX         3.50    (#    821:20  Single Ambig)
 &rst
  ixpk= 821, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1592,1593,1594,1596,1597,1598, 588, 589, 590, 592,
       593, 594,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:822    146 LEU  MDY         7.00    (#    822:20  Single Ambig)
 &rst
  ixpk= 822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.28, r4=14.78,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#  143 VAL  HA          146 LEU  MDY         5.50    (#    824:20  Unique         1.97, 4.02 A)
 &rst
  ixpk= 824, nxpk= 20, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#   77 LYS  HB+          77 LYS  HG+         3.50    (#    825:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 825, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1113,1114,
 igr2=1116,1117,
 &end
#
#   77 LYS  HB+          77 LYS  HG-         4.50    (#    826:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1113,1114,
 igr2=1116,1117,
 &end
#
#   73 LEU  HB+          73 LEU  MDX         4.50    (#    827:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 827, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1045,1046,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HG           73 LEU  MDX         4.50    (#    828:20  Unique         2.34, 2.63 A)
 &rst
  ixpk= 828, nxpk= 20, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:829     73 LEU  MDX         3.50    (#    829:20  Single Ambig)
 &rst
  ixpk= 829, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1533,1534,1535,1537,1538,1539, 588, 589, 590, 592,
       593, 594,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  146 LEU  HB+         146 LEU  MDY         5.50    (#    833:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 833, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2160,2161,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#    4 ILE  MD1         146 LEU  MDY         7.00    (#    834:20  Unique         4.84, 6.90 A)
 &rst
  ixpk= 834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=  56,  57,  58,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#  105 LEU  HA          105 LEU  MDY         3.50    (#    836:20  Unique         1.96, 3.17 A)
 &rst
  ixpk= 836, nxpk= 20, iat=1526,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#   70 TYR  HA          105 LEU  MDY         7.00    (#    837:20  Unique         2.70, 4.69 A)
 &rst
  ixpk= 837, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#   70 TYR  HB-         105 LEU  MDY         7.00    (#    838:20  Unique         2.62, 5.15 A)
 &rst
  ixpk= 838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 999,1000,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#  105 LEU  HG          105 LEU  MDY         3.50    (#    839:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 839, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#  105 LEU  HB-         105 LEU  MDY         4.50    (#    840:20  Unique         2.23, 3.48 A)
 &rst
  ixpk= 840, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1528,1529,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#   90 ILE  MD1         105 LEU  MDY         5.50    (#    842:20  Unique         4.05, 6.82 A)
 &rst
  ixpk= 842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1313,1314,1315,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#   25 LYS  HA           25 LYS  HG+         5.50    (#    844:20  Unique         3.35, 3.57 A)
 &rst
  ixpk= 844, nxpk= 20, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 345, 346,
 &end
#
#   25 LYS  HB-          25 LYS  HG-         5.50    (#    845:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 342, 343,
 igr2= 345, 346,
 &end
#
#   45 PRO  HD+          44 LEU  MDX         7.00    (#    846:20  Unique         2.45, 4.38 A)
 &rst
  ixpk= 846, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 645, 646,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#  139 LEU  MDY          25 LYS  HG+         5.50    (#    848:20  Unique         3.50, 5.76 A)
 &rst
  ixpk= 848, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2055,2056,2057,2059,2060,2061,
 igr2= 345, 346,
 &end
#
#   25 LYS  HB+          25 LYS  HG-         5.50    (#    849:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 849, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 342, 343,
 igr2= 345, 346,
 &end
#
#   25 LYS  HD+          25 LYS  HG-         4.50    (#    850:20  Unique         2.41, 2.58 A)
 &rst
  ixpk= 850, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 348, 349,
 igr2= 345, 346,
 &end
#
#   45 PRO  HD-          44 LEU  MDX         5.50    (#    855:20  Unique         2.45, 4.38 A)
 &rst
  ixpk= 855, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 645, 646,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   34 GLU  HB+          44 LEU  MDX         4.50    (#    856:20  Unique         4.37, 5.97 A)
 &rst
  ixpk= 856, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 478, 479,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   44 LEU  HG           44 LEU  MDX         3.50    (#    857:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 857, nxpk= 20, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   44 LEU  HB-          44 LEU  MDX         4.50    (#    858:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 858, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 629, 630,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#    5 THR  MG2          44 LEU  MDX         4.50    (#    859:20  Unique         2.99, 6.00 A)
 &rst
  ixpk= 859, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=  68,  69,  70,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   36 LEU  MDX          44 LEU  MDX         5.50    (#    860:20  Unique         6.12, 8.22 A)
 &rst
  ixpk= 860, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   41 LEU  HA           41 LEU  MDY         3.50    (#    863:20  Unique         3.32, 4.06 A)
 &rst
  ixpk= 863, nxpk= 20, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:864     41 LEU  MDY         7.00    (#    864:20  Single Ambig)
 &rst
  ixpk= 864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 965, 966,1135,1136,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   41 LEU  HG           41 LEU  MDY         3.50    (#    865:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 865, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:866     41 LEU  MDY         3.50    (#    866:20  Single Ambig)
 &rst
  ixpk= 866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 583, 584,1048,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   12 LEU  HG           12 LEU  MDY         3.50    (#    869:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 869, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 166, 167, 168, 170, 171, 172,
 &end
#
#   41 LEU  HB+          41 LEU  MDY         4.50    (#    870:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 583, 584,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   73 LEU  MDX          41 LEU  MDY         4.50    (#    871:20  Unique         2.37, 5.52 A)
 &rst
  ixpk= 871, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:874      0 AMB  20-1:874    3.50    (#    874:20  Double Ambig)
 &rst
  ixpk= 874, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 965, 966,2053, 367,
 igr2= 166, 167, 168, 170, 171, 172, 369, 370, 371, 373,
       374, 375,
 &end
#
#   51 LEU  MDY          26 LEU  MDX         4.50    (#    875:20  Unique         1.99, 5.27 A)
 &rst
  ixpk= 875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:876     36 LEU  MDY         7.00    (#    876:20  Single Ambig)
 &rst
  ixpk= 876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 481, 482, 553, 554,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   34 GLU  HB+          36 LEU  MDY         4.50    (#    877:20  Unique         2.27, 4.34 A)
 &rst
  ixpk= 877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 478, 479,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   36 LEU  HB+          36 LEU  MDY         5.50    (#    878:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 878, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 507, 508,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   36 LEU  HG           36 LEU  MDY         3.50    (#    879:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 879, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   36 LEU  HB-          36 LEU  MDY         4.50    (#    880:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 507, 508,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#  139 LEU  MDY          26 LEU  MDX         3.50    (#    882:20  Unique         1.99, 4.17 A)
 &rst
  ixpk= 882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2055,2056,2057,2059,2060,2061,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#  120 THR  HB          120 THR  MG2         3.50    (#    883:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 883, nxpk= 20, iat=1745,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1747,1748,1749,
 &end
#
#    0 AMB  20-2:884      0 AMB  20-1:884    3.50    (#    884:20  Double Ambig)
 &rst
  ixpk= 884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1268,1269,1270,1310,1311, 774, 775, 256, 257, 258,
      
 igr2=1747,1748,1749, 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:885     26 LEU  MDX         5.50    (#    885:20  Single Ambig)
 &rst
  ixpk= 885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2053, 367, 342, 343,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:886      0 AMB  20-1:886    7.00    (#    886:20  Double Ambig)
 &rst
  ixpk= 886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.61, r4=14.11,
 igr1=1344,1345, 605, 606, 605, 606,
 igr2=1747,1748,1749, 569, 570, 571, 573, 574, 575,
 &end
#
#   18 VAL  HA           18 VAL  MGX         4.50    (#    887:20  Unique         2.30, 3.42 A)
 &rst
  ixpk= 887, nxpk= 20, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:888      0 AMB  20-1:888    3.50    (#    888:20  Double Ambig)
 &rst
  ixpk= 888, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 240,1730,1731,
 igr2= 242, 243, 244, 246, 247, 248,1747,1748,1749,
 &end
#
#   40 LEU  HB-          40 LEU  MDY         3.50    (#    890:20  Unique         2.33, 3.28 A)
 &rst
  ixpk= 890, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 564, 565,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#   33 THR  HB           33 THR  MG2         3.50    (#    891:20  Unique         2.25, 2.64 A)
 &rst
  ixpk= 891, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 466, 467, 468,
 &end
#
#    0 AMB  20-2:892     33 THR  MG2         3.50    (#    892:20  Single Ambig)
 &rst
  ixpk= 892, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 386, 387, 386, 387,
 igr2= 466, 467, 468,
 &end
#
#   26 LEU  HB+          33 THR  MG2         4.50    (#    893:20  Unique         2.10, 3.50 A)
 &rst
  ixpk= 893, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 364, 365,
 igr2= 466, 467, 468,
 &end
#
#    4 ILE  HB           33 THR  MG2         4.50    (#    894:20  Unique         2.02, 2.92 A)
 &rst
  ixpk= 894, nxpk= 20, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 466, 467, 468,
 &end
#
#    0 AMB  20-2:895     33 THR  MG2         2.80    (#    895:20  Single Ambig)
 &rst
  ixpk= 895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,  49,  50,  51,
 igr2= 466, 467, 468,
 &end
#
#  117 THR  HB          117 THR  MG2         3.50    (#    896:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 896, nxpk= 20, iat=1709,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1711,1712,1713,
 &end
#
#  146 LEU  MDX         117 THR  MG2         4.50    (#    897:20  Unique         4.20, 6.44 A)
 &rst
  ixpk= 897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=1711,1712,1713,
 &end
#
#    0 AMB  20-2:899      0 AMB  20-1:899    7.00    (#    899:20  Double Ambig)
 &rst
  ixpk= 899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1= 367, 965, 966,
 igr2= 466, 467, 468, 149, 150, 151,
 &end
#
#    0 AMB  20-2:900      0 AMB  20-1:900    4.50    (#    900:20  Double Ambig)
 &rst
  ixpk= 900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  83, 317, 318, 319, 164,
 igr2= 466, 467, 468, 149, 150, 151,
 &end
#
#   39 PRO  HB-          40 LEU  MDY         5.50    (#    902:20  Unique         4.50, 6.05 A)
 &rst
  ixpk= 902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 553, 554,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    0 AMB  20-2:903      0 AMB  20-1:903    3.50    (#    903:20  Double Ambig)
 &rst
  ixpk= 903, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1800, 567,
 igr2= 242, 243, 244, 246, 247, 248, 569, 570, 571, 573,
       574, 575,
 &end
#
#   40 LEU  HB+          40 LEU  MDY         4.50    (#    904:20  Unique         2.33, 3.28 A)
 &rst
  ixpk= 904, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 564, 565,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    0 AMB  20-2:905    117 THR  MG2         3.50    (#    905:20  Single Ambig)
 &rst
  ixpk= 905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1220,1221,1676,1677,2141,2142,1217,1218,
 igr2=1711,1712,1713,
 &end
#
#   86 GLY  HA-          51 LEU  MDY         5.50    (#    906:20  Unique         2.42, 5.45 A)
 &rst
  ixpk= 906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1259,1260,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#   51 LEU  HG           51 LEU  MDY         3.50    (#    907:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 907, nxpk= 20, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  20-2:908     51 LEU  MDY         4.50    (#    908:20  Single Ambig)
 &rst
  ixpk= 908, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1=  85,  86,  87,  89,  90,  91, 369, 370, 371, 373,
       374, 375,  49,  50,  51, 692, 693, 694,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  20-2:910      0 AMB  20-1:910    2.80    (#    910:20  Double Ambig)
 &rst
  ixpk= 910, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=2141,2142,1806,1807,1806,1807,
 igr2=2146,2147,2148,2150,2151,2152, 303, 304, 305, 307,
       308, 309,1764,1765,1766,1768,1769,1770,
 &end
#
#   51 LEU  HB+          51 LEU  MDY         5.50    (#    911:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 911, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 733, 734,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  20-2:913     56 THR  MG2         4.50    (#    913:20  Single Ambig)
 &rst
  ixpk= 913, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 855, 856, 136, 137,
 igr2= 811, 812, 813,
 &end
#
#    0 AMB  20-2:914    143 VAL  MGY         7.00    (#    914:20  Single Ambig)
 &rst
  ixpk= 914, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=2053,2050,2051,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  147 LYS  HD+         143 VAL  MGY         7.00    (#    915:20  Unique         2.00, 4.85 A)
 &rst
  ixpk= 915, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2185,2186,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  143 VAL  HA          143 VAL  MGY         4.50    (#    916:20  Unique         2.17, 3.12 A)
 &rst
  ixpk= 916, nxpk= 20, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  143 VAL  HB          143 VAL  MGY         3.50    (#    917:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 917, nxpk= 20, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#   29 ALA  MB          143 VAL  MGY         4.50    (#    918:20  Unique         1.99, 4.08 A)
 &rst
  ixpk= 918, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 413, 414, 415,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#   26 LEU  MDX         143 VAL  MGY         3.50    (#    919:20  Unique         4.17, 7.51 A)
 &rst
  ixpk= 919, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 369, 370, 371, 373, 374, 375,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#    0 AMB  20-2:920      0 AMB  20-1:920    3.50    (#    920:20  Double Ambig)
 &rst
  ixpk= 920, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1800, 733, 734,
 igr2= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,
 &end
#
#    0 AMB  20-2:921     87 ALA  MB          3.50    (#    921:20  Single Ambig)
 &rst
  ixpk= 921, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1310,1311,1747,1748,1749,
 igr2=1268,1269,1270,
 &end
#
#    0 AMB  20-2:923     56 THR  MG2         4.50    (#    923:20  Single Ambig)
 &rst
  ixpk= 923, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 855, 856, 136, 137,
 igr2= 811, 812, 813,
 &end
#
#    0 AMB  20-2:924     56 THR  MG2         4.50    (#    924:20  Single Ambig)
 &rst
  ixpk= 924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1310,1311,1268,1269,1270,
 igr2= 811, 812, 813,
 &end
#
#    0 AMB  20-2:925    143 VAL  MGX         5.50    (#    925:20  Single Ambig)
 &rst
  ixpk= 925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2053,2050,2051,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#    0 AMB  20-2:926    143 VAL  MGY         7.00    (#    926:20  Single Ambig)
 &rst
  ixpk= 926, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=2076,2077,2076,2077,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  146 LEU  MDY         143 VAL  MGY         5.50    (#    927:20  Unique         3.10, 6.02 A)
 &rst
  ixpk= 927, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#    0 AMB  20-2:928      0 AMB  20-1:928    3.50    (#    928:20  Double Ambig)
 &rst
  ixpk= 928, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 296,2048,1132,1133,
 igr2= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  20-2:929      0 AMB  20-1:929    7.00    (#    929:20  Double Ambig)
 &rst
  ixpk= 929, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.34, r4=13.84,
 igr1=2026,2027, 787, 788,
 igr2=1764,1765,1766,1768,1769,1770, 754, 755, 756, 758,
       759, 760,
 &end
#
#    0 AMB  20-2:930      0 AMB  20-1:930    4.50    (#    930:20  Double Ambig)
 &rst
  ixpk= 930, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 301, 602, 603,
 igr2= 303, 304, 305, 307, 308, 309,  68,  69,  70,
 &end
#
#    0 AMB  20-2:931      0 AMB  20-1:931    3.50    (#    931:20  Double Ambig)
 &rst
  ixpk= 931, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 774, 775,  99, 662, 663, 664,
 igr2= 303, 304, 305, 307, 308, 309, 754, 755, 756, 758,
       759, 760,1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  20-2:933      0 AMB  20-1:933    3.50    (#    933:20  Double Ambig)
 &rst
  ixpk= 933, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1280,1281,1282,1762,
 igr2=1764,1765,1766,1768,1769,1770, 303, 304, 305, 307,
       308, 309,
 &end
#
#    0 AMB  20-2:934    121 LEU  MDX         7.00    (#    934:20  Single Ambig)
 &rst
  ixpk= 934, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=1759,1760,1284,1285,
 igr2=1764,1765,1766,1768,1769,1770,
 &end
#
#  143 VAL  HA          143 VAL  MGX         4.50    (#    938:20  Unique         2.17, 3.12 A)
 &rst
  ixpk= 938, nxpk= 20, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  143 VAL  HB          143 VAL  MGX         3.50    (#    939:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 939, nxpk= 20, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#   29 ALA  MB          143 VAL  MGX         5.50    (#    940:20  Unique         1.99, 4.08 A)
 &rst
  ixpk= 940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 413, 414, 415,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#   26 LEU  MDX         143 VAL  MGX         5.50    (#    941:20  Unique         4.17, 7.51 A)
 &rst
  ixpk= 941, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 369, 370, 371, 373, 374, 375,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  146 LEU  MDY         143 VAL  MGX         5.50    (#    942:20  Unique         3.10, 6.02 A)
 &rst
  ixpk= 942, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#   20 GLU  HG+          35 THR  MG2         7.00    (#    944:20  Unique         3.24, 5.38 A)
 &rst
  ixpk= 944, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 269, 270,
 igr2= 495, 496, 497,
 &end
#
#    0 AMB  20-2:948      0 AMB  20-1:948    4.50    (#    948:20  Double Ambig)
 &rst
  ixpk= 948, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1135,1136, 367,
 igr2=1166,1167,1168,1170,1171,1172, 303, 304, 305, 307,
       308, 309,
 &end
#
#    0 AMB  20-2:949      0 AMB  20-1:949    3.50    (#    949:20  Double Ambig)
 &rst
  ixpk= 949, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 774, 775,  99,1161,1162,
 igr2= 303, 304, 305, 307, 308, 309, 754, 755, 756, 758,
       759, 760,1166,1167,1168,1170,1171,1172,
 &end
#
#   78 PRO  HB-          80 LEU  MDX         5.50    (#    950:20  Unique         2.61, 4.52 A)
 &rst
  ixpk= 950, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1138,1139,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#   35 THR  HB           35 THR  MG2         4.50    (#    951:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 951, nxpk= 20, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 495, 496, 497,
 &end
#
#    6 LEU  HB+          35 THR  MG2         5.50    (#    952:20  Unique         3.15, 4.63 A)
 &rst
  ixpk= 952, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  80,  81,
 igr2= 495, 496, 497,
 &end
#
#    0 AMB  20-2:953     35 THR  MG2         3.50    (#    953:20  Single Ambig)
 &rst
  ixpk= 953, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 256, 257, 258,  80,  81,
 igr2= 495, 496, 497,
 &end
#
#    5 THR  HB            5 THR  MG2         3.50    (#    954:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 954, nxpk= 20, iat=  66,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  68,  69,  70,
 &end
#
#   53 ILE  MG2          22 LEU  MDX         3.50    (#    955:20  Unique         2.30, 5.04 A)
 &rst
  ixpk= 955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 770, 771, 772,
 igr2= 303, 304, 305, 307, 308, 309,
 &end
#
#    0 AMB  20-2:956      0 AMB  20-1:956    3.50    (#    956:20  Double Ambig)
 &rst
  ixpk= 956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1592,1593,1594,1596,1597,1598, 634, 635, 636, 638,
       639, 640, 101, 102, 103,
 igr2= 754, 755, 756, 758, 759, 760,  68,  69,  70,
 &end
#
#   78 PRO  HG+          80 LEU  MDX         5.50    (#    957:20  Unique         1.98, 3.83 A)
 &rst
  ixpk= 957, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1135,1136,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  20-2:958     80 LEU  MDX         3.50    (#    958:20  Single Ambig)
 &rst
  ixpk= 958, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 662, 663, 664,1164,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#   80 LEU  HB+          80 LEU  MDX         4.50    (#    959:20  Unique         2.11, 3.47 A)
 &rst
  ixpk= 959, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1161,1162,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#  114 ALA  MB           80 LEU  MDX         4.50    (#    960:20  Unique         4.21, 5.64 A)
 &rst
  ixpk= 960, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1660,1661,1662,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#   83 VAL  MGX          80 LEU  MDX         4.50    (#    961:20  Unique         2.00, 5.60 A)
 &rst
  ixpk= 961, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1203,1204,1205,1207,1208,1209,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#   52 VAL  HB           52 VAL  MGY         3.50    (#    963:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 963, nxpk= 20, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#    0 AMB  20-2:964     52 VAL  MGX         5.50    (#    964:20  Single Ambig)
 &rst
  ixpk= 964, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 787, 788,1241,1242,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   52 VAL  HB           52 VAL  MGX         3.50    (#    965:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 965, nxpk= 20, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#    7 ILE  HB           52 VAL  MGX         4.50    (#    966:20  Unique         1.99, 4.25 A)
 &rst
  ixpk= 966, nxpk= 20, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   18 VAL  HB           18 VAL  MGY         3.50    (#    969:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 969, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:970     18 VAL  MGY         4.50    (#    970:20  Single Ambig)
 &rst
  ixpk= 970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 774, 775, 256, 257, 258,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#  123 ILE  MG2          18 VAL  MGY         2.80    (#    971:20  Unique         2.69, 5.08 A)
 &rst
  ixpk= 971, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1802,1803,1804,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:972      0 AMB  20-1:972    4.50    (#    972:20  Double Ambig)
 &rst
  ixpk= 972, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2158, 645, 646,
 igr2=2165,2166,2167,2169,2170,2171,1203,1204,1205,1207,
      1208,1209,
 &end
#
#  146 LEU  HB+         146 LEU  MDX         4.50    (#    973:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2160,2161,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#   80 LEU  MDY          83 VAL  MGX         3.50    (#    974:20  Unique         2.00, 5.60 A)
 &rst
  ixpk= 974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1166,1167,1168,1170,1171,1172,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   18 VAL  HA           18 VAL  MGY         4.50    (#    976:20  Unique         2.30, 3.42 A)
 &rst
  ixpk= 976, nxpk= 20, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   83 VAL  HB           83 VAL  MGX         3.50    (#    977:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 977, nxpk= 20, iat=1201,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:978      0 AMB  20-1:978    3.50    (#    978:20  Double Ambig)
 &rst
  ixpk= 978, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1166,1167,1168,1170,1171,1172, 699, 700, 701,
 igr2=1203,1204,1205,1207,1208,1209,2165,2166,2167,2169,
      2170,2171,
 &end
#
#    0 AMB  20-2:980     83 VAL  MGX         5.50    (#    980:20  Single Ambig)
 &rst
  ixpk= 980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1164, 662, 663, 664,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#  146 LEU  HB-         146 LEU  MDX         4.50    (#    981:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2160,2161,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#    0 AMB  20-2:985     72 ALA  MB          4.50    (#    985:20  Single Ambig)
 &rst
  ixpk= 985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1081,1082,1081,1082, 968, 969,1020,1021,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  20-2:986     72 ALA  MB          4.50    (#    986:20  Single Ambig)
 &rst
  ixpk= 986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 583, 584,1045,1046,
 igr2=1035,1036,1037,
 &end
#
#   41 LEU  MDX          72 ALA  MB          3.50    (#    987:20  Unique         2.00, 4.09 A)
 &rst
  ixpk= 987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2=1035,1036,1037,
 &end
#
#   69 PHE  HB+          72 ALA  MB          7.00    (#    988:20  Unique         5.78, 6.78 A)
 &rst
  ixpk= 988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 979, 980,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  20-2:989      2 ALA  MB          5.50    (#    989:20  Single Ambig)
 &rst
  ixpk= 989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 317, 318, 319,  83,
 igr2=  25,  26,  27,
 &end
#
#    2 ALA  HA            2 ALA  MB          3.50    (#    990:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 990, nxpk= 20, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  25,  26,  27,
 &end
#
#   34 GLU  HB+           2 ALA  MB          3.50    (#    991:20  Unique         2.06, 3.85 A)
 &rst
  ixpk= 991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 478, 479,
 igr2=  25,  26,  27,
 &end
#
#   49 ILE  HB           49 ILE  MG2         4.50    (#    992:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 992, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 692, 693, 694,
 &end
#
#   49 ILE  HG1-         49 ILE  MG2         4.50    (#    993:20  Unique         2.40, 3.51 A)
 &rst
  ixpk= 993, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 696, 697,
 igr2= 692, 693, 694,
 &end
#
#   51 LEU  MDY          49 ILE  MG2         4.50    (#    994:20  Unique         2.00, 4.70 A)
 &rst
  ixpk= 994, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 692, 693, 694,
 &end
#
#  146 LEU  MDY          49 ILE  MG2         5.50    (#    995:20  Unique         3.77, 6.54 A)
 &rst
  ixpk= 995, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2= 692, 693, 694,
 &end
#
#   34 GLU  HG+           2 ALA  MB          4.50    (#    998:20  Unique         2.60, 4.16 A)
 &rst
  ixpk= 998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 481, 482,
 igr2=  25,  26,  27,
 &end
#
#    0 AMB  20-2:999     49 ILE  MG2         5.50    (#    999:20  Single Ambig)
 &rst
  ixpk= 999, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2165,2166,2167,2169,2170,2171,1203,1204,1205,1207,
      1208,1209,
 igr2= 692, 693, 694,
 &end
#
#   83 VAL  MGY         114 ALA  MB          4.50    (#   1000:20  Unique         2.57, 5.01 A)
 &rst
  ixpk= 1000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1203,1204,1205,1207,1208,1209,
 igr2=1660,1661,1662,
 &end
#
#   80 LEU  MDX          83 VAL  MGY         7.00    (#   1001:20  Unique         2.00, 5.60 A)
 &rst
  ixpk= 1001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1=1166,1167,1168,1170,1171,1172,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1002   114 ALA  MB          4.50    (#   1002:20  Single Ambig)
 &rst
  ixpk= 1002, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1217,1218,1201,1670,1671,
 igr2=1660,1661,1662,
 &end
#
#   80 LEU  HB-         114 ALA  MB          3.50    (#   1003:20  Unique         1.97, 3.15 A)
 &rst
  ixpk= 1003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1161,1162,
 igr2=1660,1661,1662,
 &end
#
#    0 AMB  20-2:1004   114 ALA  MB          4.50    (#   1004:20  Single Ambig)
 &rst
  ixpk= 1004, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 igr2=1660,1661,1662,
 &end
#
#  109 LEU  HB-         114 ALA  MB          4.50    (#   1005:20  Unique         4.70, 6.31 A)
 &rst
  ixpk= 1005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1587,1588,
 igr2=1660,1661,1662,
 &end
#
#  114 ALA  MB           83 VAL  MGY         4.50    (#   1006:20  Unique         2.57, 5.01 A)
 &rst
  ixpk= 1006, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1660,1661,1662,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#  109 LEU  HA          114 ALA  MB          7.00    (#   1009:20  Unique         5.02, 6.15 A)
 &rst
  ixpk= 1009, nxpk= 20, iat=1585,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1660,1661,1662,
 &end
#
#   83 VAL  HB           83 VAL  MGY         4.50    (#   1010:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1010, nxpk= 20, iat=1201,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   26 LEU  MDX          29 ALA  MB          5.50    (#   1011:20  Unique         3.52, 5.74 A)
 &rst
  ixpk= 1011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 369, 370, 371, 373, 374, 375,
 igr2= 413, 414, 415,
 &end
#
#   90 ILE  HB           90 ILE  MG2         4.50    (#   1012:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1012, nxpk= 20, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1306,1307,1308,
 &end
#
#  143 VAL  MGY          29 ALA  MB          3.50    (#   1013:20  Unique         1.99, 4.08 A)
 &rst
  ixpk= 1013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2113,2114,2115,2117,2118,2119,
 igr2= 413, 414, 415,
 &end
#
#  122 LYS  HG+         130 ILE  MG2         5.50    (#   1016:20  Unique         3.11, 6.20 A)
 &rst
  ixpk= 1016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1781,1782,
 igr2=1914,1915,1916,
 &end
#
#    0 AMB  20-2:1017    90 ILE  MG2         4.50    (#   1017:20  Single Ambig)
 &rst
  ixpk= 1017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1310,1311,1268,1269,1270,
 igr2=1306,1307,1308,
 &end
#
#   90 ILE  MD1          90 ILE  MG2         3.50    (#   1018:20  Unique         2.05, 3.48 A)
 &rst
  ixpk= 1018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1313,1314,1315,
 igr2=1306,1307,1308,
 &end
#
#  104 LYS  HB+         107 ALA  MB          4.50    (#   1019:20  Unique         4.12, 5.36 A)
 &rst
  ixpk= 1019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1506,1507,
 igr2=1562,1563,1564,
 &end
#
#    0 AMB  20-2:1020    82 ALA  MB          3.50    (#   1020:20  Single Ambig)
 &rst
  ixpk= 1020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 672, 673, 672, 673,
 igr2=1191,1192,1193,
 &end
#
#    0 AMB  20-2:1022    19 ALA  MB          5.50    (#   1022:20  Single Ambig)
 &rst
  ixpk= 1022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 185, 186, 315, 296,
 igr2= 256, 257, 258,
 &end
#
#   22 LEU  MDX          19 ALA  MB          4.50    (#   1023:20  Unique         4.62, 7.32 A)
 &rst
  ixpk= 1023, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 303, 304, 305, 307, 308, 309,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:1024    19 ALA  MB          3.50    (#   1024:20  Single Ambig)
 &rst
  ixpk= 1024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 242, 243, 244, 246, 247, 248, 777, 778, 779,
 igr2= 256, 257, 258,
 &end
#
#   88 ILE  MD1          19 ALA  MB          5.50    (#   1025:20  Unique         6.95, 8.66 A)
 &rst
  ixpk= 1025, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1287,1288,1289,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:1026    59 ALA  MB          4.50    (#   1026:20  Single Ambig)
 &rst
  ixpk= 1026, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 798, 799, 845,
 igr2= 847, 848, 849,
 &end
#
#  130 ILE  HG1+        130 ILE  MG2         4.50    (#   1029:20  Unique         2.13, 3.38 A)
 &rst
  ixpk= 1029, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1918,1919,
 igr2=1914,1915,1916,
 &end
#
#    0 AMB  20-2:1030   107 ALA  MB          7.00    (#   1030:20  Single Ambig)
 &rst
  ixpk= 1030, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1547,1548,1550,1551,
 igr2=1562,1563,1564,
 &end
#
#    0 AMB  20-2:1031   107 ALA  MB          5.50    (#   1031:20  Single Ambig)
 &rst
  ixpk= 1031, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1572,1573,1606,1607,
 igr2=1562,1563,1564,
 &end
#
#   83 VAL  MGX          82 ALA  MB          5.50    (#   1032:20  Unique         4.34, 6.57 A)
 &rst
  ixpk= 1032, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1203,1204,1205,1207,1208,1209,
 igr2=1191,1192,1193,
 &end
#
#  131 PRO  HD-         130 ILE  MG2         5.50    (#   1034:20  Unique         1.90, 3.47 A)
 &rst
  ixpk= 1034, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1928,1929,
 igr2=1914,1915,1916,
 &end
#
#  130 ILE  HG1-        130 ILE  MG2         4.50    (#   1035:20  Unique         2.13, 3.38 A)
 &rst
  ixpk= 1035, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1918,1919,
 igr2=1914,1915,1916,
 &end
#
#   19 ALA  HA           19 ALA  MB          4.50    (#   1038:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1038, nxpk= 20, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:1039    19 ALA  MB          5.50    (#   1039:20  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 118, 119, 118, 119,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:1040    19 ALA  MB          4.50    (#   1040:20  Single Ambig)
 &rst
  ixpk= 1040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 242, 243, 244, 246, 247, 248,  85,  86,  87,  89,
        90,  91,
 igr2= 256, 257, 258,
 &end
#
#  130 ILE  HB          130 ILE  MG2         4.50    (#   1041:20  Unique         2.31, 2.63 A)
 &rst
  ixpk= 1041, nxpk= 20, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1914,1915,1916,
 &end
#
#  130 ILE  HG1+        130 ILE  MG2         4.50    (#   1042:20  Unique         2.13, 3.38 A)
 &rst
  ixpk= 1042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1918,1919,
 igr2=1914,1915,1916,
 &end
#
#   80 LEU  MDX          46 ALA  MB          3.50    (#   1044:20  Unique         2.09, 4.63 A)
 &rst
  ixpk= 1044, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1166,1167,1168,1170,1171,1172,
 igr2= 662, 663, 664,
 &end
#
#   23 ALA  HA           23 ALA  MB          3.50    (#   1046:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1046, nxpk= 20, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 317, 318, 319,
 &end
#
#   16 GLU  HB+          23 ALA  MB          7.00    (#   1047:20  Unique         7.18, 8.70 A)
 &rst
  ixpk= 1047, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 204, 205,
 igr2= 317, 318, 319,
 &end
#
#    0 AMB  20-2:1048    23 ALA  MB          4.50    (#   1048:20  Single Ambig)
 &rst
  ixpk= 1048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 298, 299, 466, 467, 468,
 igr2= 317, 318, 319,
 &end
#
#    0 AMB  20-2:1049    23 ALA  MB          3.50    (#   1049:20  Single Ambig)
 &rst
  ixpk= 1049, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 igr2= 317, 318, 319,
 &end
#
#   53 ILE  HB           53 ILE  MG2         4.50    (#   1050:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1050, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 770, 771, 772,
 &end
#
#   53 ILE  HG1+         53 ILE  MG2         3.50    (#   1051:20  Unique         2.12, 3.14 A)
 &rst
  ixpk= 1051, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 774, 775,
 igr2= 770, 771, 772,
 &end
#
#   18 VAL  MGX          53 ILE  MG2         4.50    (#   1052:20  Unique         2.06, 4.31 A)
 &rst
  ixpk= 1052, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 242, 243, 244, 246, 247, 248,
 igr2= 770, 771, 772,
 &end
#
#   88 ILE  MG2          53 ILE  MG2         5.50    (#   1053:20  Unique         2.00, 4.23 A)
 &rst
  ixpk= 1053, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1280,1281,1282,
 igr2= 770, 771, 772,
 &end
#
#    4 ILE  HG1+          4 ILE  MG2         4.50    (#   1054:20  Unique         2.49, 3.52 A)
 &rst
  ixpk= 1054, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  53,  54,
 igr2=  49,  50,  51,
 &end
#
#    0 AMB  20-2:1055     4 ILE  MG2         3.50    (#   1055:20  Single Ambig)
 &rst
  ixpk= 1055, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1=  56,  57,  58, 738, 739, 740, 742, 743, 744,
 igr2=  49,  50,  51,
 &end
#
#  123 ILE  HG1-        123 ILE  MG2         5.50    (#   1056:20  Unique         2.25, 3.12 A)
 &rst
  ixpk= 1056, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1806,1807,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:1059     7 ILE  MG2         5.50    (#   1059:20  Single Ambig)
 &rst
  ixpk= 1059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 787, 788, 709, 710,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:1060   123 ILE  MG2         7.00    (#   1060:20  Single Ambig)
 &rst
  ixpk= 1060, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1= 342, 343,2050,2051,2053, 367,
 igr2=1802,1803,1804,
 &end
#
#  123 ILE  HB          123 ILE  MG2         3.50    (#   1061:20  Unique         2.29, 2.63 A)
 &rst
  ixpk= 1061, nxpk= 20, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1802,1803,1804,
 &end
#
#    7 ILE  HB            7 ILE  MG2         3.50    (#   1062:20  Unique         2.35, 2.63 A)
 &rst
  ixpk= 1062, nxpk= 20, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:1063     7 ILE  MG2         4.50    (#   1063:20  Single Ambig)
 &rst
  ixpk= 1063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 105, 106, 754, 755, 756, 758, 759, 760,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:1064     7 ILE  MG2         4.50    (#   1064:20  Single Ambig)
 &rst
  ixpk= 1064, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 777, 778, 779, 774, 775,
 igr2= 101, 102, 103,
 &end
#
#   53 ILE  HG1+         88 ILE  MG2         3.50    (#   1070:20  Unique         2.58, 4.09 A)
 &rst
  ixpk= 1070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 774, 775,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:1071    88 ILE  MG2         4.50    (#   1071:20  Single Ambig)
 &rst
  ixpk= 1071, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1802,1803,1804,1759,1760,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:1072    88 ILE  MG2         3.50    (#   1072:20  Single Ambig)
 &rst
  ixpk= 1072, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 770, 771, 772,1284,1285,1809,1810,1811, 774, 775,
      
 igr2=1280,1281,1282,
 &end
#
#   88 ILE  MD1          88 ILE  MG2         3.50    (#   1073:20  Unique         2.10, 3.62 A)
 &rst
  ixpk= 1073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1287,1288,1289,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:1074    88 ILE  MG2         5.50    (#   1074:20  Single Ambig)
 &rst
  ixpk= 1074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1759,1760,1284,1285,
 igr2=1280,1281,1282,
 &end
#
#   19 ALA  HA           53 ILE  MD1         4.50    (#   1075:20  Unique         3.02, 4.38 A)
 &rst
  ixpk= 1075, nxpk= 20, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 777, 778, 779,
 &end
#
#   53 ILE  HB           53 ILE  MD1         4.50    (#   1076:20  Unique         2.08, 2.92 A)
 &rst
  ixpk= 1076, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 777, 778, 779,
 &end
#
#    0 AMB  20-2:1077    53 ILE  MD1         3.50    (#   1077:20  Single Ambig)
 &rst
  ixpk= 1077, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 774, 775,  80,  81,
 igr2= 777, 778, 779,
 &end
#
#    0 AMB  20-2:1078    53 ILE  MD1         5.50    (#   1078:20  Single Ambig)
 &rst
  ixpk= 1078, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 298, 299, 736,
 igr2= 777, 778, 779,
 &end
#
#    6 LEU  MDX          53 ILE  MD1         3.50    (#   1079:20  Unique         2.02, 4.64 A)
 &rst
  ixpk= 1079, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  85,  86,  87,  89,  90,  91,
 igr2= 777, 778, 779,
 &end
#
#   88 ILE  MD1          53 ILE  MD1         4.50    (#   1080:20  Unique         3.01, 4.60 A)
 &rst
  ixpk= 1080, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1287,1288,1289,
 igr2= 777, 778, 779,
 &end
#
#    0 AMB  20-2:1081     7 ILE  MD1         4.50    (#   1081:20  Single Ambig)
 &rst
  ixpk= 1081, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 754, 755, 756, 758, 759, 760,  68,  69,  70, 588,
       589, 590, 592, 593, 594,
 igr2= 108, 109, 110,
 &end
#
#   50 TRP  HB+           7 ILE  MD1         4.50    (#   1082:20  Unique         3.14, 4.98 A)
 &rst
  ixpk= 1082, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 709, 710,
 igr2= 108, 109, 110,
 &end
#
#    7 ILE  HB            7 ILE  MD1         4.50    (#   1083:20  Unique         2.37, 3.13 A)
 &rst
  ixpk= 1083, nxpk= 20, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 108, 109, 110,
 &end
#
#    0 AMB  20-2:1084     7 ILE  MD1         3.50    (#   1084:20  Single Ambig)
 &rst
  ixpk= 1084, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 105, 106, 754, 755, 756, 758, 759, 760,
 igr2= 108, 109, 110,
 &end
#
#   90 ILE  HB           90 ILE  MD1         5.50    (#   1087:20  Unique         2.47, 3.24 A)
 &rst
  ixpk= 1087, nxpk= 20, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1313,1314,1315,
 &end
#
#    0 AMB  20-2:1088    88 ILE  MD1         5.50    (#   1088:20  Single Ambig)
 &rst
  ixpk= 1088, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,
 igr2=1287,1288,1289,
 &end
#
#    0 AMB  20-2:1089    88 ILE  MD1         3.50    (#   1089:20  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 774, 775,1284,1285, 777, 778, 779,
 igr2=1287,1288,1289,
 &end
#
#   88 ILE  MG2          88 ILE  MD1         3.50    (#   1090:20  Unique         2.10, 3.62 A)
 &rst
  ixpk= 1090, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1280,1281,1282,
 igr2=1287,1288,1289,
 &end
#
#   88 ILE  HG1+         88 ILE  MD1         4.50    (#   1091:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1284,1285,
 igr2=1287,1288,1289,
 &end
#
#   49 ILE  HB           49 ILE  MD1         4.50    (#   1093:20  Unique         3.57, 3.92 A)
 &rst
  ixpk= 1093, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 699, 700, 701,
 &end
#
#   49 ILE  HG1-         49 ILE  MD1         3.50    (#   1094:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 696, 697,
 igr2= 699, 700, 701,
 &end
#
#    0 AMB  20-2:1095    49 ILE  MD1         4.50    (#   1095:20  Single Ambig)
 &rst
  ixpk= 1095, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2165,2166,2167,2169,2170,2171,1203,1204,1205,1207,
      1208,1209,
 igr2= 699, 700, 701,
 &end
#
#  146 LEU  MDY          49 ILE  MD1         4.50    (#   1096:20  Unique         3.18, 5.85 A)
 &rst
  ixpk= 1096, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2= 699, 700, 701,
 &end
#
#   18 VAL  HB          123 ILE  MD1         4.50    (#   1097:20  Unique         2.82, 4.37 A)
 &rst
  ixpk= 1097, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1809,1810,1811,
 &end
#
#   53 ILE  HG1+         88 ILE  MD1         4.50    (#   1098:20  Unique         2.05, 3.28 A)
 &rst
  ixpk= 1098, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 774, 775,
 igr2=1287,1288,1289,
 &end
#
#    0 AMB  20-2:1101    90 ILE  MD1         2.80    (#   1101:20  Single Ambig)
 &rst
  ixpk= 1101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1268,1269,1270,1310,1311,
 igr2=1313,1314,1315,
 &end
#
#    0 AMB  20-2:1102     0 AMB  20-1:1102   2.80    (#   1102:20  Double Ambig)
 &rst
  ixpk= 1102, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=1310,1311, 303, 304, 305, 307, 308, 309,
 igr2=1313,1314,1315,1809,1810,1811,
 &end
#
#    0 AMB  20-2:1103    88 ILE  MD1         5.50    (#   1103:20  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,
 igr2=1287,1288,1289,
 &end
#
#  123 ILE  HB          123 ILE  MD1         4.50    (#   1104:20  Unique         2.10, 3.00 A)
 &rst
  ixpk= 1104, nxpk= 20, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1809,1810,1811,
 &end
#
#   88 ILE  MG2         123 ILE  MD1         3.50    (#   1105:20  Unique         2.50, 4.81 A)
 &rst
  ixpk= 1105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1280,1281,1282,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:1106     4 ILE  MD1         4.50    (#   1106:20  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 696, 697,  47,
 igr2=  56,  57,  58,
 &end
#
#    0 AMB  20-2:1107     4 ILE  MD1         2.80    (#   1107:20  Single Ambig)
 &rst
  ixpk= 1107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=  49,  50,  51, 692, 693, 694,
 igr2=  56,  57,  58,
 &end
#
#  146 LEU  MDY           4 ILE  MD1         4.50    (#   1108:20  Unique         4.84, 6.90 A)
 &rst
  ixpk= 1108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=  56,  57,  58,
 &end
#
#    4 ILE  HG1+          4 ILE  MD1         4.50    (#   1109:20  Unique         2.35, 2.62 A)
 &rst
  ixpk= 1109, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  53,  54,
 igr2=  56,  57,  58,
 &end
#
#   31 PHE  HB+           4 ILE  MD1         7.00    (#   1110:20  Unique         3.11, 4.26 A)
 &rst
  ixpk= 1110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 430, 431,
 igr2=  56,  57,  58,
 &end
#
#  130 ILE  HB          130 ILE  MD1         4.50    (#   1111:20  Unique         2.18, 3.50 A)
 &rst
  ixpk= 1111, nxpk= 20, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1921,1922,1923,
 &end
#
#  130 ILE  HG1-        130 ILE  MD1         3.50    (#   1112:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1918,1919,
 igr2=1921,1922,1923,
 &end
#
#  130 ILE  HG1+        130 ILE  MD1         3.50    (#   1113:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1918,1919,
 igr2=1921,1922,1923,
 &end
#
#  117 THR  HA          117 THR  HB          5.50    (#   1115:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 1115, nxpk= 20, iat=1707,1709, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  117 THR  HN          117 THR  HB          4.50    (#   1116:20  Unique         2.39, 2.51 A)
 &rst
  ixpk= 1116, nxpk= 20, iat=1705,1709, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 ARG  HE          117 THR  HB          4.50    (#   1117:20  Unique         1.98, 2.51 A)
 &rst
  ixpk= 1117, nxpk= 20, iat=1226,1709, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  143 VAL  HN          143 VAL  HA          5.50    (#   1118:20  Unique         2.75, 2.78 A)
 &rst
  ixpk= 1118, nxpk= 20, iat=2107,2109, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1119   143 VAL  HA          5.50    (#   1119:20  Single Ambig)
 &rst
  ixpk= 1119, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2156,2102,
 &end
#
#   73 LEU  HN           73 LEU  HA          5.50    (#   1121:20  Unique         2.75, 2.75 A)
 &rst
  ixpk= 1121, nxpk= 20, iat=1041,1043, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  117 THR  HN          116 GLN  HA          3.50    (#   1122:20  Unique         2.14, 2.14 A)
 &rst
  ixpk= 1122, nxpk= 20, iat=1705,1690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1123   116 GLN  HA          4.50    (#   1123:20  Single Ambig)
 &rst
  ixpk= 1123, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1245,1253,1688,1237,
 &end
#
#   77 LYS  HN           78 PRO  HD-         5.50    (#   1124:20  Unique         2.65, 2.87 A)
 &rst
  ixpk= 1124, nxpk= 20, iat=1109,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1132,1133,
 &end
#
#    0 AMB  20-2:1125    68 PRO  HD-         4.50    (#   1125:20  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 954, 955, 954, 955,
 igr2= 962, 963,
 &end
#
#   67 SER  HN           68 PRO  HD-         5.50    (#   1126:20  Unique         1.73, 2.40 A)
 &rst
  ixpk= 1126, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 962, 963,
 &end
#
#   44 LEU  HA           45 PRO  HD-         3.50    (#   1127:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 1127, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 645, 646,
 &end
#
#    0 AMB  20-2:1131     0 AMB  20-1:1131   3.50    (#   1131:20  Double Ambig)
 &rst
  ixpk= 1131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1649, 419,
 igr2=1651,1652, 421, 422,
 &end
#
#   85 PHE  HA           85 PHE  HB+         4.50    (#   1133:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 1133, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1241,1242,
 &end
#
#   85 PHE  HA           85 PHE  HB-         5.50    (#   1137:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 1137, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1241,1242,
 &end
#
#  116 GLN  HE2+         86 GLY  HA-         7.00    (#   1140:20  Unique         4.05, 5.75 A)
 &rst
  ixpk= 1140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1700,1701,
 igr2=1259,1260,
 &end
#
#  146 LEU  HN          146 LEU  HB-         4.50    (#   1144:20  Unique         2.22, 2.93 A)
 &rst
  ixpk= 1144, nxpk= 20, iat=2156,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2160,2161,
 &end
#
#  139 LEU  HN          139 LEU  HB-         5.50    (#   1145:20  Unique         2.05, 2.70 A)
 &rst
  ixpk= 1145, nxpk= 20, iat=2046,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2050,2051,
 &end
#
#  146 LEU  HN          146 LEU  HB+         4.50    (#   1146:20  Unique         2.22, 2.93 A)
 &rst
  ixpk= 1146, nxpk= 20, iat=2156,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2160,2161,
 &end
#
#   32 THR  HN            3 ASP  HB+         5.50    (#   1149:20  Unique         2.75, 2.92 A)
 &rst
  ixpk= 1149, nxpk= 20, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  35,  36,
 &end
#
#   42 GLU  HN           41 LEU  HB+         5.50    (#   1152:20  Unique         3.59, 3.85 A)
 &rst
  ixpk= 1152, nxpk= 20, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 583, 584,
 &end
#
#  145 LEU  HN          145 LEU  HB-         5.50    (#   1153:20  Unique         2.04, 2.69 A)
 &rst
  ixpk= 1153, nxpk= 20, iat=2137,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2141,2142,
 &end
#
#   41 LEU  HN            0 AMB  20-1:1154   5.50    (#   1154:20  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 583, 584, 564, 565,
 &end
#
#  145 LEU  HA          145 LEU  HB+         4.50    (#   1155:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 1155, nxpk= 20, iat=2139,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2141,2142,
 &end
#
#    3 ASP  HA            3 ASP  HB+         4.50    (#   1156:20  Unique         2.69, 2.83 A)
 &rst
  ixpk= 1156, nxpk= 20, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  35,  36,
 &end
#
#    4 ILE  HN            3 ASP  HB+         5.50    (#   1157:20  Unique         3.20, 3.52 A)
 &rst
  ixpk= 1157, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  35,  36,
 &end
#
#    3 ASP  HA            3 ASP  HB-         4.50    (#   1158:20  Unique         2.69, 2.83 A)
 &rst
  ixpk= 1158, nxpk= 20, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  35,  36,
 &end
#
#    0 AMB  20-2:1160     0 AMB  20-1:1160   5.50    (#   1160:20  Double Ambig)
 &rst
  ixpk= 1160, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 579,  62,
 igr2= 583, 584, 629, 630,
 &end
#
#   44 LEU  HA           44 LEU  HB+         5.50    (#   1161:20  Unique         2.49, 2.76 A)
 &rst
  ixpk= 1161, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 629, 630,
 &end
#
#   44 LEU  HN           44 LEU  HB+         4.50    (#   1162:20  Unique         2.40, 3.04 A)
 &rst
  ixpk= 1162, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 629, 630,
 &end
#
#   12 LEU  HA           12 LEU  HB+         4.50    (#   1163:20  Unique         2.43, 2.82 A)
 &rst
  ixpk= 1163, nxpk= 20, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 161, 162,
 &end
#
#    0 AMB  20-2:1164    40 LEU  HB-         4.50    (#   1164:20  Single Ambig)
 &rst
  ixpk= 1164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 562, 615,
 igr2= 564, 565,
 &end
#
#    0 AMB  20-2:1165     0 AMB  20-1:1165   7.00    (#   1165:20  Double Ambig)
 &rst
  ixpk= 1165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 562, 615,
 igr2= 564, 565, 564, 565,
 &end
#
#   41 LEU  HN           41 LEU  HB-         5.50    (#   1166:20  Unique         3.15, 3.57 A)
 &rst
  ixpk= 1166, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 583, 584,
 &end
#
#    0 AMB  20-2:1167     0 AMB  20-1:1167   4.50    (#   1167:20  Double Ambig)
 &rst
  ixpk= 1167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 766,  78,
 igr2=1278,  80,  81,
 &end
#
#   44 LEU  HA           44 LEU  HB-         7.00    (#   1168:20  Unique         2.49, 2.76 A)
 &rst
  ixpk= 1168, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 629, 630,
 &end
#
#   43 ASP  HA           43 ASP  HB+         3.50    (#   1169:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 1169, nxpk= 20, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 617, 618,
 &end
#
#   40 LEU  HN           40 LEU  HB+         5.50    (#   1171:20  Unique         2.45, 3.08 A)
 &rst
  ixpk= 1171, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 564, 565,
 &end
#
#   43 ASP  HN           43 ASP  HB+         3.50    (#   1172:20  Unique         2.07, 2.68 A)
 &rst
  ixpk= 1172, nxpk= 20, iat= 613,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 617, 618,
 &end
#
#   52 VAL  HA            7 ILE  HB          5.50    (#   1175:20  Unique         2.11, 2.29 A)
 &rst
  ixpk= 1175, nxpk= 20, iat= 750,  99, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 ASP  HA           96 ASP  HB+         3.50    (#   1176:20  Unique         2.28, 2.68 A)
 &rst
  ixpk= 1176, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1401,1402,
 &end
#
#   31 PHE  HA           31 PHE  HB+         5.50    (#   1177:20  Unique         2.25, 2.50 A)
 &rst
  ixpk= 1177, nxpk= 20, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 430, 431,
 &end
#
#   64 ASP  HA           64 ASP  HB+         4.50    (#   1180:20  Unique         2.28, 2.59 A)
 &rst
  ixpk= 1180, nxpk= 20, iat= 907,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 909, 910,
 &end
#
#    0 AMB  20-2:1181   103 ASP  HB-         5.50    (#   1181:20  Single Ambig)
 &rst
  ixpk= 1181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1492,1339,
 igr2=1494,1495,
 &end
#
#   80 LEU  HA           80 LEU  HB+         5.50    (#   1182:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 1182, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1161,1162,
 &end
#
#  103 ASP  HA          103 ASP  HB+         4.50    (#   1183:20  Unique         2.33, 2.46 A)
 &rst
  ixpk= 1183, nxpk= 20, iat=1492,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1494,1495,
 &end
#
#   70 TYR  HD           70 TYR  HB-         5.50    (#   1184:20  Unique         2.34, 3.05 A)
 &rst
  ixpk= 1184, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1003,1012,
 igr2= 999,1000,
 &end
#
#   70 TYR  HN           70 TYR  HB-         5.50    (#   1185:20  Unique         2.07, 2.64 A)
 &rst
  ixpk= 1185, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 999,1000,
 &end
#
#   79 ASP  HN           79 ASP  HB+         3.50    (#   1186:20  Unique         2.64, 2.76 A)
 &rst
  ixpk= 1186, nxpk= 20, iat=1145,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1149,1150,
 &end
#
#   79 ASP  HN           79 ASP  HB-         4.50    (#   1187:20  Unique         2.64, 2.76 A)
 &rst
  ixpk= 1187, nxpk= 20, iat=1145,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1149,1150,
 &end
#
#   79 ASP  HA           79 ASP  HB-         4.50    (#   1188:20  Unique         2.55, 2.79 A)
 &rst
  ixpk= 1188, nxpk= 20, iat=1147,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1149,1150,
 &end
#
#   70 TYR  HD           70 TYR  HB+         4.50    (#   1189:20  Unique         2.34, 3.05 A)
 &rst
  ixpk= 1189, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1003,1012,
 igr2= 999,1000,
 &end
#
#   79 ASP  HA           79 ASP  HB+         4.50    (#   1190:20  Unique         2.55, 2.79 A)
 &rst
  ixpk= 1190, nxpk= 20, iat=1147,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1149,1150,
 &end
#
#   79 ASP  HN           79 ASP  HB-         4.50    (#   1191:20  Unique         2.64, 2.76 A)
 &rst
  ixpk= 1191, nxpk= 20, iat=1145,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1149,1150,
 &end
#
#   49 ILE  HN           49 ILE  HB          5.50    (#   1193:20  Unique         2.87, 2.96 A)
 &rst
  ixpk= 1193, nxpk= 20, iat= 686, 690, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 TYR  HN           70 TYR  HB+         4.50    (#   1194:20  Unique         2.07, 2.64 A)
 &rst
  ixpk= 1194, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 999,1000,
 &end
#
#    4 ILE  HA           49 ILE  HB          5.50    (#   1196:20  Unique         3.27, 3.34 A)
 &rst
  ixpk= 1196, nxpk= 20, iat=  45, 690, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 PHE  HA           69 PHE  HB+         5.50    (#   1197:20  Unique         2.71, 2.84 A)
 &rst
  ixpk= 1197, nxpk= 20, iat= 977,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#   69 PHE  HN           69 PHE  HB-         5.50    (#   1198:20  Unique         2.10, 2.60 A)
 &rst
  ixpk= 1198, nxpk= 20, iat= 975,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#   70 TYR  HN           69 PHE  HB-         5.50    (#   1199:20  Unique         2.06, 2.61 A)
 &rst
  ixpk= 1199, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#    0 AMB  20-2:1201     0 AMB  20-1:1201   3.50    (#   1201:20  Double Ambig)
 &rst
  ixpk= 1201, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=2132,2133,2132,2133,2137,
 igr2=2127,2128,2127,2128,
 &end
#
#  144 ASN  HN            0 AMB  20-1:1202   3.50    (#   1202:20  Single Ambig)
 &rst
  ixpk= 1202, nxpk= 20, iat=2123,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2127,2128,2127,2128,
 &end
#
#  144 ASN  HA            0 AMB  20-1:1203   3.50    (#   1203:20  Single Ambig)
 &rst
  ixpk= 1203, nxpk= 20, iat=2125,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2127,2128,2127,2128,
 &end
#
#  141 SER  HA            0 AMB  20-1:1204   4.50    (#   1204:20  Single Ambig)
 &rst
  ixpk= 1204, nxpk= 20, iat=2074,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2127,2128,2127,2128,
 &end
#
#  111 ASN  HN          111 ASN  HB-         4.50    (#   1205:20  Unique         2.09, 2.62 A)
 &rst
  ixpk= 1205, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1628,1629,
 &end
#
#    0 AMB  20-2:1206     0 AMB  20-1:1206   3.50    (#   1206:20  Double Ambig)
 &rst
  ixpk= 1206, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1626, 217,
 igr2=1628,1629, 219, 220,
 &end
#
#  111 ASN  HN          111 ASN  HB+         4.50    (#   1207:20  Unique         2.09, 2.62 A)
 &rst
  ixpk= 1207, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1628,1629,
 &end
#
#    0 AMB  20-2:1208     0 AMB  20-1:1208   4.50    (#   1208:20  Double Ambig)
 &rst
  ixpk= 1208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 236,1633,1634,
 igr2= 219, 220,1628,1629,
 &end
#
#  108 GLU  HA          111 ASN  HB+         4.50    (#   1209:20  Unique         2.12, 3.07 A)
 &rst
  ixpk= 1209, nxpk= 20, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1628,1629,
 &end
#
#    0 AMB  20-2:1210     0 AMB  20-1:1210   4.50    (#   1210:20  Double Ambig)
 &rst
  ixpk= 1210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 236,1633,1634,
 igr2= 219, 220,1628,1629,
 &end
#
#  112 SER  HN          111 ASN  HB-         5.50    (#   1211:20  Unique         3.31, 3.86 A)
 &rst
  ixpk= 1211, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1628,1629,
 &end
#
#  108 GLU  HA          111 ASN  HB-         4.50    (#   1212:20  Unique         2.12, 3.07 A)
 &rst
  ixpk= 1212, nxpk= 20, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1628,1629,
 &end
#
#    0 AMB  20-2:1213     0 AMB  20-1:1213   3.50    (#   1213:20  Double Ambig)
 &rst
  ixpk= 1213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1626, 217,
 igr2=1628,1629, 219, 220,
 &end
#
#   20 GLU  HN           20 GLU  HG+         4.50    (#   1215:20  Unique         3.84, 4.17 A)
 &rst
  ixpk= 1215, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 269, 270,
 &end
#
#   71 GLU  HN           71 GLU  HG+         4.50    (#   1216:20  Unique         2.95, 3.12 A)
 &rst
  ixpk= 1216, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1023,1024,
 &end
#
#   65 ASN  HA           65 ASN  HB-         4.50    (#   1217:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 1217, nxpk= 20, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 921, 922,
 &end
#
#   65 ASN  HA           65 ASN  HB+         4.50    (#   1219:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 1219, nxpk= 20, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 921, 922,
 &end
#
#   27 GLU  HA           27 GLU  HG-         4.50    (#   1220:20  Unique         2.13, 2.69 A)
 &rst
  ixpk= 1220, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 386, 387,
 &end
#
#   27 GLU  HN            0 AMB  20-1:1221   4.50    (#   1221:20  Single Ambig)
 &rst
  ixpk= 1221, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 386, 387, 386, 387,
 &end
#
#   27 GLU  HN           27 GLU  HG+         4.50    (#   1222:20  Unique         2.99, 3.28 A)
 &rst
  ixpk= 1222, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 386, 387,
 &end
#
#   27 GLU  HA           27 GLU  HG+         4.50    (#   1223:20  Unique         2.13, 2.69 A)
 &rst
  ixpk= 1223, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 386, 387,
 &end
#
#   28 GLU  HN           28 GLU  HG+         4.50    (#   1225:20  Unique         2.27, 3.31 A)
 &rst
  ixpk= 1225, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 401, 402,
 &end
#
#  108 GLU  HN          108 GLU  HG+         4.50    (#   1226:20  Unique         2.56, 3.30 A)
 &rst
  ixpk= 1226, nxpk= 20, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1575,1576,
 &end
#
#   74 GLN  HE2+        108 GLU  HG+         4.50    (#   1227:20  Unique         1.92, 3.02 A)
 &rst
  ixpk= 1227, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1072,1073,
 igr2=1575,1576,
 &end
#
#  119 GLU  HA          119 GLU  HG+         3.50    (#   1228:20  Unique         3.50, 3.88 A)
 &rst
  ixpk= 1228, nxpk= 20, iat=1728,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1733,1734,
 &end
#
#   74 GLN  HE2+        108 GLU  HG-         5.50    (#   1229:20  Unique         1.92, 3.02 A)
 &rst
  ixpk= 1229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1072,1073,
 igr2=1575,1576,
 &end
#
#  108 GLU  HA          108 GLU  HG+         7.00    (#   1231:20  Unique         3.00, 3.34 A)
 &rst
  ixpk= 1231, nxpk= 20, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1575,1576,
 &end
#
#  119 GLU  HN          119 GLU  HG+         4.50    (#   1232:20  Unique         2.08, 3.06 A)
 &rst
  ixpk= 1232, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1733,1734,
 &end
#
#    0 AMB  20-2:1233     0 AMB  20-1:1233   4.50    (#   1233:20  Double Ambig)
 &rst
  ixpk= 1233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 598,1016,
 igr2= 605, 606, 605, 606,1023,1024,
 &end
#
#   42 GLU  HN            0 AMB  20-1:1234   4.50    (#   1234:20  Single Ambig)
 &rst
  ixpk= 1234, nxpk= 20, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 605, 606, 605, 606,
 &end
#
#    0 AMB  20-2:1235     0 AMB  20-1:1235   4.50    (#   1235:20  Double Ambig)
 &rst
  ixpk= 1235, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1504,1560,
 igr2=1575,1576,1575,1576,
 &end
#
#   75 GLU  HN           75 GLU  HG-         5.50    (#   1236:20  Unique         4.40, 4.47 A)
 &rst
  ixpk= 1236, nxpk= 20, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1084,1085,
 &end
#
#    0 AMB  20-2:1237     0 AMB  20-1:1237   3.50    (#   1237:20  Double Ambig)
 &rst
  ixpk= 1237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1079, 600,
 igr2=1084,1085, 605, 606,
 &end
#
#    0 AMB  20-2:1238     0 AMB  20-1:1238   5.50    (#   1238:20  Double Ambig)
 &rst
  ixpk= 1238, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1077, 560,
 igr2=1084,1085, 605, 606,
 &end
#
#   34 GLU  HA           34 GLU  HG-         4.50    (#   1239:20  Unique         2.06, 2.59 A)
 &rst
  ixpk= 1239, nxpk= 20, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 481, 482,
 &end
#
#   34 GLU  HA           34 GLU  HG+         4.50    (#   1240:20  Unique         2.06, 2.59 A)
 &rst
  ixpk= 1240, nxpk= 20, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 481, 482,
 &end
#
#   76 GLN  HE2-         76 GLN  HG+         4.50    (#   1242:20  Unique         2.42, 3.08 A)
 &rst
  ixpk= 1242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1104,1105,
 igr2=1099,1100,
 &end
#
#   76 GLN  HN           76 GLN  HG+         4.50    (#   1243:20  Unique         1.82, 2.64 A)
 &rst
  ixpk= 1243, nxpk= 20, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1099,1100,
 &end
#
#   76 GLN  HA           76 GLN  HG+         3.50    (#   1244:20  Unique         3.55, 3.84 A)
 &rst
  ixpk= 1244, nxpk= 20, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:1245    76 GLN  HG-         4.50    (#   1245:20  Single Ambig)
 &rst
  ixpk= 1245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1094,1111,
 igr2=1099,1100,
 &end
#
#   76 GLN  HE2-         76 GLN  HG-         4.50    (#   1246:20  Unique         2.42, 3.08 A)
 &rst
  ixpk= 1246, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1104,1105,
 igr2=1099,1100,
 &end
#
#   76 GLN  HN           76 GLN  HG-         4.50    (#   1247:20  Unique         1.82, 2.64 A)
 &rst
  ixpk= 1247, nxpk= 20, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1099,1100,
 &end
#
#   74 GLN  HN           74 GLN  HG-         4.50    (#   1248:20  Unique         2.19, 2.34 A)
 &rst
  ixpk= 1248, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1067,1068,
 &end
#
#    0 AMB  20-2:1249     0 AMB  20-1:1249   4.50    (#   1249:20  Double Ambig)
 &rst
  ixpk= 1249, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1213,1666,
 igr2=1217,1218,1670,1671,1217,1218,
 &end
#
#  115 LYS  HA          115 LYS  HB+         3.50    (#   1250:20  Unique         2.36, 2.45 A)
 &rst
  ixpk= 1250, nxpk= 20, iat=1668,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1670,1671,
 &end
#
#  147 LYS  HN          147 LYS  HB+         4.50    (#   1251:20  Unique         2.07, 2.71 A)
 &rst
  ixpk= 1251, nxpk= 20, iat=2175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2179,2180,
 &end
#
#   84 ARG  HA           84 ARG  HB+         5.50    (#   1252:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 1252, nxpk= 20, iat=1215,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1217,1218,
 &end
#
#   34 GLU  HA           34 GLU  HB-         4.50    (#   1253:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 1253, nxpk= 20, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#   34 GLU  HA           34 GLU  HB+         4.50    (#   1254:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 1254, nxpk= 20, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#    0 AMB  20-2:1255     0 AMB  20-1:1255   4.50    (#   1255:20  Double Ambig)
 &rst
  ixpk= 1255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1239, 713,
 igr2= 709, 710, 709, 710,
 &end
#
#    0 AMB  20-2:1256    50 TRP  HB-         4.50    (#   1256:20  Single Ambig)
 &rst
  ixpk= 1256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1239, 713,
 igr2= 709, 710,
 &end
#
#   52 VAL  HN           52 VAL  HB          4.50    (#   1257:20  Unique         3.07, 3.19 A)
 &rst
  ixpk= 1257, nxpk= 20, iat= 748, 752, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1258     0 AMB  20-1:1258   5.50    (#   1258:20  Double Ambig)
 &rst
  ixpk= 1258, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1937,1504,
 igr2=1934,1935,1506,1507,
 &end
#
#   78 PRO  HA           78 PRO  HB-         4.50    (#   1259:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1259, nxpk= 20, iat=1141,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1138,1139,
 &end
#
#    0 AMB  20-2:1260     0 AMB  20-1:1260   4.50    (#   1260:20  Double Ambig)
 &rst
  ixpk= 1260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1141, 556,
 igr2=1138,1139, 553, 554,
 &end
#
#  119 GLU  HA          119 GLU  HB+         4.50    (#   1261:20  Unique         2.27, 2.48 A)
 &rst
  ixpk= 1261, nxpk= 20, iat=1728,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1730,1731,
 &end
#
#  110 LYS  HA            0 AMB  20-1:1262   5.50    (#   1262:20  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 20, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1606,1607,1606,1607,
 &end
#
#  110 LYS  HN            0 AMB  20-1:1263   4.50    (#   1263:20  Single Ambig)
 &rst
  ixpk= 1263, nxpk= 20, iat=1602,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1606,1607,1606,1607,
 &end
#
#  110 LYS  HA            0 AMB  20-1:1264   5.50    (#   1264:20  Single Ambig)
 &rst
  ixpk= 1264, nxpk= 20, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1606,1607,1606,1607,
 &end
#
#   39 PRO  HA           39 PRO  HB+         4.50    (#   1266:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1266, nxpk= 20, iat= 556,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 553, 554,
 &end
#
#    0 AMB  20-2:1267     0 AMB  20-1:1267   5.50    (#   1267:20  Double Ambig)
 &rst
  ixpk= 1267, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1721,1722,1111,1651,1652,2024,
 igr2=1730,1731,1138,1139,1138,1139,1730,1731,
 &end
#
#    0 AMB  20-2:1268     0 AMB  20-1:1268   4.50    (#   1268:20  Double Ambig)
 &rst
  ixpk= 1268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1728,1668,
 igr2=1730,1731,1606,1607,
 &end
#
#  119 GLU  HN          119 GLU  HB-         4.50    (#   1269:20  Unique         3.51, 3.69 A)
 &rst
  ixpk= 1269, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1730,1731,
 &end
#
#   39 PRO  HA           39 PRO  HB+         4.50    (#   1270:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1270, nxpk= 20, iat= 556,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 553, 554,
 &end
#
#    0 AMB  20-2:1271     0 AMB  20-1:1271   3.50    (#   1271:20  Double Ambig)
 &rst
  ixpk= 1271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 679,1524,1197,
 igr2=1201,1506,1507,
 &end
#
#   45 PRO  HA           45 PRO  HB+         4.50    (#   1273:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1273, nxpk= 20, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 651, 652,
 &end
#
#   45 PRO  HA           45 PRO  HB-         4.50    (#   1274:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1274, nxpk= 20, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 651, 652,
 &end
#
#  143 VAL  HN          143 VAL  HB          4.50    (#   1276:20  Unique         2.30, 2.36 A)
 &rst
  ixpk= 1276, nxpk= 20, iat=2107,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  142 TRP  HE3         143 VAL  HB          5.50    (#   1277:20  Unique         3.92, 4.23 A)
 &rst
  ixpk= 1277, nxpk= 20, iat=2102,2111, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 ALA  HA           75 GLU  HB-         4.50    (#   1278:20  Unique         1.95, 2.36 A)
 &rst
  ixpk= 1278, nxpk= 20, iat=1033,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1081,1082,
 &end
#
#    6 LEU  HA            6 LEU  HG          4.50    (#   1280:20  Unique         3.65, 3.66 A)
 &rst
  ixpk= 1280, nxpk= 20, iat=  78,  83, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 GLN  HN           75 GLU  HB-         4.50    (#   1281:20  Unique         2.45, 3.15 A)
 &rst
  ixpk= 1281, nxpk= 20, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1081,1082,
 &end
#
#   75 GLU  HN           75 GLU  HB-         4.50    (#   1282:20  Unique         2.43, 2.59 A)
 &rst
  ixpk= 1282, nxpk= 20, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1081,1082,
 &end
#
#   76 GLN  HN           75 GLU  HB+         5.50    (#   1283:20  Unique         2.45, 3.15 A)
 &rst
  ixpk= 1283, nxpk= 20, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1081,1082,
 &end
#
#   75 GLU  HN           75 GLU  HB+         3.50    (#   1284:20  Unique         2.43, 2.59 A)
 &rst
  ixpk= 1284, nxpk= 20, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1081,1082,
 &end
#
#   72 ALA  HA           75 GLU  HB+         4.50    (#   1285:20  Unique         1.95, 2.36 A)
 &rst
  ixpk= 1285, nxpk= 20, iat=1033,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1081,1082,
 &end
#
#    0 AMB  20-2:1286     0 AMB  20-1:1286   3.50    (#   1286:20  Double Ambig)
 &rst
  ixpk= 1286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 340,1079,
 igr2= 342, 343,1081,1082,
 &end
#
#   18 VAL  HN           18 VAL  HB          5.50    (#   1287:20  Unique         2.55, 2.63 A)
 &rst
  ixpk= 1287, nxpk= 20, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 PRO  HA           68 PRO  HB+         4.50    (#   1288:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1288, nxpk= 20, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 968, 969,
 &end
#
#  138 TRP  HA          138 TRP  HB+         4.50    (#   1289:20  Unique         2.62, 2.84 A)
 &rst
  ixpk= 1289, nxpk= 20, iat=2024,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2026,2027,
 &end
#
#   77 LYS  HA           77 LYS  HB+         4.50    (#   1290:20  Unique         2.61, 2.81 A)
 &rst
  ixpk= 1290, nxpk= 20, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1113,1114,
 &end
#
#  138 TRP  HN          138 TRP  HB+         5.50    (#   1291:20  Unique         2.08, 2.73 A)
 &rst
  ixpk= 1291, nxpk= 20, iat=2022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2026,2027,
 &end
#
#  103 ASP  HA          106 GLU  HB+         4.50    (#   1292:20  Unique         3.36, 4.56 A)
 &rst
  ixpk= 1292, nxpk= 20, iat=1492,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1547,1548,
 &end
#
#  106 GLU  HN          106 GLU  HB+         4.50    (#   1293:20  Unique         2.16, 3.02 A)
 &rst
  ixpk= 1293, nxpk= 20, iat=1543,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1547,1548,
 &end
#
#  107 ALA  HN          106 GLU  HB+         4.50    (#   1294:20  Unique         2.78, 3.28 A)
 &rst
  ixpk= 1294, nxpk= 20, iat=1558,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1547,1548,
 &end
#
#    0 AMB  20-2:1295     0 AMB  20-1:1295   5.50    (#   1295:20  Double Ambig)
 &rst
  ixpk= 1295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1700,1701,1060,
 igr2=1341,1342,1064,1065,
 &end
#
#   74 GLN  HN           74 GLN  HB-         4.50    (#   1296:20  Unique         2.74, 3.18 A)
 &rst
  ixpk= 1296, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1064,1065,
 &end
#
#   94 GLU  HN           93 ARG  HB-         5.50    (#   1297:20  Unique         1.93, 3.27 A)
 &rst
  ixpk= 1297, nxpk= 20, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1341,1342,
 &end
#
#    0 AMB  20-2:1298     0 AMB  20-1:1298   3.50    (#   1298:20  Double Ambig)
 &rst
  ixpk= 1298, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2007,2022,
 igr2=2011,2012,2011,2012,
 &end
#
#   21 HIS  HA           24 GLU  HB-         4.50    (#   1299:20  Unique         2.73, 3.17 A)
 &rst
  ixpk= 1299, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#   28 GLU  HN           28 GLU  HB-         4.50    (#   1300:20  Unique         2.21, 2.94 A)
 &rst
  ixpk= 1300, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 398, 399,
 &end
#
#   25 LYS  HN           24 GLU  HB-         4.50    (#   1301:20  Unique         2.01, 2.82 A)
 &rst
  ixpk= 1301, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#   28 GLU  HN           28 GLU  HB+         3.50    (#   1302:20  Unique         2.21, 2.94 A)
 &rst
  ixpk= 1302, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 398, 399,
 &end
#
#  137 GLU  HA          137 GLU  HB+         2.80    (#   1303:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 1303, nxpk= 20, iat=2009,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2011,2012,
 &end
#
#   24 GLU  HN           24 GLU  HB+         4.50    (#   1304:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 1304, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#   25 LYS  HN           24 GLU  HB+         5.50    (#   1305:20  Unique         2.01, 2.82 A)
 &rst
  ixpk= 1305, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 327, 328,
 &end
#
#  108 GLU  HN          108 GLU  HB-         5.50    (#   1306:20  Unique         2.26, 2.93 A)
 &rst
  ixpk= 1306, nxpk= 20, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1572,1573,
 &end
#
#  108 GLU  HA          108 GLU  HB-         4.50    (#   1307:20  Unique         2.54, 2.79 A)
 &rst
  ixpk= 1307, nxpk= 20, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1572,1573,
 &end
#
#  108 GLU  HN          108 GLU  HB+         4.50    (#   1308:20  Unique         2.26, 2.93 A)
 &rst
  ixpk= 1308, nxpk= 20, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1572,1573,
 &end
#
#  108 GLU  HA          108 GLU  HB+         5.50    (#   1309:20  Unique         2.54, 2.79 A)
 &rst
  ixpk= 1309, nxpk= 20, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1572,1573,
 &end
#
#   28 GLU  HN           28 GLU  HB-         4.50    (#   1310:20  Unique         2.21, 2.94 A)
 &rst
  ixpk= 1310, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 398, 399,
 &end
#
#   24 GLU  HN           24 GLU  HB-         4.50    (#   1311:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 1311, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#   72 ALA  HN           71 GLU  HB+         4.50    (#   1312:20  Unique         2.45, 2.81 A)
 &rst
  ixpk= 1312, nxpk= 20, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1020,1021,
 &end
#
#   68 PRO  HA           71 GLU  HB+         4.50    (#   1313:20  Unique         2.37, 3.14 A)
 &rst
  ixpk= 1313, nxpk= 20, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1020,1021,
 &end
#
#   71 GLU  HN           71 GLU  HB+         3.50    (#   1314:20  Unique         2.24, 2.90 A)
 &rst
  ixpk= 1314, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1020,1021,
 &end
#
#   21 HIS  HN           21 HIS  HB-         7.00    (#   1315:20  Unique         2.41, 2.53 A)
 &rst
  ixpk= 1315, nxpk= 20, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 281, 282,
 &end
#
#   76 GLN  HN           76 GLN  HB+         5.50    (#   1316:20  Unique         2.98, 3.30 A)
 &rst
  ixpk= 1316, nxpk= 20, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1096,1097,
 &end
#
#    6 LEU  HA            6 LEU  MDX         5.50    (#   1317:20  Unique         2.23, 3.06 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:1318     0 AMB  20-1:1318   3.50    (#   1318:20  Double Ambig)
 &rst
  ixpk= 1318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 600,1094,
 igr2= 602, 603,1096,1097,
 &end
#
#   42 GLU  HN           42 GLU  HB+         4.50    (#   1319:20  Unique         3.73, 3.90 A)
 &rst
  ixpk= 1319, nxpk= 20, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 602, 603,
 &end
#
#   76 GLN  HN           76 GLN  HB-         5.50    (#   1320:20  Unique         2.98, 3.30 A)
 &rst
  ixpk= 1320, nxpk= 20, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1096,1097,
 &end
#
#   76 GLN  HA           76 GLN  HB-         4.50    (#   1321:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 1321, nxpk= 20, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1096,1097,
 &end
#
#  112 SER  HA           77 LYS  HD+         5.50    (#   1322:20  Unique         4.07, 4.49 A)
 &rst
  ixpk= 1322, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1119,1120,
 &end
#
#    0 AMB  20-2:1323   116 GLN  HB-         5.50    (#   1323:20  Single Ambig)
 &rst
  ixpk= 1323, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1247,1251,1245,1253,1688,
 igr2=1692,1693,
 &end
#
#   27 GLU  HN           27 GLU  HB-         5.50    (#   1324:20  Unique         2.19, 2.86 A)
 &rst
  ixpk= 1324, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 383, 384,
 &end
#
#   27 GLU  HA           27 GLU  HB-         4.50    (#   1325:20  Unique         2.63, 2.82 A)
 &rst
  ixpk= 1325, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   28 GLU  HN            0 AMB  20-1:1326   4.50    (#   1326:20  Single Ambig)
 &rst
  ixpk= 1326, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 383, 384, 383, 384,
 &end
#
#   27 GLU  HN           27 GLU  HB+         4.50    (#   1327:20  Unique         2.19, 2.86 A)
 &rst
  ixpk= 1327, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#  116 GLN  HN          116 GLN  HB+         4.50    (#   1328:20  Unique         2.35, 2.53 A)
 &rst
  ixpk= 1328, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1692,1693,
 &end
#
#   27 GLU  HA            0 AMB  20-1:1329   4.50    (#   1329:20  Single Ambig)
 &rst
  ixpk= 1329, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 383, 384, 383, 384,
 &end
#
#  143 VAL  HN          142 TRP  HB+         5.50    (#   1330:20  Unique         2.37, 3.18 A)
 &rst
  ixpk= 1330, nxpk= 20, iat=2107,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2087,2088,
 &end
#
#  142 TRP  HE3         142 TRP  HB+         5.50    (#   1331:20  Unique         2.41, 3.18 A)
 &rst
  ixpk= 1331, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2087,2088,
 &end
#
#  142 TRP  HN          142 TRP  HB-         4.50    (#   1332:20  Unique         2.29, 2.54 A)
 &rst
  ixpk= 1332, nxpk= 20, iat=2083,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2087,2088,
 &end
#
#   40 LEU  HN           40 LEU  HG          4.50    (#   1334:20  Unique         3.39, 3.44 A)
 &rst
  ixpk= 1334, nxpk= 20, iat= 560, 567, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 LYS  HA          110 LYS  HG+         5.50    (#   1335:20  Unique         2.81, 2.94 A)
 &rst
  ixpk= 1335, nxpk= 20, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1609,1610,
 &end
#
#   36 LEU  HA           36 LEU  MDX         4.50    (#   1337:20  Unique         3.09, 4.40 A)
 &rst
  ixpk= 1337, nxpk= 20, iat= 505,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#  145 LEU  HA          145 LEU  HG          5.50    (#   1338:20  Unique         2.25, 2.40 A)
 &rst
  ixpk= 1338, nxpk= 20, iat=2139,2144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1339     0 AMB  20-1:1339   5.50    (#   1339:20  Double Ambig)
 &rst
  ixpk= 1339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 977,1721,1722,
 igr2=1533,1534,1535,1537,1538,1539,2144,
 &end
#
#    0 AMB  20-2:1340    73 LEU  MDY         7.00    (#   1340:20  Single Ambig)
 &rst
  ixpk= 1340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=1104,1105,1003,1012,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:1342    40 LEU  MDX         5.50    (#   1342:20  Single Ambig)
 &rst
  ixpk= 1342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 562, 615,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    0 AMB  20-2:1343   121 LEU  HG          5.50    (#   1343:20  Single Ambig)
 &rst
  ixpk= 1343, nxpk= 20, iat=  -1,1762, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2024,1721,1722,
 &end
#
#    5 THR  HA            6 LEU  MDY         5.50    (#   1344:20  Unique         3.47, 5.69 A)
 &rst
  ixpk= 1344, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#  142 TRP  HE3         139 LEU  MDX         4.50    (#   1345:20  Unique         2.20, 4.90 A)
 &rst
  ixpk= 1345, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#   12 LEU  HA           12 LEU  MDX         5.50    (#   1350:20  Unique         2.10, 3.75 A)
 &rst
  ixpk= 1350, nxpk= 20, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 166, 167, 168, 170, 171, 172,
 &end
#
#  115 LYS  HA          115 LYS  HG-         5.50    (#   1351:20  Unique         3.58, 3.75 A)
 &rst
  ixpk= 1351, nxpk= 20, iat=1668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1673,1674,
 &end
#
#  115 LYS  HA          115 LYS  HG+         5.50    (#   1353:20  Unique         3.58, 3.75 A)
 &rst
  ixpk= 1353, nxpk= 20, iat=1668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1673,1674,
 &end
#
#    0 AMB  20-2:1354   109 LEU  MDX         5.50    (#   1354:20  Single Ambig)
 &rst
  ixpk= 1354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1239,1104,1105,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#   77 LYS  HA           77 LYS  HG+         5.50    (#   1357:20  Unique         2.15, 2.78 A)
 &rst
  ixpk= 1357, nxpk= 20, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1116,1117,
 &end
#
#   77 LYS  HA           77 LYS  HG+         5.50    (#   1358:20  Unique         2.15, 2.78 A)
 &rst
  ixpk= 1358, nxpk= 20, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1116,1117,
 &end
#
#    0 AMB  20-2:1359    73 LEU  MDX         5.50    (#   1359:20  Single Ambig)
 &rst
  ixpk= 1359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1104,1105,1003,1012,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  146 LEU  HN          146 LEU  MDY         4.50    (#   1360:20  Unique         1.95, 4.42 A)
 &rst
  ixpk= 1360, nxpk= 20, iat=2156,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#   70 TYR  HD          105 LEU  MDY         4.50    (#   1363:20  Unique         4.37, 7.31 A)
 &rst
  ixpk= 1363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1003,1012,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#   25 LYS  HN           25 LYS  HG+         5.50    (#   1364:20  Unique         1.99, 2.77 A)
 &rst
  ixpk= 1364, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 345, 346,
 &end
#
#   44 LEU  HA           44 LEU  MDX         4.50    (#   1366:20  Unique         2.00, 3.65 A)
 &rst
  ixpk= 1366, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   12 LEU  HA           12 LEU  MDY         4.50    (#   1367:20  Unique         2.10, 3.75 A)
 &rst
  ixpk= 1367, nxpk= 20, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 166, 167, 168, 170, 171, 172,
 &end
#
#   36 LEU  HA           36 LEU  MDY         3.50    (#   1369:20  Unique         3.09, 4.40 A)
 &rst
  ixpk= 1369, nxpk= 20, iat= 505,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#   26 LEU  HA           26 LEU  MDX         3.50    (#   1371:20  Unique         1.99, 3.10 A)
 &rst
  ixpk= 1371, nxpk= 20, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:1372   120 THR  MG2         4.50    (#   1372:20  Single Ambig)
 &rst
  ixpk= 1372, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1755,1361,
 igr2=1747,1748,1749,
 &end
#
#    0 AMB  20-2:1374     0 AMB  20-1:1374   4.50    (#   1374:20  Double Ambig)
 &rst
  ixpk= 1374, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2102,2156,
 igr2= 369, 370, 371, 373, 374, 375,1711,1712,1713,
 &end
#
#  120 THR  HA          120 THR  MG2         3.50    (#   1375:20  Unique         2.47, 3.66 A)
 &rst
  ixpk= 1375, nxpk= 20, iat=1743,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1747,1748,1749,
 &end
#
#    0 AMB  20-2:1376     0 AMB  20-1:1376   7.00    (#   1376:20  Double Ambig)
 &rst
  ixpk= 1376, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.12, r4=12.62,
 igr1=1321,1322,1798,
 igr2=1747,1748,1749, 242, 243, 244, 246, 247, 248,
 &end
#
#   33 THR  HA           33 THR  MG2         4.50    (#   1377:20  Unique         2.57, 3.28 A)
 &rst
  ixpk= 1377, nxpk= 20, iat= 462,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 466, 467, 468,
 &end
#
#   18 VAL  HN           18 VAL  MGX         4.50    (#   1378:20  Unique         2.16, 3.86 A)
 &rst
  ixpk= 1378, nxpk= 20, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#  120 THR  HA          120 THR  MG2         3.50    (#   1379:20  Unique         2.47, 3.66 A)
 &rst
  ixpk= 1379, nxpk= 20, iat=1743,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1747,1748,1749,
 &end
#
#   32 THR  HN           32 THR  MG2         4.50    (#   1380:20  Unique         3.07, 3.81 A)
 &rst
  ixpk= 1380, nxpk= 20, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 452, 453, 454,
 &end
#
#    0 AMB  20-2:1381    33 THR  MG2         5.50    (#   1381:20  Single Ambig)
 &rst
  ixpk= 1381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 474, 394, 426,
 igr2= 466, 467, 468,
 &end
#
#   33 THR  HN           33 THR  MG2         4.50    (#   1382:20  Unique         3.01, 3.54 A)
 &rst
  ixpk= 1382, nxpk= 20, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 466, 467, 468,
 &end
#
#  118 GLY  HN          117 THR  MG2         5.50    (#   1383:20  Unique         2.13, 3.39 A)
 &rst
  ixpk= 1383, nxpk= 20, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1711,1712,1713,
 &end
#
#   33 THR  HN           32 THR  MG2         5.50    (#   1385:20  Unique         3.72, 4.43 A)
 &rst
  ixpk= 1385, nxpk= 20, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 452, 453, 454,
 &end
#
#    0 AMB  20-2:1386    32 THR  MG2         7.00    (#   1386:20  Single Ambig)
 &rst
  ixpk= 1386, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 428, 381,
 igr2= 452, 453, 454,
 &end
#
#   32 THR  HA           32 THR  MG2         3.50    (#   1387:20  Unique         2.32, 2.94 A)
 &rst
  ixpk= 1387, nxpk= 20, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 452, 453, 454,
 &end
#
#   32 THR  HB           32 THR  MG2         3.50    (#   1388:20  Unique         2.41, 2.64 A)
 &rst
  ixpk= 1388, nxpk= 20, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 452, 453, 454,
 &end
#
#   40 LEU  HA           40 LEU  MDY         3.50    (#   1389:20  Unique         2.35, 3.70 A)
 &rst
  ixpk= 1389, nxpk= 20, iat= 562,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#   52 VAL  HN           51 LEU  MDY         5.50    (#   1390:20  Unique         3.59, 5.43 A)
 &rst
  ixpk= 1390, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#   51 LEU  HA           51 LEU  MDY         4.50    (#   1395:20  Unique         1.93, 3.73 A)
 &rst
  ixpk= 1395, nxpk= 20, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#  143 VAL  HN          143 VAL  MGY         4.50    (#   1396:20  Unique         2.32, 3.89 A)
 &rst
  ixpk= 1396, nxpk= 20, iat=2107,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  142 TRP  HE3         143 VAL  MGY         4.50    (#   1397:20  Unique         1.99, 4.45 A)
 &rst
  ixpk= 1397, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#   87 ALA  HN           87 ALA  MB          5.50    (#   1398:20  Unique         2.19, 2.95 A)
 &rst
  ixpk= 1398, nxpk= 20, iat=1264,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1268,1269,1270,
 &end
#
#   87 ALA  HA           87 ALA  MB          4.50    (#   1400:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 1400, nxpk= 20, iat=1266,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1268,1269,1270,
 &end
#
#   11 THR  HA           11 THR  MG2         4.50    (#   1401:20  Unique         2.23, 3.73 A)
 &rst
  ixpk= 1401, nxpk= 20, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 149, 150, 151,
 &end
#
#   56 THR  HA           56 THR  MG2         4.50    (#   1402:20  Unique         2.35, 3.10 A)
 &rst
  ixpk= 1402, nxpk= 20, iat= 807,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 811, 812, 813,
 &end
#
#    0 AMB  20-2:1403     0 AMB  20-1:1403   5.50    (#   1403:20  Double Ambig)
 &rst
  ixpk= 1403, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=1774, 252,2083,
 igr2=1764,1765,1766,1768,1769,1770, 303, 304, 305, 307,
       308, 309,2146,2147,2148,2150,2151,2152,
 &end
#
#    0 AMB  20-2:1404     0 AMB  20-1:1404   5.50    (#   1404:20  Double Ambig)
 &rst
  ixpk= 1404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2137,1656,
 igr2=2146,2147,2148,2150,2151,2152,1166,1167,1168,1170,
      1171,1172,
 &end
#
#    0 AMB  20-2:1405     0 AMB  20-1:1405   3.50    (#   1405:20  Double Ambig)
 &rst
  ixpk= 1405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2139,1651,1652,1798,
 igr2=2146,2147,2148,2150,2151,2152,1166,1167,1168,1170,
      1171,1172,1764,1765,1766,1768,1769,1770,
 &end
#
#   88 ILE  HN           87 ALA  MB          5.50    (#   1406:20  Unique         2.99, 3.84 A)
 &rst
  ixpk= 1406, nxpk= 20, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1268,1269,1270,
 &end
#
#  120 THR  HA           87 ALA  MB          5.50    (#   1407:20  Unique         2.29, 3.67 A)
 &rst
  ixpk= 1407, nxpk= 20, iat=1743,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1268,1269,1270,
 &end
#
#  143 VAL  HN          143 VAL  MGX         4.50    (#   1409:20  Unique         2.32, 3.89 A)
 &rst
  ixpk= 1409, nxpk= 20, iat=2107,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  142 TRP  HE3         143 VAL  MGX         5.50    (#   1410:20  Unique         1.99, 4.45 A)
 &rst
  ixpk= 1410, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  144 ASN  HN          143 VAL  MGX         5.50    (#   1411:20  Unique         2.76, 4.18 A)
 &rst
  ixpk= 1411, nxpk= 20, iat=2123,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#  144 ASN  HD2-        143 VAL  MGY         7.00    (#   1412:20  Unique         4.63, 6.65 A)
 &rst
  ixpk= 1412, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2132,2133,
 igr2=2113,2114,2115,2117,2118,2119,
 &end
#
#    0 AMB  20-2:1413     0 AMB  20-1:1413   3.50    (#   1413:20  Double Ambig)
 &rst
  ixpk= 1413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1413, 809,
 igr2=1415,1416,1417, 811, 812, 813,
 &end
#
#   36 LEU  HN           35 THR  MG2         5.50    (#   1414:20  Unique         2.33, 3.40 A)
 &rst
  ixpk= 1414, nxpk= 20, iat= 503,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 495, 496, 497,
 &end
#
#   35 THR  HA           35 THR  MG2         3.50    (#   1415:20  Unique         2.12, 2.94 A)
 &rst
  ixpk= 1415, nxpk= 20, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 495, 496, 497,
 &end
#
#   97 THR  HA           97 THR  MG2         4.50    (#   1416:20  Unique         2.14, 3.27 A)
 &rst
  ixpk= 1416, nxpk= 20, iat=1411,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1415,1416,1417,
 &end
#
#    0 AMB  20-2:1417     5 THR  MG2         3.50    (#   1417:20  Single Ambig)
 &rst
  ixpk= 1417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  64,  45,
 igr2=  68,  69,  70,
 &end
#
#    0 AMB  20-2:1418    80 LEU  MDX         5.50    (#   1418:20  Single Ambig)
 &rst
  ixpk= 1418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 713,1104,1105,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  20-2:1419    80 LEU  MDX         4.50    (#   1419:20  Single Ambig)
 &rst
  ixpk= 1419, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1642,1643, 660,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#  114 ALA  HN           80 LEU  MDX         7.00    (#   1420:20  Unique         3.11, 4.92 A)
 &rst
  ixpk= 1420, nxpk= 20, iat=1656,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#   80 LEU  HA           80 LEU  MDX         3.50    (#   1421:20  Unique         1.91, 3.41 A)
 &rst
  ixpk= 1421, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  20-2:1422     0 AMB  20-1:1422   5.50    (#   1422:20  Double Ambig)
 &rst
  ixpk= 1422, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=  62, 764,
 igr2=  68,  69,  70, 754, 755, 756, 758, 759, 760,
 &end
#
#   50 TRP  HD1           5 THR  MG2         4.50    (#   1423:20  Unique         2.63, 3.48 A)
 &rst
  ixpk= 1423, nxpk= 20, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  68,  69,  70,
 &end
#
#   52 VAL  HA           52 VAL  MGY         4.50    (#   1424:20  Unique         2.37, 3.52 A)
 &rst
  ixpk= 1424, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   85 PHE  HA           52 VAL  MGX         4.50    (#   1425:20  Unique         4.71, 7.10 A)
 &rst
  ixpk= 1425, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   52 VAL  HN           52 VAL  MGX         4.50    (#   1426:20  Unique         2.29, 3.76 A)
 &rst
  ixpk= 1426, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   52 VAL  HA           52 VAL  MGX         4.50    (#   1427:20  Unique         2.37, 3.52 A)
 &rst
  ixpk= 1427, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#  114 ALA  HN           83 VAL  MGX         7.00    (#   1428:20  Unique         4.83, 6.51 A)
 &rst
  ixpk= 1428, nxpk= 20, iat=1656,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1429    83 VAL  MGX         4.50    (#   1429:20  Single Ambig)
 &rst
  ixpk= 1429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1197, 679,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1430    83 VAL  MGX         4.50    (#   1430:20  Single Ambig)
 &rst
  ixpk= 1430, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1159, 681, 682,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   83 VAL  HA           83 VAL  MGX         3.50    (#   1431:20  Unique         2.33, 3.50 A)
 &rst
  ixpk= 1431, nxpk= 20, iat=1199,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#  146 LEU  HN          146 LEU  MDX         4.50    (#   1432:20  Unique         1.95, 4.42 A)
 &rst
  ixpk= 1432, nxpk= 20, iat=2156,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#    0 AMB  20-2:1433    72 ALA  MB          5.50    (#   1433:20  Single Ambig)
 &rst
  ixpk= 1433, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1016, 579,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  20-2:1434    72 ALA  MB          3.50    (#   1434:20  Single Ambig)
 &rst
  ixpk= 1434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1031,1041,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  20-2:1435    72 ALA  MB          3.50    (#   1435:20  Single Ambig)
 &rst
  ixpk= 1435, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1033, 977,
 igr2=1035,1036,1037,
 &end
#
#   34 GLU  HN            2 ALA  MB          5.50    (#   1436:20  Unique         3.09, 3.62 A)
 &rst
  ixpk= 1436, nxpk= 20, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  25,  26,  27,
 &end
#
#   33 THR  HA            2 ALA  MB          4.50    (#   1437:20  Unique         2.24, 3.17 A)
 &rst
  ixpk= 1437, nxpk= 20, iat= 462,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  25,  26,  27,
 &end
#
#    3 ASP  HN            2 ALA  MB          4.50    (#   1439:20  Unique         2.17, 2.94 A)
 &rst
  ixpk= 1439, nxpk= 20, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  25,  26,  27,
 &end
#
#    4 ILE  HN            2 ALA  MB          4.50    (#   1440:20  Unique         2.23, 3.35 A)
 &rst
  ixpk= 1440, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  25,  26,  27,
 &end
#
#   32 THR  HB            2 ALA  MB          4.50    (#   1442:20  Unique         2.02, 3.16 A)
 &rst
  ixpk= 1442, nxpk= 20, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  25,  26,  27,
 &end
#
#   49 ILE  HA           49 ILE  MG2         4.50    (#   1444:20  Unique         2.09, 2.94 A)
 &rst
  ixpk= 1444, nxpk= 20, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 692, 693, 694,
 &end
#
#    4 ILE  HA           49 ILE  MG2         5.50    (#   1446:20  Unique         5.12, 5.78 A)
 &rst
  ixpk= 1446, nxpk= 20, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 692, 693, 694,
 &end
#
#  115 LYS  HN          114 ALA  MB          4.50    (#   1447:20  Unique         2.58, 3.46 A)
 &rst
  ixpk= 1447, nxpk= 20, iat=1666,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1660,1661,1662,
 &end
#
#  114 ALA  HN          114 ALA  MB          3.50    (#   1448:20  Unique         2.20, 2.90 A)
 &rst
  ixpk= 1448, nxpk= 20, iat=1656,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1660,1661,1662,
 &end
#
#  114 ALA  HA          114 ALA  MB          3.50    (#   1450:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 1450, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1660,1661,1662,
 &end
#
#    0 AMB  20-2:1451    83 VAL  MGY         5.50    (#   1451:20  Single Ambig)
 &rst
  ixpk= 1451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1197, 679,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   83 VAL  HA           83 VAL  MGY         4.50    (#   1452:20  Unique         2.33, 3.50 A)
 &rst
  ixpk= 1452, nxpk= 20, iat=1199,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   84 ARG  HN           83 VAL  MGY         4.50    (#   1453:20  Unique         1.86, 3.82 A)
 &rst
  ixpk= 1453, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   50 TRP  HD1          83 VAL  MGY         4.50    (#   1456:20  Unique         2.14, 3.81 A)
 &rst
  ixpk= 1456, nxpk= 20, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   31 PHE  HN           29 ALA  MB          5.50    (#   1457:20  Unique         3.05, 4.07 A)
 &rst
  ixpk= 1457, nxpk= 20, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 413, 414, 415,
 &end
#
#  142 TRP  HE3          29 ALA  MB          5.50    (#   1458:20  Unique         5.04, 5.56 A)
 &rst
  ixpk= 1458, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 413, 414, 415,
 &end
#
#   90 ILE  HA           90 ILE  MG2         4.50    (#   1459:20  Unique         2.14, 2.95 A)
 &rst
  ixpk= 1459, nxpk= 20, iat=1302,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1306,1307,1308,
 &end
#
#   29 ALA  HN           29 ALA  MB          3.50    (#   1460:20  Unique         2.22, 2.88 A)
 &rst
  ixpk= 1460, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 413, 414, 415,
 &end
#
#   29 ALA  HA           29 ALA  MB          3.50    (#   1462:20  Unique         2.29, 2.63 A)
 &rst
  ixpk= 1462, nxpk= 20, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 413, 414, 415,
 &end
#
#   26 LEU  HA           29 ALA  MB          4.50    (#   1464:20  Unique         2.52, 3.55 A)
 &rst
  ixpk= 1464, nxpk= 20, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 413, 414, 415,
 &end
#
#   91 GLY  HN           90 ILE  MG2         5.50    (#   1466:20  Unique         1.95, 3.25 A)
 &rst
  ixpk= 1466, nxpk= 20, iat=1319,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1306,1307,1308,
 &end
#
#   82 ALA  HN           82 ALA  MB          3.50    (#   1467:20  Unique         2.35, 3.12 A)
 &rst
  ixpk= 1467, nxpk= 20, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1191,1192,1193,
 &end
#
#    0 AMB  20-2:1468    82 ALA  MB          5.50    (#   1468:20  Single Ambig)
 &rst
  ixpk= 1468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1197, 679,
 igr2=1191,1192,1193,
 &end
#
#   82 ALA  HA           82 ALA  MB          3.50    (#   1469:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1469, nxpk= 20, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1191,1192,1193,
 &end
#
#   47 SER  HA           82 ALA  MB          3.50    (#   1470:20  Unique         2.25, 3.77 A)
 &rst
  ixpk= 1470, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1191,1192,1193,
 &end
#
#   91 GLY  HA+         130 ILE  MG2         4.50    (#   1471:20  Unique         2.66, 5.04 A)
 &rst
  ixpk= 1471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1321,1322,
 igr2=1914,1915,1916,
 &end
#
#  108 GLU  HN          107 ALA  MB          4.50    (#   1472:20  Unique         2.65, 3.21 A)
 &rst
  ixpk= 1472, nxpk= 20, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1562,1563,1564,
 &end
#
#  107 ALA  HN          107 ALA  MB          3.50    (#   1473:20  Unique         2.07, 2.87 A)
 &rst
  ixpk= 1473, nxpk= 20, iat=1558,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1562,1563,1564,
 &end
#
#    0 AMB  20-2:1474   107 ALA  MB          2.80    (#   1474:20  Single Ambig)
 &rst
  ixpk= 1474, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1504,1560,
 igr2=1562,1563,1564,
 &end
#
#    0 AMB  20-2:1475    19 ALA  MB          3.50    (#   1475:20  Single Ambig)
 &rst
  ixpk= 1475, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 262, 252,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:1476   130 ILE  MG2         4.50    (#   1476:20  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1321,1322,1910,
 igr2=1914,1915,1916,
 &end
#
#   46 ALA  HN           46 ALA  MB          3.50    (#   1477:20  Unique         2.23, 2.94 A)
 &rst
  ixpk= 1477, nxpk= 20, iat= 658,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 662, 663, 664,
 &end
#
#   80 LEU  HA           46 ALA  MB          4.50    (#   1478:20  Unique         2.19, 3.44 A)
 &rst
  ixpk= 1478, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 662, 663, 664,
 &end
#
#   46 ALA  HA           46 ALA  MB          3.50    (#   1479:20  Unique         2.29, 2.63 A)
 &rst
  ixpk= 1479, nxpk= 20, iat= 660,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 662, 663, 664,
 &end
#
#   23 ALA  HN           23 ALA  MB          3.50    (#   1480:20  Unique         2.14, 2.88 A)
 &rst
  ixpk= 1480, nxpk= 20, iat= 313,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 317, 318, 319,
 &end
#
#   24 GLU  HN           23 ALA  MB          4.50    (#   1481:20  Unique         2.50, 3.35 A)
 &rst
  ixpk= 1481, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 317, 318, 319,
 &end
#
#   53 ILE  HA           53 ILE  MG2         4.50    (#   1483:20  Unique         2.23, 2.97 A)
 &rst
  ixpk= 1483, nxpk= 20, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 770, 771, 772,
 &end
#
#    5 THR  HN            4 ILE  MG2         4.50    (#   1484:20  Unique         2.32, 3.10 A)
 &rst
  ixpk= 1484, nxpk= 20, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  49,  50,  51,
 &end
#
#    4 ILE  HA            4 ILE  MG2         4.50    (#   1486:20  Unique         2.47, 3.16 A)
 &rst
  ixpk= 1486, nxpk= 20, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  49,  50,  51,
 &end
#
#  123 ILE  HA          123 ILE  MG2         4.50    (#   1488:20  Unique         2.26, 2.93 A)
 &rst
  ixpk= 1488, nxpk= 20, iat=1798,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1802,1803,1804,
 &end
#
#    7 ILE  HA            7 ILE  MG2         5.50    (#   1489:20  Unique         2.22, 2.90 A)
 &rst
  ixpk= 1489, nxpk= 20, iat=  97,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 101, 102, 103,
 &end
#
#   88 ILE  HA           88 ILE  MG2         5.50    (#   1492:20  Unique         2.29, 3.05 A)
 &rst
  ixpk= 1492, nxpk= 20, iat=1276,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:1493     7 ILE  MD1         5.50    (#   1493:20  Single Ambig)
 &rst
  ixpk= 1493, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 713,1239,1104,1105,
 igr2= 108, 109, 110,
 &end
#
#   49 ILE  HA           49 ILE  MD1         5.50    (#   1496:20  Unique         2.03, 3.12 A)
 &rst
  ixpk= 1496, nxpk= 20, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 699, 700, 701,
 &end
#
#  123 ILE  HA          123 ILE  MD1         5.50    (#   1499:20  Unique         3.88, 4.54 A)
 &rst
  ixpk= 1499, nxpk= 20, iat=1798,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1809,1810,1811,
 &end
#
#   34 GLU  HN           33 THR  HB          4.50    (#   1501:20  Unique         2.74, 2.77 A)
 &rst
  ixpk= 1501, nxpk= 20, iat= 474, 464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 THR  HN           32 THR  HB          4.50    (#   1502:20  Unique         2.81, 2.83 A)
 &rst
  ixpk= 1502, nxpk= 20, iat= 460, 450, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 THR  HN            5 THR  HB          5.50    (#   1503:20  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1503, nxpk= 20, iat=  62,  66, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 THR  HN          120 THR  HB          4.50    (#   1504:20  Unique         2.27, 2.51 A)
 &rst
  ixpk= 1504, nxpk= 20, iat=1741,1745, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 THR  HN           35 THR  HB          4.50    (#   1505:20  Unique         2.67, 2.81 A)
 &rst
  ixpk= 1505, nxpk= 20, iat= 489, 493, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1506     0 AMB  20-1:1506   4.50    (#   1506:20  Double Ambig)
 &rst
  ixpk= 1506, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 679,1524,
 igr2= 672, 673,1330,1331,
 &end
#
#    0 AMB  20-2:1507     0 AMB  20-1:1507   7.00    (#   1507:20  Double Ambig)
 &rst
  ixpk= 1507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 668,1558,
 igr2= 672, 673,1330,1331,
 &end
#
#    0 AMB  20-2:1508     0 AMB  20-1:1508   5.50    (#   1508:20  Double Ambig)
 &rst
  ixpk= 1508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 679,1197,
 igr2= 672, 673, 672, 673,
 &end
#
#  112 SER  HN          112 SER  HB+         5.50    (#   1509:20  Unique         2.32, 2.99 A)
 &rst
  ixpk= 1509, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1642,1643,
 &end
#
#  112 SER  HN          112 SER  HB-         4.50    (#   1510:20  Unique         2.32, 2.99 A)
 &rst
  ixpk= 1510, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1642,1643,
 &end
#
#  121 LEU  HN          120 THR  HA          3.50    (#   1512:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1512, nxpk= 20, iat=1755,1743, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  132 GLU  HN          131 PRO  HA          4.50    (#   1513:20  Unique         3.51, 3.56 A)
 &rst
  ixpk= 1513, nxpk= 20, iat=1941,1937, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 LEU  HN           39 PRO  HA          3.50    (#   1514:20  Unique         3.57, 3.57 A)
 &rst
  ixpk= 1514, nxpk= 20, iat= 560, 556, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 SER  HN           81 SER  HB-         5.50    (#   1515:20  Unique         2.18, 2.60 A)
 &rst
  ixpk= 1515, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1180,1181,
 &end
#
#  141 SER  HN          141 SER  HB-         4.50    (#   1516:20  Unique         2.10, 2.58 A)
 &rst
  ixpk= 1516, nxpk= 20, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2076,2077,
 &end
#
#  141 SER  HN          141 SER  HB+         4.50    (#   1517:20  Unique         2.10, 2.58 A)
 &rst
  ixpk= 1517, nxpk= 20, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2076,2077,
 &end
#
#  142 TRP  HN          142 TRP  HA          4.50    (#   1518:20  Unique         2.73, 2.75 A)
 &rst
  ixpk= 1518, nxpk= 20, iat=2083,2085, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   79 ASP  HN           78 PRO  HA          3.50    (#   1519:20  Unique         2.56, 2.61 A)
 &rst
  ixpk= 1519, nxpk= 20, iat=1145,1141, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  118 GLY  HN          117 THR  HA          3.50    (#   1520:20  Unique         2.15, 2.18 A)
 &rst
  ixpk= 1520, nxpk= 20, iat=1719,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1521    83 VAL  HA          4.50    (#   1521:20  Single Ambig)
 &rst
  ixpk= 1521, nxpk= 20, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 679,1197,
 &end
#
#   84 ARG  HN           83 VAL  HA          3.50    (#   1522:20  Unique         2.22, 2.24 A)
 &rst
  ixpk= 1522, nxpk= 20, iat=1213,1199, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 ILE  HN           52 VAL  HA          4.50    (#   1523:20  Unique         2.20, 2.22 A)
 &rst
  ixpk= 1523, nxpk= 20, iat= 764, 750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ILE  HN           52 VAL  HA          4.50    (#   1524:20  Unique         2.52, 2.65 A)
 &rst
  ixpk= 1524, nxpk= 20, iat=  95, 750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  138 TRP  HN          138 TRP  HA          4.50    (#   1525:20  Unique         2.74, 2.74 A)
 &rst
  ixpk= 1525, nxpk= 20, iat=2022,2024, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 SER  HN            0 AMB  20-1:1526   4.50    (#   1526:20  Single Ambig)
 &rst
  ixpk= 1526, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 954, 955, 954, 955,
 &end
#
#   67 SER  HN            0 AMB  20-1:1527   4.50    (#   1527:20  Single Ambig)
 &rst
  ixpk= 1527, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 954, 955, 954, 955,
 &end
#
#   70 TYR  HD           70 TYR  HA          4.50    (#   1528:20  Unique         3.10, 3.93 A)
 &rst
  ixpk= 1528, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1003,1012,
 &end
#
#  124 ASN  HN          123 ILE  HA          4.50    (#   1529:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 1529, nxpk= 20, iat=1815,1798, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  141 SER  HN          141 SER  HA          4.50    (#   1530:20  Unique         2.75, 2.75 A)
 &rst
  ixpk= 1530, nxpk= 20, iat=2072,2074, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 SER  HN            7 ILE  HA          4.50    (#   1531:20  Unique         2.16, 2.16 A)
 &rst
  ixpk= 1531, nxpk= 20, iat= 114,  97, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 GLU  HN          106 GLU  HA          5.50    (#   1532:20  Unique         2.76, 2.77 A)
 &rst
  ixpk= 1532, nxpk= 20, iat=1543,1545, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 LYS  HN          110 LYS  HA          5.50    (#   1533:20  Unique         2.87, 2.88 A)
 &rst
  ixpk= 1533, nxpk= 20, iat=1602,1604, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LYS  HN          104 LYS  HA          5.50    (#   1534:20  Unique         2.70, 2.75 A)
 &rst
  ixpk= 1534, nxpk= 20, iat=1502,1504, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 GLU  HN           24 GLU  HA          4.50    (#   1535:20  Unique         2.77, 2.78 A)
 &rst
  ixpk= 1535, nxpk= 20, iat= 323, 325, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1536   137 GLU  HA          4.50    (#   1536:20  Single Ambig)
 &rst
  ixpk= 1536, nxpk= 20, iat=  -1,2009, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2007,2022,
 &end
#
#   28 GLU  HN           28 GLU  HA          4.50    (#   1537:20  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1537, nxpk= 20, iat= 394, 396, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 GLU  HN           71 GLU  HA          5.50    (#   1538:20  Unique         2.76, 2.77 A)
 &rst
  ixpk= 1538, nxpk= 20, iat=1016,1018, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 ALA  HN           28 GLU  HA          5.50    (#   1539:20  Unique         3.34, 3.37 A)
 &rst
  ixpk= 1539, nxpk= 20, iat= 409, 396, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 HIS  HN           21 HIS  HA          5.50    (#   1540:20  Unique         2.78, 2.78 A)
 &rst
  ixpk= 1540, nxpk= 20, iat= 277, 279, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 GLN  HN            0 AMB  20-1:1541   4.50    (#   1541:20  Single Ambig)
 &rst
  ixpk= 1541, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1062,1018,
 &end
#
#   75 GLU  HN           74 GLN  HA          7.00    (#   1543:20  Unique         3.33, 3.33 A)
 &rst
  ixpk= 1543, nxpk= 20, iat=1077,1062, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   42 GLU  HN           42 GLU  HA          4.50    (#   1544:20  Unique         2.75, 2.75 A)
 &rst
  ixpk= 1544, nxpk= 20, iat= 598, 600, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 GLU  HN           75 GLU  HA          4.50    (#   1545:20  Unique         2.90, 2.90 A)
 &rst
  ixpk= 1545, nxpk= 20, iat=1077,1079, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 ASP  HN           42 GLU  HA          5.50    (#   1546:20  Unique         2.23, 2.25 A)
 &rst
  ixpk= 1546, nxpk= 20, iat= 613, 600, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  142 TRP  HE3         139 LEU  HA          5.50    (#   1547:20  Unique         2.23, 2.49 A)
 &rst
  ixpk= 1547, nxpk= 20, iat=2102,2048, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 GLU  HN          108 GLU  HA          4.50    (#   1548:20  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1548, nxpk= 20, iat=1568,1570, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 ASN  HD2-        108 GLU  HA          4.50    (#   1549:20  Unique         1.94, 2.73 A)
 &rst
  ixpk= 1549, nxpk= 20, iat=  -1,1570, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1633,1634,
 &end
#
#  147 LYS  HN          147 LYS  HA          4.50    (#   1550:20  Unique         2.76, 2.83 A)
 &rst
  ixpk= 1550, nxpk= 20, iat=2175,2177, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 ASN  HN          108 GLU  HA          4.50    (#   1551:20  Unique         3.20, 3.24 A)
 &rst
  ixpk= 1551, nxpk= 20, iat=1624,1570, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 ASP  HN            3 ASP  HA          5.50    (#   1552:20  Unique         2.94, 2.94 A)
 &rst
  ixpk= 1552, nxpk= 20, iat=  31,  33, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    4 ILE  HN            3 ASP  HA          5.50    (#   1553:20  Unique         3.40, 3.42 A)
 &rst
  ixpk= 1553, nxpk= 20, iat=  43,  33, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 LYS  HN           25 LYS  HA          5.50    (#   1554:20  Unique         2.76, 2.77 A)
 &rst
  ixpk= 1554, nxpk= 20, iat= 338, 340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   95 TYR  HN           94 GLU  HA          5.50    (#   1555:20  Unique         3.48, 3.53 A)
 &rst
  ixpk= 1555, nxpk= 20, iat=1376,1363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 GLN  HN           76 GLN  HA          4.50    (#   1556:20  Unique         2.92, 2.92 A)
 &rst
  ixpk= 1556, nxpk= 20, iat=1092,1094, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   47 SER  HN           47 SER  HA          4.50    (#   1557:20  Unique         2.87, 2.88 A)
 &rst
  ixpk= 1557, nxpk= 20, iat= 668, 670, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 GLY  HN           47 SER  HA          3.50    (#   1558:20  Unique         2.14, 2.14 A)
 &rst
  ixpk= 1558, nxpk= 20, iat= 679, 670, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 LYS  HN           77 LYS  HA          3.50    (#   1559:20  Unique         2.29, 2.30 A)
 &rst
  ixpk= 1559, nxpk= 20, iat=1109,1111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 THR  HN           34 GLU  HA          3.50    (#   1560:20  Unique         2.15, 2.15 A)
 &rst
  ixpk= 1560, nxpk= 20, iat= 489, 476, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1561    23 ALA  HA          4.50    (#   1561:20  Single Ambig)
 &rst
  ixpk= 1561, nxpk= 20, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 313, 360,
 &end
#
#  111 ASN  HN          111 ASN  HA          3.50    (#   1562:20  Unique         2.81, 2.82 A)
 &rst
  ixpk= 1562, nxpk= 20, iat=1624,1626, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1563    19 ALA  HA          4.50    (#   1563:20  Single Ambig)
 &rst
  ixpk= 1563, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 252, 262,
 &end
#
#  144 ASN  HN          144 ASN  HA          4.50    (#   1564:20  Unique         2.79, 2.81 A)
 &rst
  ixpk= 1564, nxpk= 20, iat=2123,2125, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 ILE  HN          129 ASP  HA          4.50    (#   1565:20  Unique         3.45, 3.53 A)
 &rst
  ixpk= 1565, nxpk= 20, iat=1908,1898, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1566   144 ASN  HA          5.50    (#   1566:20  Single Ambig)
 &rst
  ixpk= 1566, nxpk= 20, iat=  -1,2125, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2175,2156,
 &end
#
#  107 ALA  HN          107 ALA  HA          4.50    (#   1567:20  Unique         2.75, 2.78 A)
 &rst
  ixpk= 1567, nxpk= 20, iat=1558,1560, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 ASP  HN           43 ASP  HA          4.50    (#   1568:20  Unique         2.78, 2.80 A)
 &rst
  ixpk= 1568, nxpk= 20, iat= 613, 615, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1569    72 ALA  HA          4.50    (#   1569:20  Single Ambig)
 &rst
  ixpk= 1569, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1031,1041,
 &end
#
#  146 LEU  HN          146 LEU  HA          4.50    (#   1570:20  Unique         2.81, 2.83 A)
 &rst
  ixpk= 1570, nxpk= 20, iat=2156,2158, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 ILE  HN           65 ASN  HA          5.50    (#   1571:20  Unique         3.32, 5.16 A)
 &rst
  ixpk= 1571, nxpk= 20, iat= 872, 919, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 LYS  HN          121 LEU  HA          3.50    (#   1573:20  Unique         2.21, 2.32 A)
 &rst
  ixpk= 1573, nxpk= 20, iat=1774,1757, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 LEU  HN           40 LEU  HA          4.50    (#   1574:20  Unique         3.17, 3.19 A)
 &rst
  ixpk= 1574, nxpk= 20, iat= 579, 562, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 LEU  HN           40 LEU  HA          4.50    (#   1575:20  Unique         2.94, 2.95 A)
 &rst
  ixpk= 1575, nxpk= 20, iat= 560, 562, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 HIS  HN           36 LEU  HA          4.50    (#   1576:20  Unique         2.24, 2.28 A)
 &rst
  ixpk= 1576, nxpk= 20, iat= 522, 505, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  115 LYS  HN          114 ALA  HA          3.50    (#   1577:20  Unique         2.22, 2.31 A)
 &rst
  ixpk= 1577, nxpk= 20, iat=1666,1658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ALA  HN          114 ALA  HA          5.50    (#   1578:20  Unique         2.84, 2.86 A)
 &rst
  ixpk= 1578, nxpk= 20, iat=1656,1658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 ALA  HN           29 ALA  HA          4.50    (#   1579:20  Unique         2.79, 2.81 A)
 &rst
  ixpk= 1579, nxpk= 20, iat= 409, 411, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   83 VAL  HN            0 AMB  20-1:1580   5.50    (#   1580:20  Single Ambig)
 &rst
  ixpk= 1580, nxpk= 20, iat=1197,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1189,1658,
 &end
#
#   46 ALA  HN           46 ALA  HA          4.50    (#   1581:20  Unique         2.89, 2.90 A)
 &rst
  ixpk= 1581, nxpk= 20, iat= 658, 660, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   47 SER  HN           46 ALA  HA          4.50    (#   1583:20  Unique         2.67, 2.69 A)
 &rst
  ixpk= 1583, nxpk= 20, iat= 668, 660, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 ASP  HN            2 ALA  HA          4.50    (#   1584:20  Unique         2.52, 2.62 A)
 &rst
  ixpk= 1584, nxpk= 20, iat=  31,  23, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 LYS  HN           78 PRO  HD+         4.50    (#   1585:20  Unique         2.65, 2.87 A)
 &rst
  ixpk= 1585, nxpk= 20, iat=1109,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1132,1133,
 &end
#
#   67 SER  HN           68 PRO  HD+         5.50    (#   1586:20  Unique         1.73, 2.40 A)
 &rst
  ixpk= 1586, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 962, 963,
 &end
#
#    0 AMB  20-2:1587    38 GLY  HA-         5.50    (#   1587:20  Single Ambig)
 &rst
  ixpk= 1587, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 539, 547, 548, 547, 548,
 igr2= 541, 542,
 &end
#
#  140 GLY  HN          140 GLY  HA+         4.50    (#   1588:20  Unique         2.29, 2.56 A)
 &rst
  ixpk= 1588, nxpk= 20, iat=2065,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2067,2068,
 &end
#
#  140 GLY  HN          140 GLY  HA-         4.50    (#   1589:20  Unique         2.29, 2.56 A)
 &rst
  ixpk= 1589, nxpk= 20, iat=2065,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2067,2068,
 &end
#
#    0 AMB  20-2:1591     0 AMB  20-1:1591   5.50    (#   1591:20  Double Ambig)
 &rst
  ixpk= 1591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 843, 836,
 igr2= 838, 839, 838, 839,
 &end
#
#   30 GLY  HN           30 GLY  HA+         4.50    (#   1592:20  Unique         2.59, 2.77 A)
 &rst
  ixpk= 1592, nxpk= 20, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 421, 422,
 &end
#
#    0 AMB  20-2:1593    48 GLY  HA-         3.50    (#   1593:20  Single Ambig)
 &rst
  ixpk= 1593, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 686, 679,
 igr2= 681, 682,
 &end
#
#  113 GLY  HN          113 GLY  HA+         4.50    (#   1594:20  Unique         2.57, 2.77 A)
 &rst
  ixpk= 1594, nxpk= 20, iat=1649,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1651,1652,
 &end
#
#  118 GLY  HN          118 GLY  HA+         4.50    (#   1595:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1595, nxpk= 20, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1721,1722,
 &end
#
#  119 GLU  HN          118 GLY  HA-         4.50    (#   1596:20  Unique         2.14, 2.75 A)
 &rst
  ixpk= 1596, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1721,1722,
 &end
#
#  119 GLU  HN          118 GLY  HA+         4.50    (#   1597:20  Unique         2.14, 2.75 A)
 &rst
  ixpk= 1597, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1721,1722,
 &end
#
#  118 GLY  HN          118 GLY  HA-         5.50    (#   1598:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1598, nxpk= 20, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1721,1722,
 &end
#
#   69 PHE  HN           69 PHE  HB+         5.50    (#   1599:20  Unique         2.10, 2.60 A)
 &rst
  ixpk= 1599, nxpk= 20, iat= 975,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#   89 GLY  HN           89 GLY  HA-         7.00    (#   1600:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1600, nxpk= 20, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1295,1296,
 &end
#
#    6 LEU  HN            6 LEU  MDY         4.50    (#   1601:20  Unique         2.94, 4.67 A)
 &rst
  ixpk= 1601, nxpk= 20, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HN            5 THR  MG2         5.50    (#   1602:20  Unique         4.02, 4.67 A)
 &rst
  ixpk= 1602, nxpk= 20, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  68,  69,  70,
 &end
#
#   50 TRP  HN           49 ILE  MG2         4.50    (#   1604:20  Unique         2.64, 3.71 A)
 &rst
  ixpk= 1604, nxpk= 20, iat= 705,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 692, 693, 694,
 &end
#
#   89 GLY  HN           88 ILE  MG2         5.50    (#   1605:20  Unique         2.55, 3.95 A)
 &rst
  ixpk= 1605, nxpk= 20, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1280,1281,1282,
 &end
#
#   33 THR  MG2          33 THR  HA          3.50    (#   1609:20  Unique         2.57, 3.28 A)
 &rst
  ixpk= 1609, nxpk= 20, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 466, 467, 468,
 &end
#
#    0 AMB  20-2:1610    33 THR  HA          5.50    (#   1610:20  Single Ambig)
 &rst
  ixpk= 1610, nxpk= 20, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=  49,  50,  51,  85,  86,  87,  89,  90,  91,  85,
        86,  87,  89,  90,  91,
 &end
#
#   84 ARG  HG+          49 ILE  HA          5.50    (#   1611:20  Unique         2.20, 3.40 A)
 &rst
  ixpk= 1611, nxpk= 20, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1220,1221,
 &end
#
#   33 THR  HB           33 THR  HA          3.50    (#   1612:20  Unique         2.32, 2.34 A)
 &rst
  ixpk= 1612, nxpk= 20, iat= 464, 462, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ILE  MG2          49 ILE  HA          3.50    (#   1613:20  Unique         2.09, 2.94 A)
 &rst
  ixpk= 1613, nxpk= 20, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 692, 693, 694,
 &end
#
#   49 ILE  MD1          49 ILE  HA          5.50    (#   1614:20  Unique         2.03, 3.12 A)
 &rst
  ixpk= 1614, nxpk= 20, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 699, 700, 701,
 &end
#
#   90 ILE  HB           55 SER  HA          5.50    (#   1615:20  Unique         5.34, 5.51 A)
 &rst
  ixpk= 1615, nxpk= 20, iat=1304, 796, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   85 PHE  HB+          85 PHE  HA          4.50    (#   1616:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 1616, nxpk= 20, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1241,1242,
 &end
#
#   85 PHE  HB-          85 PHE  HA          4.50    (#   1617:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 1617, nxpk= 20, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1241,1242,
 &end
#
#   84 ARG  HB+          84 ARG  HA          3.50    (#   1618:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 1618, nxpk= 20, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1217,1218,
 &end
#
#    0 AMB  20-2:1619    84 ARG  HA          3.50    (#   1619:20  Single Ambig)
 &rst
  ixpk= 1619, nxpk= 20, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1217,1218,1220,1221,
 &end
#
#   50 TRP  HB+          50 TRP  HA          4.50    (#   1620:20  Unique         2.57, 2.80 A)
 &rst
  ixpk= 1620, nxpk= 20, iat=  -1, 707, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 709, 710,
 &end
#
#   50 TRP  HB-          50 TRP  HA          4.50    (#   1621:20  Unique         2.57, 2.80 A)
 &rst
  ixpk= 1621, nxpk= 20, iat=  -1, 707, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 709, 710,
 &end
#
#    0 AMB  20-2:1622    87 ALA  HA          3.50    (#   1622:20  Single Ambig)
 &rst
  ixpk= 1622, nxpk= 20, iat=  -1,1266, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1268,1269,1270,1310,1311,
 &end
#
#   52 VAL  HB           87 ALA  HA          5.50    (#   1623:20  Unique         4.94, 5.11 A)
 &rst
  ixpk= 1623, nxpk= 20, iat= 752,1266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    4 ILE  HN           33 THR  HA          4.50    (#   1628:20  Unique         2.40, 2.44 A)
 &rst
  ixpk= 1628, nxpk= 20, iat=  43, 462, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 GLU  HN           33 THR  HA          3.50    (#   1629:20  Unique         2.28, 2.29 A)
 &rst
  ixpk= 1629, nxpk= 20, iat= 474, 462, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 GLY  HN           85 PHE  HA          4.50    (#   1632:20  Unique         2.19, 2.27 A)
 &rst
  ixpk= 1632, nxpk= 20, iat=1257,1239, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  115 LYS  HN           84 ARG  HA          4.50    (#   1633:20  Unique         1.94, 2.24 A)
 &rst
  ixpk= 1633, nxpk= 20, iat=1666,1215, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   85 PHE  HN           84 ARG  HA          4.50    (#   1634:20  Unique         2.33, 2.43 A)
 &rst
  ixpk= 1634, nxpk= 20, iat=1237,1215, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 LEU  HN           50 TRP  HA          3.50    (#   1635:20  Unique         2.15, 2.15 A)
 &rst
  ixpk= 1635, nxpk= 20, iat= 729, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 TRP  HD1          50 TRP  HA          4.50    (#   1636:20  Unique         2.43, 2.60 A)
 &rst
  ixpk= 1636, nxpk= 20, iat= 713, 707, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 THR  HN           50 TRP  HA          7.00    (#   1637:20  Unique         3.27, 3.35 A)
 &rst
  ixpk= 1637, nxpk= 20, iat=  62, 707, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   52 VAL  HN           87 ALA  HA          5.50    (#   1638:20  Unique         3.21, 3.49 A)
 &rst
  ixpk= 1638, nxpk= 20, iat= 748,1266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   88 ILE  HN           87 ALA  HA          3.50    (#   1640:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1640, nxpk= 20, iat=1274,1266, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 THR  HA           33 THR  HB          4.50    (#   1644:20  Unique         2.32, 2.34 A)
 &rst
  ixpk= 1644, nxpk= 20, iat= 462, 464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 THR  HA           56 THR  HB          5.50    (#   1645:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 1645, nxpk= 20, iat= 807, 809, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 THR  HA           32 THR  HB          3.50    (#   1647:20  Unique         2.58, 2.58 A)
 &rst
  ixpk= 1647, nxpk= 20, iat= 448, 450, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1649     0 AMB  20-1:1649   4.50    (#   1649:20  Double Ambig)
 &rst
  ixpk= 1649, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1411, 145,
 igr2=1413, 147,
 &end
#
#   50 TRP  HA            5 THR  HB          5.50    (#   1653:20  Unique         4.45, 4.50 A)
 &rst
  ixpk= 1653, nxpk= 20, iat= 707,  66, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 TRP  HD1           5 THR  HB          5.50    (#   1654:20  Unique         4.40, 4.73 A)
 &rst
  ixpk= 1654, nxpk= 20, iat= 713,  66, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 THR  HA           11 THR  HB          4.50    (#   1656:20  Unique         2.38, 2.50 A)
 &rst
  ixpk= 1656, nxpk= 20, iat= 145, 147, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 THR  HA           35 THR  HB          4.50    (#   1659:20  Unique         3.00, 3.00 A)
 &rst
  ixpk= 1659, nxpk= 20, iat= 491, 493, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 VAL  HN           18 VAL  HA          5.50    (#   1660:20  Unique         2.91, 2.92 A)
 &rst
  ixpk= 1660, nxpk= 20, iat= 236, 238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 PRO  HG-          68 PRO  HA          4.50    (#   1661:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 1661, nxpk= 20, iat=  -1, 971, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 965, 966,
 &end
#
#  146 LEU  HG          143 VAL  HA          4.50    (#   1662:20  Unique         2.88, 3.18 A)
 &rst
  ixpk= 1662, nxpk= 20, iat=2163,2109, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1663   143 VAL  HA          5.50    (#   1663:20  Single Ambig)
 &rst
  ixpk= 1663, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2160,2161,2185,2186,
 &end
#
#   19 ALA  MB            0 AMB  20-1:1664   5.50    (#   1664:20  Single Ambig)
 &rst
  ixpk= 1664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 256, 257, 258,
 igr2= 118, 119, 118, 119,
 &end
#
#   90 ILE  MG2          92 SER  HB-         4.50    (#   1665:20  Unique         2.43, 4.48 A)
 &rst
  ixpk= 1665, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1306,1307,1308,
 igr2=1330,1331,
 &end
#
#   92 SER  HA           92 SER  HB-         5.50    (#   1667:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 1667, nxpk= 20, iat=1328,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1330,1331,
 &end
#
#   47 SER  HA           47 SER  HB-         3.50    (#   1668:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 1668, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 672, 673,
 &end
#
#   47 SER  HA           47 SER  HB+         3.50    (#   1669:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 1669, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 672, 673,
 &end
#
#   92 SER  HA           92 SER  HB+         5.50    (#   1671:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 1671, nxpk= 20, iat=1328,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1330,1331,
 &end
#
#   47 SER  HN           47 SER  HB+         7.00    (#   1672:20  Unique         3.26, 3.66 A)
 &rst
  ixpk= 1672, nxpk= 20, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 672, 673,
 &end
#
#  112 SER  HA          112 SER  HB-         4.50    (#   1674:20  Unique         2.35, 2.46 A)
 &rst
  ixpk= 1674, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1642,1643,
 &end
#
#   80 LEU  MDY         112 SER  HB+         4.50    (#   1677:20  Unique         2.07, 4.79 A)
 &rst
  ixpk= 1677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1166,1167,1168,1170,1171,1172,
 igr2=1642,1643,
 &end
#
#    0 AMB  20-2:1678     0 AMB  20-1:1678   5.50    (#   1678:20  Double Ambig)
 &rst
  ixpk= 1678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1161,1162,1116,1117,1587,1588,
 igr2=1642,1643,1642,1643,1642,1643,
 &end
#
#  109 LEU  HA          112 SER  HB+         7.00    (#   1679:20  Unique         2.99, 3.95 A)
 &rst
  ixpk= 1679, nxpk= 20, iat=1585,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1642,1643,
 &end
#
#  112 SER  HA          112 SER  HB+         3.50    (#   1680:20  Unique         2.35, 2.46 A)
 &rst
  ixpk= 1680, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1642,1643,
 &end
#
#  131 PRO  HB+         131 PRO  HA          5.50    (#   1685:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1685, nxpk= 20, iat=  -1,1937, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1934,1935,
 &end
#
#    0 AMB  20-2:1687    81 SER  HB-         5.50    (#   1687:20  Single Ambig)
 &rst
  ixpk= 1687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1189,1159,
 igr2=1180,1181,
 &end
#
#  141 SER  HA          141 SER  HB-         3.50    (#   1688:20  Unique         2.26, 2.77 A)
 &rst
  ixpk= 1688, nxpk= 20, iat=2074,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2076,2077,
 &end
#
#  141 SER  HA          141 SER  HB+         3.50    (#   1689:20  Unique         2.26, 2.77 A)
 &rst
  ixpk= 1689, nxpk= 20, iat=2074,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2076,2077,
 &end
#
#   81 SER  HA           81 SER  HB-         3.50    (#   1691:20  Unique         2.42, 2.80 A)
 &rst
  ixpk= 1691, nxpk= 20, iat=1178,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1180,1181,
 &end
#
#   81 SER  HA           81 SER  HB+         4.50    (#   1692:20  Unique         2.42, 2.80 A)
 &rst
  ixpk= 1692, nxpk= 20, iat=1178,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1180,1181,
 &end
#
#  142 TRP  HB+         142 TRP  HA          5.50    (#   1694:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 1694, nxpk= 20, iat=  -1,2085, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2087,2088,
 &end
#
#   11 THR  HB           11 THR  HA          3.50    (#   1695:20  Unique         2.38, 2.50 A)
 &rst
  ixpk= 1695, nxpk= 20, iat= 147, 145, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  142 TRP  HD1         142 TRP  HA          4.50    (#   1697:20  Unique         2.84, 2.90 A)
 &rst
  ixpk= 1697, nxpk= 20, iat=2091,2085, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1698     0 AMB  20-1:1698   4.50    (#   1698:20  Double Ambig)
 &rst
  ixpk= 1698, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 965, 966,1135,1136,
 igr2= 145,1141,
 &end
#
#  117 THR  HN          117 THR  HA          7.00    (#   1700:20  Unique         2.86, 2.91 A)
 &rst
  ixpk= 1700, nxpk= 20, iat=1705,1707, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  117 THR  HB          117 THR  HA          7.00    (#   1702:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 1702, nxpk= 20, iat=1709,1707, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  118 GLY  HA+         117 THR  HA          7.00    (#   1703:20  Unique         4.37, 4.42 A)
 &rst
  ixpk= 1703, nxpk= 20, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1721,1722,
 &end
#
#   78 PRO  HB-          78 PRO  HA          5.50    (#   1704:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1704, nxpk= 20, iat=  -1,1141, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1138,1139,
 &end
#
#    0 AMB  20-2:1705    52 VAL  HA          5.50    (#   1705:20  Single Ambig)
 &rst
  ixpk= 1705, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1287,1288,1289, 101, 102, 103,
 &end
#
#   11 THR  HA            0 AMB  20-1:1708   3.50    (#   1708:20  Single Ambig)
 &rst
  ixpk= 1708, nxpk= 20, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 954, 955, 954, 955,
 &end
#
#   11 THR  HA            0 AMB  20-1:1709   3.50    (#   1709:20  Single Ambig)
 &rst
  ixpk= 1709, nxpk= 20, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 954, 955, 954, 955,
 &end
#
#   68 PRO  HD-           0 AMB  20-1:1710   7.00    (#   1710:20  Single Ambig)
 &rst
  ixpk= 1710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 962, 963,
 igr2= 954, 955, 954, 955,
 &end
#
#  113 GLY  HA-          81 SER  HA          7.00    (#   1712:20  Unique         3.26, 3.67 A)
 &rst
  ixpk= 1712, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1651,1652,
 &end
#
#    0 AMB  20-2:1713    81 SER  HA          4.50    (#   1713:20  Single Ambig)
 &rst
  ixpk= 1713, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1658,1189,1159,
 &end
#
#   82 ALA  HN           81 SER  HA          7.00    (#   1715:20  Unique         3.18, 3.28 A)
 &rst
  ixpk= 1715, nxpk= 20, iat=1187,1178, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   70 TYR  HB+          70 TYR  HA          5.50    (#   1716:20  Unique         2.23, 2.56 A)
 &rst
  ixpk= 1716, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 999,1000,
 &end
#
#    0 AMB  20-2:1717    70 TYR  HA          7.00    (#   1717:20  Single Ambig)
 &rst
  ixpk= 1717, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1041,1031,
 &end
#
#   70 TYR  HN           70 TYR  HA          7.00    (#   1718:20  Unique         2.76, 2.77 A)
 &rst
  ixpk= 1718, nxpk= 20, iat= 995, 997, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   73 LEU  HB+          70 TYR  HA          7.00    (#   1719:20  Unique         2.09, 3.04 A)
 &rst
  ixpk= 1719, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1045,1046,
 &end
#
#    0 AMB  20-2:1722     0 AMB  20-1:1722   4.50    (#   1722:20  Double Ambig)
 &rst
  ixpk= 1722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2022, 975,
 igr2=2024, 977,
 &end
#
#   72 ALA  HN           69 PHE  HA          7.00    (#   1723:20  Unique         3.77, 3.86 A)
 &rst
  ixpk= 1723, nxpk= 20, iat=1031, 977, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  124 ASN  HN          123 ILE  HA          4.50    (#   1724:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 1724, nxpk= 20, iat=1815,1798, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   69 PHE  HA           70 TYR  HA          5.50    (#   1725:20  Unique         4.77, 4.78 A)
 &rst
  ixpk= 1725, nxpk= 20, iat= 977, 997, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 ASN  HN          141 SER  HA          7.00    (#   1726:20  Unique         3.53, 3.70 A)
 &rst
  ixpk= 1726, nxpk= 20, iat=2123,2074, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  123 ILE  MD1         123 ILE  HA          5.50    (#   1727:20  Unique         3.88, 4.54 A)
 &rst
  ixpk= 1727, nxpk= 20, iat=  -1,1798, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1809,1810,1811,
 &end
#
#    0 AMB  20-2:1728   141 SER  HA          5.50    (#   1728:20  Single Ambig)
 &rst
  ixpk= 1728, nxpk= 20, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2139,2009,
 &end
#
#    0 AMB  20-2:1729   136 GLU  HA          7.00    (#   1729:20  Single Ambig)
 &rst
  ixpk= 1729, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3=10.99, r4=11.49,
 igr1=1764,1765,1766,1768,1769,1770,1802,1803,1804, 303,
       304, 305, 307, 308, 309,
 &end
#
#    0 AMB  20-2:1730   136 GLU  HA          7.00    (#   1730:20  Single Ambig)
 &rst
  ixpk= 1730, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
      1769,1770,
 &end
#
#    0 AMB  20-2:1731   136 GLU  HA          7.00    (#   1731:20  Single Ambig)
 &rst
  ixpk= 1731, nxpk= 20, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2046, 287,
 &end
#
#   84 ARG  HN           49 ILE  HA          5.50    (#   1732:20  Unique         2.78, 3.15 A)
 &rst
  ixpk= 1732, nxpk= 20, iat=1213, 688, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 TRP  HN           49 ILE  HA          3.50    (#   1733:20  Unique         2.14, 2.14 A)
 &rst
  ixpk= 1733, nxpk= 20, iat= 705, 688, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 THR  HN           33 THR  HA          7.00    (#   1735:20  Unique         2.93, 2.93 A)
 &rst
  ixpk= 1735, nxpk= 20, iat= 460, 462, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    7 ILE  HB            7 ILE  HA          7.00    (#   1736:20  Unique         2.98, 2.98 A)
 &rst
  ixpk= 1736, nxpk= 20, iat=  99,  97, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1740   110 LYS  HA          7.00    (#   1740:20  Single Ambig)
 &rst
  ixpk= 1740, nxpk= 20, iat=  -1,1604, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1656,1638,
 &end
#
#   89 GLY  HN           88 ILE  HA          3.50    (#   1741:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1741, nxpk= 20, iat=1293,1276, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 LYS  HN          104 LYS  HA          5.50    (#   1743:20  Unique         2.70, 2.75 A)
 &rst
  ixpk= 1743, nxpk= 20, iat=1502,1504, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 GLN  HB-          74 GLN  HA          4.50    (#   1747:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 1747, nxpk= 20, iat=  -1,1062, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1064,1065,
 &end
#
#    0 AMB  20-2:1748    71 GLU  HA          7.00    (#   1748:20  Single Ambig)
 &rst
  ixpk= 1748, nxpk= 20, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1031,1041,
 &end
#
#   74 GLN  HN           71 GLU  HA          5.50    (#   1749:20  Unique         3.94, 4.06 A)
 &rst
  ixpk= 1749, nxpk= 20, iat=1060,1018, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 HIS  HD2          21 HIS  HA          5.50    (#   1752:20  Unique         2.66, 3.29 A)
 &rst
  ixpk= 1752, nxpk= 20, iat= 290, 279, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 GLU  HB-          21 HIS  HA          7.00    (#   1754:20  Unique         2.73, 3.17 A)
 &rst
  ixpk= 1754, nxpk= 20, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 327, 328,
 &end
#
#  105 LEU  MDX         105 LEU  HA          7.00    (#   1755:20  Unique         1.96, 3.17 A)
 &rst
  ixpk= 1755, nxpk= 20, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#   41 LEU  HB-          41 LEU  HA          4.50    (#   1756:20  Unique         2.61, 2.84 A)
 &rst
  ixpk= 1756, nxpk= 20, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 583, 584,
 &end
#
#   41 LEU  HN           41 LEU  HA          5.50    (#   1757:20  Unique         2.28, 2.28 A)
 &rst
  ixpk= 1757, nxpk= 20, iat= 579, 581, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1758    74 GLN  HA          4.50    (#   1758:20  Single Ambig)
 &rst
  ixpk= 1758, nxpk= 20, iat=  -1,1062, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1094,
 &end
#
#  109 LEU  HG          109 LEU  HA          7.00    (#   1762:20  Unique         3.15, 3.23 A)
 &rst
  ixpk= 1762, nxpk= 20, iat=1590,1585, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  112 SER  HB-         109 LEU  HA          5.50    (#   1763:20  Unique         2.99, 3.95 A)
 &rst
  ixpk= 1763, nxpk= 20, iat=  -1,1585, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1642,1643,
 &end
#
#  109 LEU  HN          109 LEU  HA          7.00    (#   1764:20  Unique         2.76, 2.78 A)
 &rst
  ixpk= 1764, nxpk= 20, iat=1583,1585, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1765     0 AMB  20-1:1765   4.50    (#   1765:20  Double Ambig)
 &rst
  ixpk= 1765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2053, 367, 342, 343,1064,1065,
 igr2= 362,1079,
 &end
#
#   44 LEU  HN           42 GLU  HA          7.00    (#   1766:20  Unique         3.30, 3.31 A)
 &rst
  ixpk= 1766, nxpk= 20, iat= 625, 600, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1768    41 LEU  HA          7.00    (#   1768:20  Single Ambig)
 &rst
  ixpk= 1768, nxpk= 20, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 613,1104,1105,
 &end
#
#   73 LEU  MDY          73 LEU  HA          7.00    (#   1769:20  Unique         1.92, 3.76 A)
 &rst
  ixpk= 1769, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HB+          73 LEU  HA          5.50    (#   1770:20  Unique         2.58, 2.79 A)
 &rst
  ixpk= 1770, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1045,1046,
 &end
#
#   74 GLN  HN           73 LEU  HA          7.00    (#   1772:20  Unique         3.57, 3.57 A)
 &rst
  ixpk= 1772, nxpk= 20, iat=1060,1043, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   73 LEU  HG           73 LEU  HA          7.00    (#   1773:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 1773, nxpk= 20, iat=1048,1043, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  147 LYS  HB+         147 LYS  HA          4.50    (#   1774:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 1774, nxpk= 20, iat=  -1,2177, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2179,2180,
 &end
#
#  147 LYS  HG+         147 LYS  HA          4.50    (#   1775:20  Unique         2.15, 2.54 A)
 &rst
  ixpk= 1775, nxpk= 20, iat=  -1,2177, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2182,2183,
 &end
#
#   56 THR  HN           55 SER  HA          5.50    (#   1776:20  Unique         2.14, 2.14 A)
 &rst
  ixpk= 1776, nxpk= 20, iat= 805, 796, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 LEU  HN           22 LEU  HA          7.00    (#   1778:20  Unique         2.75, 2.76 A)
 &rst
  ixpk= 1778, nxpk= 20, iat= 294, 296, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   28 GLU  HN           25 LYS  HA          7.00    (#   1779:20  Unique         3.20, 3.35 A)
 &rst
  ixpk= 1779, nxpk= 20, iat= 394, 340, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  105 LEU  MDY         103 ASP  HA          7.00    (#   1780:20  Unique         6.15, 7.55 A)
 &rst
  ixpk= 1780, nxpk= 20, iat=  -1,1492, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#   77 LYS  HN           76 GLN  HA          5.50    (#   1781:20  Unique         3.54, 3.55 A)
 &rst
  ixpk= 1781, nxpk= 20, iat=1109,1094, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 PRO  HD-          77 LYS  HA          5.50    (#   1783:20  Unique         2.19, 2.64 A)
 &rst
  ixpk= 1783, nxpk= 20, iat=  -1,1111, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1132,1133,
 &end
#
#   97 THR  HN           96 ASP  HA          7.00    (#   1784:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 1784, nxpk= 20, iat=1409,1399, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1785    96 ASP  HA          5.50    (#   1785:20  Single Ambig)
 &rst
  ixpk= 1785, nxpk= 20, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1397,1423,
 &end
#
#  116 GLN  HG+         116 GLN  HA          5.50    (#   1786:20  Unique         2.34, 2.83 A)
 &rst
  ixpk= 1786, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1695,1696,
 &end
#
#  145 LEU  HN          145 LEU  HA          5.50    (#   1787:20  Unique         2.81, 2.86 A)
 &rst
  ixpk= 1787, nxpk= 20, iat=2137,2139, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1788   145 LEU  HA          7.00    (#   1788:20  Single Ambig)
 &rst
  ixpk= 1788, nxpk= 20, iat=  -1,2139, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2156,2175,
 &end
#
#    0 AMB  20-2:1789   144 ASN  HA          5.50    (#   1789:20  Single Ambig)
 &rst
  ixpk= 1789, nxpk= 20, iat=  -1,2125, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2137,2132,2133,
 &end
#
#    0 AMB  20-2:1790     0 AMB  20-1:1790   5.50    (#   1790:20  Double Ambig)
 &rst
  ixpk= 1790, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 625,1824,1825,
 igr2= 615,1898,
 &end
#
#  110 LYS  HN          107 ALA  HA          7.00    (#   1792:20  Unique         3.85, 3.89 A)
 &rst
  ixpk= 1792, nxpk= 20, iat=1602,1560, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1793   107 ALA  HA          5.50    (#   1793:20  Single Ambig)
 &rst
  ixpk= 1793, nxpk= 20, iat=  -1,1560, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1612,1613,1612,1613,
 &end
#
#   83 VAL  MGY          85 PHE  HA          7.00    (#   1794:20  Unique         4.40, 5.89 A)
 &rst
  ixpk= 1794, nxpk= 20, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:1795    85 PHE  HA          5.50    (#   1795:20  Single Ambig)
 &rst
  ixpk= 1795, nxpk= 20, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1245,1253,1237,
 &end
#
#   50 TRP  HN           85 PHE  HA          5.50    (#   1796:20  Unique         3.03, 3.23 A)
 &rst
  ixpk= 1796, nxpk= 20, iat= 705,1239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 GLU  HG+          72 ALA  HA          7.00    (#   1798:20  Unique         3.77, 4.25 A)
 &rst
  ixpk= 1798, nxpk= 20, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1084,1085,
 &end
#
#   13 GLY  HA+          12 LEU  HA          7.00    (#   1800:20  Unique         4.31, 4.55 A)
 &rst
  ixpk= 1800, nxpk= 20, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 178, 179,
 &end
#
#    9 GLY  HA-          12 LEU  HA          4.50    (#   1801:20  Unique         3.19, 4.41 A)
 &rst
  ixpk= 1801, nxpk= 20, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 127, 128,
 &end
#
#   75 GLU  HN           72 ALA  HA          5.50    (#   1802:20  Unique         3.26, 3.29 A)
 &rst
  ixpk= 1802, nxpk= 20, iat=1077,1033, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 GLY  HN           12 LEU  HA          5.50    (#   1803:20  Unique         2.28, 2.59 A)
 &rst
  ixpk= 1803, nxpk= 20, iat= 176, 159, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 GLN  HN           72 ALA  HA          5.50    (#   1805:20  Unique         3.74, 3.77 A)
 &rst
  ixpk= 1805, nxpk= 20, iat=1092,1033, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 TYR  HB-          65 ASN  HA          7.00    (#   1808:20  Unique         5.70, 7.12 A)
 &rst
  ixpk= 1808, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 999,1000,
 &end
#
#   64 ASP  HA           65 ASN  HA          7.00    (#   1809:20  Unique         4.72, 4.82 A)
 &rst
  ixpk= 1809, nxpk= 20, iat= 907, 919, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   60 GLY  HA-          65 ASN  HA          7.00    (#   1810:20  Unique         2.47, 3.44 A)
 &rst
  ixpk= 1810, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 855, 856,
 &end
#
#    0 AMB  20-2:1811    65 ASN  HA          7.00    (#   1811:20  Single Ambig)
 &rst
  ixpk= 1811, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1= 885, 886, 887,1477,1478,1479,1484,1485,1486,
 &end
#
#   83 VAL  MGY          84 ARG  HA          7.00    (#   1814:20  Unique         4.20, 5.11 A)
 &rst
  ixpk= 1814, nxpk= 20, iat=  -1,1215, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#  121 LEU  HB-         121 LEU  HA          5.50    (#   1815:20  Unique         2.49, 2.80 A)
 &rst
  ixpk= 1815, nxpk= 20, iat=  -1,1757, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1759,1760,
 &end
#
#   80 LEU  MDX          80 LEU  HA          3.50    (#   1816:20  Unique         1.91, 3.41 A)
 &rst
  ixpk= 1816, nxpk= 20, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   80 LEU  HB-          80 LEU  HA          4.50    (#   1817:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 1817, nxpk= 20, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1161,1162,
 &end
#
#    0 AMB  20-2:1821    36 LEU  HA          7.00    (#   1821:20  Single Ambig)
 &rst
  ixpk= 1821, nxpk= 20, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 560, 262,
 &end
#
#    0 AMB  20-2:1822    50 TRP  HA          7.00    (#   1822:20  Single Ambig)
 &rst
  ixpk= 1822, nxpk= 20, iat=  -1, 707, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  49,  50,  51, 692, 693, 694,
 &end
#
#    0 AMB  20-2:1823    50 TRP  HA          7.00    (#   1823:20  Single Ambig)
 &rst
  ixpk= 1823, nxpk= 20, iat=  -1, 707, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=  66, 681, 682,
 &end
#
#   50 TRP  HD1          50 TRP  HA          4.50    (#   1824:20  Unique         2.43, 2.60 A)
 &rst
  ixpk= 1824, nxpk= 20, iat= 713, 707, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 TRP  HN           50 TRP  HA          7.00    (#   1825:20  Unique         2.91, 2.93 A)
 &rst
  ixpk= 1825, nxpk= 20, iat= 705, 707, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    5 THR  HB           50 TRP  HA          7.00    (#   1826:20  Unique         4.45, 4.50 A)
 &rst
  ixpk= 1826, nxpk= 20, iat=  66, 707, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1829   114 ALA  HA          5.50    (#   1829:20  Single Ambig)
 &rst
  ixpk= 1829, nxpk= 20, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1670,1671,1217,1218,
 &end
#
#   82 ALA  MB           82 ALA  HA          2.80    (#   1830:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1830, nxpk= 20, iat=  -1,1189, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1191,1192,1193,
 &end
#
#   81 SER  HA          114 ALA  HA          5.50    (#   1832:20  Unique         3.36, 3.93 A)
 &rst
  ixpk= 1832, nxpk= 20, iat=1178,1658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 PRO  HD-          44 LEU  HA          4.50    (#   1833:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 1833, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 645, 646,
 &end
#
#   30 GLY  HN           29 ALA  HA          5.50    (#   1835:20  Unique         3.48, 3.48 A)
 &rst
  ixpk= 1835, nxpk= 20, iat= 419, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ALA  MB          114 ALA  HA          3.50    (#   1836:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 1836, nxpk= 20, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1660,1661,1662,
 &end
#
#   44 LEU  MDX          44 LEU  HA          4.50    (#   1837:20  Unique         2.00, 3.65 A)
 &rst
  ixpk= 1837, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#    0 AMB  20-2:1839     0 AMB  20-1:1839   4.50    (#   1839:20  Double Ambig)
 &rst
  ixpk= 1839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 629, 630,2113,2114,2115,2117,2118,2119,
 igr2= 627, 411,
 &end
#
#   44 LEU  HB-          46 ALA  HA          7.00    (#   1840:20  Unique         6.05, 6.16 A)
 &rst
  ixpk= 1840, nxpk= 20, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 629, 630,
 &end
#
#   83 VAL  HN           82 ALA  HA          4.50    (#   1841:20  Unique         3.34, 3.40 A)
 &rst
  ixpk= 1841, nxpk= 20, iat=1197,1189, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ALA  HN           82 ALA  HA          5.50    (#   1842:20  Unique         2.94, 2.95 A)
 &rst
  ixpk= 1842, nxpk= 20, iat=1187,1189, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1846    87 ALA  HA          7.00    (#   1846:20  Single Ambig)
 &rst
  ixpk= 1846, nxpk= 20, iat=  -1,1266, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1287,1288,1289, 738, 739, 740, 742, 743, 744,
 &end
#
#   32 THR  HB            2 ALA  HA          7.00    (#   1847:20  Unique         2.29, 2.39 A)
 &rst
  ixpk= 1847, nxpk= 20, iat= 450,  23, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:1851     0 AMB  20-1:1851   4.50    (#   1851:20  Double Ambig)
 &rst
  ixpk= 1851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1910,1898,
 igr2=1928,1929,1928,1929,
 &end
#
#    0 AMB  20-2:1852    87 ALA  HA          7.00    (#   1852:20  Single Ambig)
 &rst
  ixpk= 1852, nxpk= 20, iat=  -1,1266, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1=1310,1311,1747,1748,1749,
 &end
#
#   52 VAL  MGX          87 ALA  HA          7.00    (#   1853:20  Unique         2.02, 4.13 A)
 &rst
  ixpk= 1853, nxpk= 20, iat=  -1,1266, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#   52 VAL  HB           87 ALA  HA          5.50    (#   1854:20  Unique         4.94, 5.11 A)
 &rst
  ixpk= 1854, nxpk= 20, iat= 752,1266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 ILE  MG2         131 PRO  HD+         5.50    (#   1855:20  Unique         1.90, 3.47 A)
 &rst
  ixpk= 1855, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1914,1915,1916,
 igr2=1928,1929,
 &end
#
#   78 PRO  HB-          78 PRO  HD-         5.50    (#   1860:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1860, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1138,1139,
 igr2=1132,1133,
 &end
#
#   73 LEU  HA           78 PRO  HD-         5.50    (#   1861:20  Unique         4.09, 4.38 A)
 &rst
  ixpk= 1861, nxpk= 20, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1132,1133,
 &end
#
#   77 LYS  HA           78 PRO  HD-         4.50    (#   1862:20  Unique         2.19, 2.64 A)
 &rst
  ixpk= 1862, nxpk= 20, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1132,1133,
 &end
#
#    0 AMB  20-2:1863     0 AMB  20-1:1863   5.50    (#   1863:20  Double Ambig)
 &rst
  ixpk= 1863, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1= 940, 941, 942, 944, 945, 946,1166,1167,1168,1170,
      1171,1172,1166,1167,1168,1170,1171,1172,
 igr2= 962, 963,1132,1133,1132,1133,
 &end
#
#    0 AMB  20-2:1864     0 AMB  20-1:1864   5.50    (#   1864:20  Double Ambig)
 &rst
  ixpk= 1864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1096,1097, 965, 966,
 igr2=1132,1133, 962, 963,
 &end
#
#   44 LEU  HA           45 PRO  HD+         3.50    (#   1865:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 1865, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 645, 646,
 &end
#
#   77 LYS  HN           78 PRO  HD+         4.50    (#   1866:20  Unique         2.65, 2.87 A)
 &rst
  ixpk= 1866, nxpk= 20, iat=1109,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1132,1133,
 &end
#
#   68 PRO  HG+          68 PRO  HD-         5.50    (#   1867:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1867, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 965, 966,
 igr2= 962, 963,
 &end
#
#   44 LEU  MDX          45 PRO  HD+         5.50    (#   1869:20  Unique         2.45, 4.38 A)
 &rst
  ixpk= 1869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 634, 635, 636, 638, 639, 640,
 igr2= 645, 646,
 &end
#
#   44 LEU  HB+          45 PRO  HD-         7.00    (#   1870:20  Unique         1.83, 3.33 A)
 &rst
  ixpk= 1870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 629, 630,
 igr2= 645, 646,
 &end
#
#   68 PRO  HG-          68 PRO  HD-         5.50    (#   1871:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1871, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 965, 966,
 igr2= 962, 963,
 &end
#
#   53 ILE  MD1          38 GLY  HA+         7.00    (#   1876:20  Unique         7.20, 8.22 A)
 &rst
  ixpk= 1876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 777, 778, 779,
 igr2= 541, 542,
 &end
#
#    0 AMB  20-2:1877     0 AMB  20-1:1877   7.00    (#   1877:20  Double Ambig)
 &rst
  ixpk= 1877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.34, r4=12.84,
 igr1= 539, 547, 548, 547, 548,
 igr2= 541, 542, 541, 542, 541, 542,
 &end
#
#  143 VAL  HB          140 GLY  HA-         5.50    (#   1878:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 1878, nxpk= 20, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2067,2068,
 &end
#
#  141 SER  HN          140 GLY  HA-         7.00    (#   1879:20  Unique         2.46, 3.04 A)
 &rst
  ixpk= 1879, nxpk= 20, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2067,2068,
 &end
#
#   56 THR  MG2          60 GLY  HA+         5.50    (#   1883:20  Unique         4.26, 5.80 A)
 &rst
  ixpk= 1883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 811, 812, 813,
 igr2= 855, 856,
 &end
#
#   30 GLY  HN           30 GLY  HA-         3.50    (#   1892:20  Unique         2.59, 2.77 A)
 &rst
  ixpk= 1892, nxpk= 20, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 421, 422,
 &end
#
#  114 ALA  HN          113 GLY  HA-         5.50    (#   1893:20  Unique         2.86, 3.21 A)
 &rst
  ixpk= 1893, nxpk= 20, iat=1656,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1651,1652,
 &end
#
#  114 ALA  HN          113 GLY  HA+         5.50    (#   1894:20  Unique         2.86, 3.21 A)
 &rst
  ixpk= 1894, nxpk= 20, iat=1656,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1651,1652,
 &end
#
#    0 AMB  20-2:1897     0 AMB  20-1:1897   3.50    (#   1897:20  Double Ambig)
 &rst
  ixpk= 1897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 686, 679,
 igr2= 681, 682, 681, 682,
 &end
#
#    0 AMB  20-2:1899   118 GLY  HA-         7.00    (#   1899:20  Single Ambig)
 &rst
  ixpk= 1899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1700,1701,1350,
 igr2=1721,1722,
 &end
#
#    0 AMB  20-2:1900     0 AMB  20-1:1900   7.00    (#   1900:20  Double Ambig)
 &rst
  ixpk= 1900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1159,1728,1640,
 igr2=1651,1652,1721,1722,1651,1652,
 &end
#
#    0 AMB  20-2:1901     0 AMB  20-1:1901   7.00    (#   1901:20  Double Ambig)
 &rst
  ixpk= 1901, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1180,1181,1180,1181,
 igr2=1651,1652,1651,1652,
 &end
#
#  142 TRP  HD1         118 GLY  HA+         7.00    (#   1903:20  Unique         2.00, 3.50 A)
 &rst
  ixpk= 1903, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1721,1722,
 &end
#
#  142 TRP  HD1         118 GLY  HA-         7.00    (#   1907:20  Unique         2.00, 3.50 A)
 &rst
  ixpk= 1907, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1721,1722,
 &end
#
#  109 LEU  MDY          85 PHE  HB-         7.00    (#   1916:20  Unique         3.90, 6.24 A)
 &rst
  ixpk= 1916, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1592,1593,1594,1596,1597,1598,
 igr2=1241,1242,
 &end
#
#   51 LEU  HA           51 LEU  HB+         7.00    (#   1918:20  Unique         2.43, 2.74 A)
 &rst
  ixpk= 1918, nxpk= 20, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 733, 734,
 &end
#
#    6 LEU  HA           51 LEU  HB+         7.00    (#   1919:20  Unique         2.46, 3.21 A)
 &rst
  ixpk= 1919, nxpk= 20, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 733, 734,
 &end
#
#   51 LEU  HN           51 LEU  HB+         7.00    (#   1920:20  Unique         2.47, 3.09 A)
 &rst
  ixpk= 1920, nxpk= 20, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 733, 734,
 &end
#
#   51 LEU  MDY          51 LEU  HB-         7.00    (#   1921:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 1921, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 733, 734,
 &end
#
#   51 LEU  MDX          51 LEU  HB-         5.50    (#   1922:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 1922, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2= 733, 734,
 &end
#
#   51 LEU  HA           51 LEU  HB-         7.00    (#   1923:20  Unique         2.43, 2.74 A)
 &rst
  ixpk= 1923, nxpk= 20, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 733, 734,
 &end
#
#   53 ILE  HB           89 GLY  HA-         7.00    (#   1931:20  Unique         6.14, 7.48 A)
 &rst
  ixpk= 1931, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1295,1296,
 &end
#
#   90 ILE  HA           89 GLY  HA+         5.50    (#   1933:20  Unique         4.44, 4.54 A)
 &rst
  ixpk= 1933, nxpk= 20, iat=1302,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1295,1296,
 &end
#
#  121 LEU  HB-          89 GLY  HA-         7.00    (#   1940:20  Unique         4.70, 6.10 A)
 &rst
  ixpk= 1940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1759,1760,
 igr2=1295,1296,
 &end
#
#   36 LEU  MDY          36 LEU  HB+         7.00    (#   1942:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 1942, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 507, 508,
 &end
#
#   36 LEU  MDY          36 LEU  HB-         7.00    (#   1943:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 1943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 507, 508,
 &end
#
#   36 LEU  MDX          36 LEU  HB-         5.50    (#   1944:20  Unique         2.03, 3.22 A)
 &rst
  ixpk= 1944, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 507, 508,
 &end
#
#    0 AMB  20-2:1945     0 AMB  20-1:1945   7.00    (#   1945:20  Double Ambig)
 &rst
  ixpk= 1945, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=  80,  81, 478, 479,
 igr2= 507, 508, 507, 508,
 &end
#
#    0 AMB  20-2:1946    36 LEU  HB-         7.00    (#   1946:20  Single Ambig)
 &rst
  ixpk= 1946, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=  80,  81, 478, 479,
 igr2= 507, 508,
 &end
#
#   36 LEU  HN           36 LEU  HB+         7.00    (#   1947:20  Unique         3.35, 3.65 A)
 &rst
  ixpk= 1947, nxpk= 20, iat= 503,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 507, 508,
 &end
#
#   51 LEU  HA           86 GLY  HA-         7.00    (#   1949:20  Unique         3.06, 3.99 A)
 &rst
  ixpk= 1949, nxpk= 20, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1259,1260,
 &end
#
#   86 GLY  HN           86 GLY  HA-         7.00    (#   1951:20  Unique         2.53, 2.76 A)
 &rst
  ixpk= 1951, nxpk= 20, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1259,1260,
 &end
#
#   51 LEU  MDY          86 GLY  HA-         5.50    (#   1953:20  Unique         2.42, 5.45 A)
 &rst
  ixpk= 1953, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2=1259,1260,
 &end
#
#    0 AMB  20-2:1954   110 LYS  HE-         4.50    (#   1954:20  Single Ambig)
 &rst
  ixpk= 1954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1609,1610,1692,1693,
 igr2=1615,1616,
 &end
#
#  116 GLN  HB-         110 LYS  HE-         7.00    (#   1955:20  Unique         2.00, 3.46 A)
 &rst
  ixpk= 1955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1692,1693,
 igr2=1615,1616,
 &end
#
#   87 ALA  HN           86 GLY  HA+         4.50    (#   1958:20  Unique         2.14, 2.73 A)
 &rst
  ixpk= 1958, nxpk= 20, iat=1264,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1259,1260,
 &end
#
#   51 LEU  HA           86 GLY  HA+         7.00    (#   1960:20  Unique         3.06, 3.99 A)
 &rst
  ixpk= 1960, nxpk= 20, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1259,1260,
 &end
#
#    0 AMB  20-2:1961     0 AMB  20-1:1961   7.00    (#   1961:20  Double Ambig)
 &rst
  ixpk= 1961, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1344,1345,1547,1548,
 igr2=1615,1616,1615,1616,
 &end
#
#    0 AMB  20-2:1962   110 LYS  HE-         5.50    (#   1962:20  Single Ambig)
 &rst
  ixpk= 1962, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1344,1345,1547,1548,
 igr2=1615,1616,
 &end
#
#  116 GLN  HB-         110 LYS  HE+         7.00    (#   1963:20  Unique         2.00, 3.46 A)
 &rst
  ixpk= 1963, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1692,1693,
 igr2=1615,1616,
 &end
#
#    0 AMB  20-2:1966   139 LEU  HB-         4.50    (#   1966:20  Single Ambig)
 &rst
  ixpk= 1966, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
      1769,1770,
 igr2=2050,2051,
 &end
#
#  139 LEU  HN          139 LEU  HB+         5.50    (#   1967:20  Unique         2.05, 2.70 A)
 &rst
  ixpk= 1967, nxpk= 20, iat=2046,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2050,2051,
 &end
#
#  146 LEU  HA          146 LEU  HB-         4.50    (#   1969:20  Unique         2.25, 2.44 A)
 &rst
  ixpk= 1969, nxpk= 20, iat=2158,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2160,2161,
 &end
#
#    0 AMB  20-2:1970     0 AMB  20-1:1970   4.50    (#   1970:20  Double Ambig)
 &rst
  ixpk= 1970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.69, r4= 9.19,
 igr1=1533,1534,1535,1537,1538,1539, 940, 941, 942, 944,
       945, 946,2163,
 igr2=1528,1529,2160,2161,
 &end
#
#  146 LEU  MDY         146 LEU  HB+         5.50    (#   1971:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 1971, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2160,2161,
 &end
#
#  146 LEU  MDX         146 LEU  HB+         7.00    (#   1972:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 1972, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2160,2161,
 &end
#
#  146 LEU  MDX         146 LEU  HB-         7.00    (#   1973:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 1973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2160,2161,
 &end
#
#  146 LEU  MDX         146 LEU  HB+         7.00    (#   1974:20  Unique         2.02, 3.22 A)
 &rst
  ixpk= 1974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2=2160,2161,
 &end
#
#   25 LYS  HD+          25 LYS  HE-         5.50    (#   1977:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1977, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 348, 349,
 igr2= 351, 352,
 &end
#
#   70 TYR  HB-         105 LEU  HB+         5.50    (#   1981:20  Unique         4.22, 5.89 A)
 &rst
  ixpk= 1981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 999,1000,
 igr2=1528,1529,
 &end
#
#   70 TYR  HB-         105 LEU  HB+         7.00    (#   1982:20  Unique         4.22, 5.89 A)
 &rst
  ixpk= 1982, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 999,1000,
 igr2=1528,1529,
 &end
#
#    3 ASP  HA            3 ASP  HB-         4.50    (#   1985:20  Unique         2.69, 2.83 A)
 &rst
  ixpk= 1985, nxpk= 20, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  35,  36,
 &end
#
#    0 AMB  20-2:1988     0 AMB  20-1:1988   5.50    (#   1988:20  Double Ambig)
 &rst
  ixpk= 1988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2156,2102,
 igr2=2188,2189,2188,2189,
 &end
#
#    0 AMB  20-2:1989     0 AMB  20-1:1989   7.00    (#   1989:20  Double Ambig)
 &rst
  ixpk= 1989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1550,1551,1547,1548,
 igr2=1528,1529,1528,1529,
 &end
#
#  145 LEU  HN          145 LEU  HB+         7.00    (#   1990:20  Unique         2.04, 2.69 A)
 &rst
  ixpk= 1990, nxpk= 20, iat=2137,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2141,2142,
 &end
#
#  105 LEU  HN          105 LEU  HB-         7.00    (#   1991:20  Unique         2.15, 2.54 A)
 &rst
  ixpk= 1991, nxpk= 20, iat=1524,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1528,1529,
 &end
#
#  105 LEU  HN          105 LEU  HB-         5.50    (#   1992:20  Unique         2.15, 2.54 A)
 &rst
  ixpk= 1992, nxpk= 20, iat=1524,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1528,1529,
 &end
#
#   73 LEU  HN           73 LEU  HB-         7.00    (#   1993:20  Unique         2.29, 2.94 A)
 &rst
  ixpk= 1993, nxpk= 20, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1045,1046,
 &end
#
#    0 AMB  20-2:1995     0 AMB  20-1:1995   4.50    (#   1995:20  Double Ambig)
 &rst
  ixpk= 1995, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 igr2=  80,  81,  80,  81,
 &end
#
#    0 AMB  20-2:1996     0 AMB  20-1:1996   7.00    (#   1996:20  Double Ambig)
 &rst
  ixpk= 1996, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 495, 496, 497, 777, 778, 779,
 igr2=  80,  81,  80,  81,
 &end
#
#   73 LEU  MDX          73 LEU  HB+         7.00    (#   1997:20  Unique         2.29, 3.27 A)
 &rst
  ixpk= 1997, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1045,1046,
 &end
#
#   41 LEU  MDX          73 LEU  HB+         5.50    (#   1998:20  Unique         4.36, 6.23 A)
 &rst
  ixpk= 1998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2=1045,1046,
 &end
#
#   73 LEU  HA           73 LEU  HB+         7.00    (#   1999:20  Unique         2.58, 2.79 A)
 &rst
  ixpk= 1999, nxpk= 20, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1045,1046,
 &end
#
#   74 GLN  HN           73 LEU  HB+         5.50    (#   2000:20  Unique         2.35, 2.70 A)
 &rst
  ixpk= 2000, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1045,1046,
 &end
#
#   73 LEU  HN           73 LEU  HB+         5.50    (#   2001:20  Unique         2.29, 2.94 A)
 &rst
  ixpk= 2001, nxpk= 20, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1045,1046,
 &end
#
#  145 LEU  HN          145 LEU  HB-         7.00    (#   2002:20  Unique         2.04, 2.69 A)
 &rst
  ixpk= 2002, nxpk= 20, iat=2137,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2141,2142,
 &end
#
#    0 AMB  20-2:2003     0 AMB  20-1:2003   7.00    (#   2003:20  Double Ambig)
 &rst
  ixpk= 2003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.53, r4=12.03,
 igr1= 696, 697, 413, 414, 415,
 igr2=  35,  36, 351, 352,
 &end
#
#   32 THR  HN            3 ASP  HB+         5.50    (#   2004:20  Unique         2.75, 2.92 A)
 &rst
  ixpk= 2004, nxpk= 20, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  35,  36,
 &end
#
#    4 ILE  HN            3 ASP  HB+         7.00    (#   2005:20  Unique         3.20, 3.52 A)
 &rst
  ixpk= 2005, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  35,  36,
 &end
#
#    3 ASP  HN            3 ASP  HB+         7.00    (#   2007:20  Unique         2.44, 2.75 A)
 &rst
  ixpk= 2007, nxpk= 20, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  35,  36,
 &end
#
#    4 ILE  HN            3 ASP  HB-         7.00    (#   2008:20  Unique         3.20, 3.52 A)
 &rst
  ixpk= 2008, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  35,  36,
 &end
#
#    3 ASP  HN            3 ASP  HB-         7.00    (#   2009:20  Unique         2.44, 2.75 A)
 &rst
  ixpk= 2009, nxpk= 20, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  35,  36,
 &end
#
#   32 THR  HN            3 ASP  HB-         7.00    (#   2010:20  Unique         2.75, 2.92 A)
 &rst
  ixpk= 2010, nxpk= 20, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  35,  36,
 &end
#
#    0 AMB  20-2:2011     0 AMB  20-1:2011   2.80    (#   2011:20  Double Ambig)
 &rst
  ixpk= 2011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2146,2147,2148,2150,2151,2152, 166, 167, 168, 170,
       171, 172, 569, 570, 571, 573, 574, 575,2144,
 igr2=2141,2142, 161, 162, 564, 565,
 &end
#
#    0 AMB  20-2:2012     7 ILE  HB          5.50    (#   2012:20  Single Ambig)
 &rst
  ixpk= 2012, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 754, 755, 756, 758, 759, 760, 105, 106,
 &end
#
#    0 AMB  20-2:2013     6 LEU  HB-         5.50    (#   2013:20  Single Ambig)
 &rst
  ixpk= 2013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1287,1288,1289, 101, 102, 103,
 igr2=  80,  81,
 &end
#
#   73 LEU  HA           73 LEU  HB-         5.50    (#   2014:20  Unique         2.58, 2.79 A)
 &rst
  ixpk= 2014, nxpk= 20, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1045,1046,
 &end
#
#    0 AMB  20-2:2015    40 LEU  HB-         5.50    (#   2015:20  Single Ambig)
 &rst
  ixpk= 2015, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 562, 615,
 igr2= 564, 565,
 &end
#
#   41 LEU  HA           41 LEU  HB-         5.50    (#   2016:20  Unique         2.61, 2.84 A)
 &rst
  ixpk= 2016, nxpk= 20, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 583, 584,
 &end
#
#   74 GLN  HN           73 LEU  HB-         7.00    (#   2017:20  Unique         2.35, 2.70 A)
 &rst
  ixpk= 2017, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1045,1046,
 &end
#
#   74 GLN  HN           73 LEU  HB-         7.00    (#   2018:20  Unique         2.35, 2.70 A)
 &rst
  ixpk= 2018, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1045,1046,
 &end
#
#    0 AMB  20-2:2019    73 LEU  HB-         5.50    (#   2019:20  Single Ambig)
 &rst
  ixpk= 2019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1111,1079,
 igr2=1045,1046,
 &end
#
#   73 LEU  HG           73 LEU  HB-         5.50    (#   2020:20  Unique         2.47, 2.75 A)
 &rst
  ixpk= 2020, nxpk= 20, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1045,1046,
 &end
#
#   44 LEU  MDX          44 LEU  HB-         7.00    (#   2021:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 2021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 634, 635, 636, 638, 639, 640,
 igr2= 629, 630,
 &end
#
#   44 LEU  MDX          44 LEU  HB-         7.00    (#   2022:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 2022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 634, 635, 636, 638, 639, 640,
 igr2= 629, 630,
 &end
#
#   44 LEU  MDY          44 LEU  HB+         4.50    (#   2024:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 2024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 634, 635, 636, 638, 639, 640,
 igr2= 629, 630,
 &end
#
#  105 LEU  MDY         105 LEU  HB+         5.50    (#   2028:20  Unique         2.23, 3.48 A)
 &rst
  ixpk= 2028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1533,1534,1535,1537,1538,1539,
 igr2=1528,1529,
 &end
#
#    6 LEU  MDX           6 LEU  HB+         5.50    (#   2029:20  Unique         2.24, 3.48 A)
 &rst
  ixpk= 2029, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  85,  86,  87,  89,  90,  91,
 igr2=  80,  81,
 &end
#
#    6 LEU  HA            6 LEU  HB+         7.00    (#   2030:20  Unique         2.71, 2.83 A)
 &rst
  ixpk= 2030, nxpk= 20, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  80,  81,
 &end
#
#  145 LEU  HA          145 LEU  HB-         5.50    (#   2031:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 2031, nxpk= 20, iat=2139,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2141,2142,
 &end
#
#   44 LEU  HN           43 ASP  HB+         7.00    (#   2033:20  Unique         3.29, 3.37 A)
 &rst
  ixpk= 2033, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 617, 618,
 &end
#
#   40 LEU  HN           43 ASP  HB+         5.50    (#   2034:20  Unique         5.50, 6.17 A)
 &rst
  ixpk= 2034, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 617, 618,
 &end
#
#   26 LEU  HG           26 LEU  HB+         7.00    (#   2035:20  Unique         2.32, 2.44 A)
 &rst
  ixpk= 2035, nxpk= 20, iat= 367,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 364, 365,
 &end
#
#    0 AMB  20-2:2036     0 AMB  20-1:2036   7.00    (#   2036:20  Double Ambig)
 &rst
  ixpk= 2036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1= 386, 387, 386, 387,
 igr2= 364, 365, 364, 365,
 &end
#
#   26 LEU  HN           26 LEU  HB+         7.00    (#   2037:20  Unique         2.21, 2.87 A)
 &rst
  ixpk= 2037, nxpk= 20, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 364, 365,
 &end
#
#  145 LEU  HA          145 LEU  HB-         5.50    (#   2038:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 2038, nxpk= 20, iat=2139,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2141,2142,
 &end
#
#    0 AMB  20-2:2039     0 AMB  20-1:2039   7.00    (#   2039:20  Double Ambig)
 &rst
  ixpk= 2039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 562, 615,
 igr2= 564, 565, 564, 565,
 &end
#
#   41 LEU  MDY          73 LEU  HB+         7.00    (#   2041:20  Unique         4.36, 6.23 A)
 &rst
  ixpk= 2041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2=1045,1046,
 &end
#
#   41 LEU  MDX          41 LEU  HB-         4.50    (#   2043:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 2043, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2= 583, 584,
 &end
#
#    0 AMB  20-2:2046     0 AMB  20-1:2046   4.50    (#   2046:20  Double Ambig)
 &rst
  ixpk= 2046, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 862,1898,
 igr2= 864, 865,1900,1901,
 &end
#
#    7 ILE  MG2           7 ILE  HB          4.50    (#   2048:20  Unique         2.35, 2.63 A)
 &rst
  ixpk= 2048, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 101, 102, 103,
 &end
#
#    7 ILE  MD1           7 ILE  HB          5.50    (#   2049:20  Unique         2.37, 3.13 A)
 &rst
  ixpk= 2049, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 108, 109, 110,
 &end
#
#   88 ILE  MD1          88 ILE  HB          7.00    (#   2050:20  Unique         2.40, 3.15 A)
 &rst
  ixpk= 2050, nxpk= 20, iat=  -1,1278, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1287,1288,1289,
 &end
#
#  109 LEU  MDX         109 LEU  HB+         5.50    (#   2051:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 2051, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1592,1593,1594,1596,1597,1598,
 igr2=1587,1588,
 &end
#
#   90 ILE  MD1          90 ILE  HB          4.50    (#   2052:20  Unique         2.47, 3.24 A)
 &rst
  ixpk= 2052, nxpk= 20, iat=  -1,1304, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1313,1314,1315,
 &end
#
#    0 AMB  20-2:2053    53 ILE  HB          4.50    (#   2053:20  Single Ambig)
 &rst
  ixpk= 2053, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 242, 243, 244, 246, 247, 248,  85,  86,  87,  89,
        90,  91,  85,  86,  87,  89,  90,  91,
 &end
#
#   33 THR  MG2           4 ILE  HB          4.50    (#   2054:20  Unique         2.02, 2.92 A)
 &rst
  ixpk= 2054, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 466, 467, 468,
 &end
#
#  109 LEU  MDX         109 LEU  HB-         5.50    (#   2055:20  Unique         2.13, 3.31 A)
 &rst
  ixpk= 2055, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1592,1593,1594,1596,1597,1598,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:2056   109 LEU  HB-         5.50    (#   2056:20  Single Ambig)
 &rst
  ixpk= 2056, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1533,1534,1535,1537,1538,1539,1660,1661,1662,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:2057   109 LEU  HB-         7.00    (#   2057:20  Single Ambig)
 &rst
  ixpk= 2057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1533,1534,1535,1537,1538,1539,1660,1661,1662,
 igr2=1587,1588,
 &end
#
#    0 AMB  20-2:2058   109 LEU  HB-         7.00    (#   2058:20  Single Ambig)
 &rst
  ixpk= 2058, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1545,1585,
 igr2=1587,1588,
 &end
#
#   91 GLY  HA-          96 ASP  HB+         4.50    (#   2059:20  Unique         2.35, 3.88 A)
 &rst
  ixpk= 2059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1321,1322,
 igr2=1401,1402,
 &end
#
#    0 AMB  20-2:2061     7 ILE  HB          5.50    (#   2061:20  Single Ambig)
 &rst
  ixpk= 2061, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 754, 755, 756, 758, 759, 760, 105, 106,
 &end
#
#    0 AMB  20-2:2062     0 AMB  20-1:2062   5.50    (#   2062:20  Double Ambig)
 &rst
  ixpk= 2062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=1268,1269,1270,1310,1311, 774, 775,
 igr2=1304, 768,
 &end
#
#    0 AMB  20-2:2063     0 AMB  20-1:2063   7.00    (#   2063:20  Double Ambig)
 &rst
  ixpk= 2063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=1545,1585,
 igr2=1587,1588,1587,1588,
 &end
#
#   88 ILE  HG1-        121 LEU  HB+         7.00    (#   2064:20  Unique         1.99, 3.60 A)
 &rst
  ixpk= 2064, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1284,1285,
 igr2=1759,1760,
 &end
#
#    0 AMB  20-2:2065   121 LEU  HB-         7.00    (#   2065:20  Single Ambig)
 &rst
  ixpk= 2065, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=1280,1281,1282,1762,
 igr2=1759,1760,
 &end
#
#  121 LEU  HA          121 LEU  HB-         7.00    (#   2066:20  Unique         2.49, 2.80 A)
 &rst
  ixpk= 2066, nxpk= 20, iat=1757,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1759,1760,
 &end
#
#  121 LEU  HA          121 LEU  HB-         7.00    (#   2067:20  Unique         2.49, 2.80 A)
 &rst
  ixpk= 2067, nxpk= 20, iat=1757,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1759,1760,
 &end
#
#   31 PHE  HA           31 PHE  HB+         5.50    (#   2068:20  Unique         2.25, 2.50 A)
 &rst
  ixpk= 2068, nxpk= 20, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 430, 431,
 &end
#
#    3 ASP  HB+          31 PHE  HB+         7.00    (#   2070:20  Unique         2.82, 3.82 A)
 &rst
  ixpk= 2070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=  35,  36,
 igr2= 430, 431,
 &end
#
#    0 AMB  20-2:2071     0 AMB  20-1:2071   7.00    (#   2071:20  Double Ambig)
 &rst
  ixpk= 2071, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.53, r4=12.03,
 igr1=1415,1416,1417,1918,1919,
 igr2=1401,1402,1401,1402,
 &end
#
#    0 AMB  20-2:2073    53 ILE  HB          4.50    (#   2073:20  Single Ambig)
 &rst
  ixpk= 2073, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 242, 243, 244, 246, 247, 248,  85,  86,  87,  89,
        90,  91,
 &end
#
#  123 ILE  HG1-        123 ILE  HB          5.50    (#   2074:20  Unique         2.51, 2.80 A)
 &rst
  ixpk= 2074, nxpk= 20, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1806,1807,
 &end
#
#  123 ILE  HG1-        123 ILE  HB          7.00    (#   2075:20  Unique         2.51, 2.80 A)
 &rst
  ixpk= 2075, nxpk= 20, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1806,1807,
 &end
#
#   31 PHE  HA           31 PHE  HB-         7.00    (#   2080:20  Unique         2.25, 2.50 A)
 &rst
  ixpk= 2080, nxpk= 20, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 430, 431,
 &end
#
#   31 PHE  HN           31 PHE  HB-         5.50    (#   2081:20  Unique         3.45, 3.51 A)
 &rst
  ixpk= 2081, nxpk= 20, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 430, 431,
 &end
#
#   31 PHE  HN           31 PHE  HB+         7.00    (#   2082:20  Unique         3.45, 3.51 A)
 &rst
  ixpk= 2082, nxpk= 20, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 430, 431,
 &end
#
#    4 ILE  MD1          31 PHE  HB-         7.00    (#   2083:20  Unique         3.11, 4.26 A)
 &rst
  ixpk= 2083, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  56,  57,  58,
 igr2= 430, 431,
 &end
#
#    4 ILE  MD1          31 PHE  HB+         7.00    (#   2084:20  Unique         3.11, 4.26 A)
 &rst
  ixpk= 2084, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  56,  57,  58,
 igr2= 430, 431,
 &end
#
#   70 TYR  HB-          64 ASP  HB+         5.50    (#   2085:20  Unique         4.15, 5.44 A)
 &rst
  ixpk= 2085, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 999,1000,
 igr2= 909, 910,
 &end
#
#   64 ASP  HN           64 ASP  HB+         5.50    (#   2086:20  Unique         2.58, 3.60 A)
 &rst
  ixpk= 2086, nxpk= 20, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 909, 910,
 &end
#
#    0 AMB  20-2:2087     0 AMB  20-1:2087   4.50    (#   2087:20  Double Ambig)
 &rst
  ixpk= 2087, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1= 369, 370, 371, 373, 374, 375, 369, 370, 371, 373,
       374, 375,  85,  86,  87,  89,  90,  91,
 igr2= 298, 299, 298, 299, 298, 299,
 &end
#
#   22 LEU  HA           22 LEU  HB+         5.50    (#   2089:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 2089, nxpk= 20, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 298, 299,
 &end
#
#   22 LEU  HG           22 LEU  HB-         7.00    (#   2090:20  Unique         2.51, 2.79 A)
 &rst
  ixpk= 2090, nxpk= 20, iat= 301,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 298, 299,
 &end
#
#   22 LEU  HA           22 LEU  HB-         7.00    (#   2091:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 2091, nxpk= 20, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 298, 299,
 &end
#
#   79 ASP  HA           79 ASP  HB+         5.50    (#   2094:20  Unique         2.55, 2.79 A)
 &rst
  ixpk= 2094, nxpk= 20, iat=1147,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1149,1150,
 &end
#
#    0 AMB  20-2:2095   103 ASP  HB-         5.50    (#   2095:20  Single Ambig)
 &rst
  ixpk= 2095, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1492,1339,
 igr2=1494,1495,
 &end
#
#   80 LEU  HA           80 LEU  HB-         5.50    (#   2096:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 2096, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1161,1162,
 &end
#
#    0 AMB  20-2:2097     0 AMB  20-1:2097   7.00    (#   2097:20  Double Ambig)
 &rst
  ixpk= 2097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=1159,1658,
 igr2=1161,1162,1161,1162,
 &end
#
#   80 LEU  HA           80 LEU  HB-         5.50    (#   2098:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 2098, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1161,1162,
 &end
#
#    0 AMB  20-2:2099     0 AMB  20-1:2099   7.00    (#   2099:20  Double Ambig)
 &rst
  ixpk= 2099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.34, r4=12.84,
 igr1=1201,1138,1139,1217,1218,
 igr2=1161,1162,1161,1162,1161,1162,
 &end
#
#    0 AMB  20-2:2100    80 LEU  HB-         7.00    (#   2100:20  Single Ambig)
 &rst
  ixpk= 2100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.27, r4=10.77,
 igr1=1201,1138,1139,1217,1218,
 igr2=1161,1162,
 &end
#
#  114 ALA  MB           80 LEU  HB+         7.00    (#   2101:20  Unique         1.97, 3.15 A)
 &rst
  ixpk= 2101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1660,1661,1662,
 igr2=1161,1162,
 &end
#
#  114 ALA  MB           80 LEU  HB-         7.00    (#   2102:20  Unique         1.97, 3.15 A)
 &rst
  ixpk= 2102, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1660,1661,1662,
 igr2=1161,1162,
 &end
#
#    0 AMB  20-2:2103     0 AMB  20-1:2103   5.50    (#   2103:20  Double Ambig)
 &rst
  ixpk= 2103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 296, 315,
 igr2= 298, 299, 298, 299,
 &end
#
#  105 LEU  MDX          70 TYR  HB-         7.00    (#   2105:20  Unique         2.62, 5.15 A)
 &rst
  ixpk= 2105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1533,1534,1535,1537,1538,1539,
 igr2= 999,1000,
 &end
#
#  105 LEU  MDX          70 TYR  HB+         7.00    (#   2106:20  Unique         2.62, 5.15 A)
 &rst
  ixpk= 2106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1533,1534,1535,1537,1538,1539,
 igr2= 999,1000,
 &end
#
#   70 TYR  HA           70 TYR  HB+         7.00    (#   2107:20  Unique         2.23, 2.56 A)
 &rst
  ixpk= 2107, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 999,1000,
 &end
#
#    0 AMB  20-2:2110     0 AMB  20-1:2110   7.00    (#   2110:20  Double Ambig)
 &rst
  ixpk= 2110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=1141, 660,1642,1643,
 igr2=1149,1150,1149,1150,1149,1150,
 &end
#
#   70 TYR  HN           70 TYR  HB+         7.00    (#   2116:20  Unique         2.07, 2.64 A)
 &rst
  ixpk= 2116, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 999,1000,
 &end
#
#    4 ILE  HG1-         49 ILE  HB          5.50    (#   2121:20  Unique         1.97, 2.85 A)
 &rst
  ixpk= 2121, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  53,  54,
 &end
#
#   49 ILE  HG1-         49 ILE  HB          5.50    (#   2122:20  Unique         2.43, 2.46 A)
 &rst
  ixpk= 2122, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 696, 697,
 &end
#
#   49 ILE  HA           49 ILE  HB          5.50    (#   2124:20  Unique         2.97, 3.00 A)
 &rst
  ixpk= 2124, nxpk= 20, iat= 688, 690, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2126    49 ILE  HB          5.50    (#   2126:20  Single Ambig)
 &rst
  ixpk= 2126, nxpk= 20, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  49,  50,  51, 692, 693, 694,
 &end
#
#   95 TYR  HA           95 TYR  HB-         7.00    (#   2128:20  Unique         2.49, 2.83 A)
 &rst
  ixpk= 2128, nxpk= 20, iat=1378,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1380,1381,
 &end
#
#   70 TYR  HD           69 PHE  HB+         7.00    (#   2132:20  Unique         5.52, 6.72 A)
 &rst
  ixpk= 2132, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1003,1012,
 igr2= 979, 980,
 &end
#
#   70 TYR  HN           69 PHE  HB+         5.50    (#   2134:20  Unique         2.06, 2.61 A)
 &rst
  ixpk= 2134, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#   69 PHE  HA           69 PHE  HB+         5.50    (#   2135:20  Unique         2.71, 2.84 A)
 &rst
  ixpk= 2135, nxpk= 20, iat= 977,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#   66 LEU  MDX          69 PHE  HB+         7.00    (#   2136:20  Unique         1.96, 4.00 A)
 &rst
  ixpk= 2136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 979, 980,
 &end
#
#   69 PHE  HA           69 PHE  HB-         5.50    (#   2138:20  Unique         2.71, 2.84 A)
 &rst
  ixpk= 2138, nxpk= 20, iat= 977,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
#   66 LEU  MDX          69 PHE  HB-         7.00    (#   2139:20  Unique         1.96, 4.00 A)
 &rst
  ixpk= 2139, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 979, 980,
 &end
#
#  109 LEU  MDY          69 PHE  HB-         7.00    (#   2140:20  Unique         5.25, 7.28 A)
 &rst
  ixpk= 2140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1592,1593,1594,1596,1597,1598,
 igr2= 979, 980,
 &end
#
#  145 LEU  MDX           0 AMB  20-1:2146   7.00    (#   2146:20  Single Ambig)
 &rst
  ixpk= 2146, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=2146,2147,2148,2150,2151,2152,
 igr2=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:2147     0 AMB  20-1:2147   7.00    (#   2147:20  Double Ambig)
 &rst
  ixpk= 2147, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1=2179,2180,2179,2180,2141,2142,
 igr2=2127,2128,2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:2148     0 AMB  20-1:2148   7.00    (#   2148:20  Double Ambig)
 &rst
  ixpk= 2148, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=2179,2180,2179,2180,
 igr2=2127,2128,2127,2128,
 &end
#
#  146 LEU  HN            0 AMB  20-1:2149   7.00    (#   2149:20  Single Ambig)
 &rst
  ixpk= 2149, nxpk= 20, iat=2156,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=2127,2128,2127,2128,
 &end
#
#    0 AMB  20-2:2150     0 AMB  20-1:2150   4.50    (#   2150:20  Double Ambig)
 &rst
  ixpk= 2150, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2132,2133,2132,2133,2137,
 igr2=2127,2128,2127,2128,
 &end
#
#  130 ILE  HG1-        130 ILE  HB          4.50    (#   2155:20  Unique         2.44, 2.62 A)
 &rst
  ixpk= 2155, nxpk= 20, iat=  -1,1912, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1918,1919,
 &end
#
#  130 ILE  HA          130 ILE  HB          5.50    (#   2158:20  Unique         2.97, 2.98 A)
 &rst
  ixpk= 2158, nxpk= 20, iat=1910,1912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 ILE  HN          130 ILE  HB          7.00    (#   2160:20  Unique         2.22, 2.66 A)
 &rst
  ixpk= 2160, nxpk= 20, iat=1908,1912, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  111 ASN  HD2+        111 ASN  HB+         7.00    (#   2163:20  Unique         2.19, 3.29 A)
 &rst
  ixpk= 2163, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1633,1634,
 igr2=1628,1629,
 &end
#
#  111 ASN  HD2+        111 ASN  HB-         7.00    (#   2164:20  Unique         2.19, 3.29 A)
 &rst
  ixpk= 2164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1633,1634,
 igr2=1628,1629,
 &end
#
#  112 SER  HN          111 ASN  HB+         5.50    (#   2167:20  Unique         3.31, 3.86 A)
 &rst
  ixpk= 2167, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1628,1629,
 &end
#
#  144 ASN  HA            0 AMB  20-1:2168   3.50    (#   2168:20  Single Ambig)
 &rst
  ixpk= 2168, nxpk= 20, iat=2125,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2127,2128,2127,2128,
 &end
#
#   71 GLU  HB+          71 GLU  HG-         2.80    (#   2176:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 2176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1020,1021,
 igr2=1023,1024,
 &end
#
#   35 THR  MG2          20 GLU  HG+         5.50    (#   2177:20  Unique         3.24, 5.38 A)
 &rst
  ixpk= 2177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 495, 496, 497,
 igr2= 269, 270,
 &end
#
#   35 THR  MG2          20 GLU  HG+         7.00    (#   2178:20  Unique         3.24, 5.38 A)
 &rst
  ixpk= 2178, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 495, 496, 497,
 igr2= 269, 270,
 &end
#
#    0 AMB  20-2:2180     0 AMB  20-1:2180   4.50    (#   2180:20  Double Ambig)
 &rst
  ixpk= 2180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1994,2067,2068,
 igr2=1999,2000,1999,2000,
 &end
#
#    0 AMB  20-2:2181     0 AMB  20-1:2181   4.50    (#   2181:20  Double Ambig)
 &rst
  ixpk= 2181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 264, 325,
 igr2= 269, 270, 330, 331,
 &end
#
#   21 HIS  HA            0 AMB  20-1:2182   7.00    (#   2182:20  Single Ambig)
 &rst
  ixpk= 2182, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 269, 270, 330, 331,
 &end
#
#   20 GLU  HN           20 GLU  HG+         5.50    (#   2185:20  Unique         3.84, 4.17 A)
 &rst
  ixpk= 2185, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 269, 270,
 &end
#
#  137 GLU  HN          136 GLU  HG+         7.00    (#   2186:20  Unique         2.09, 2.83 A)
 &rst
  ixpk= 2186, nxpk= 20, iat=2007,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1999,2000,
 &end
#
#    0 AMB  20-2:2187     0 AMB  20-1:2187   4.50    (#   2187:20  Double Ambig)
 &rst
  ixpk= 2187, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2009, 600,
 igr2=2014,2015, 605, 606,
 &end
#
#   70 TYR  HD           71 GLU  HG-         7.00    (#   2188:20  Unique         2.33, 4.62 A)
 &rst
  ixpk= 2188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1003,1012,
 igr2=1023,1024,
 &end
#
#   70 TYR  HD           71 GLU  HG+         5.50    (#   2189:20  Unique         2.33, 4.62 A)
 &rst
  ixpk= 2189, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1003,1012,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:2190     0 AMB  20-1:2190   4.50    (#   2190:20  Double Ambig)
 &rst
  ixpk= 2190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 340, 396,
 igr2= 401, 402, 401, 402,
 &end
#
#   24 GLU  HA           27 GLU  HG+         5.50    (#   2191:20  Unique         3.60, 4.57 A)
 &rst
  ixpk= 2191, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 386, 387,
 &end
#
#   71 GLU  HN           71 GLU  HG-         5.50    (#   2192:20  Unique         2.95, 3.12 A)
 &rst
  ixpk= 2192, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:2193     0 AMB  20-1:2193   7.00    (#   2193:20  Double Ambig)
 &rst
  ixpk= 2193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 995,1077,
 igr2=1023,1024,1023,1024,
 &end
#
#   65 ASN  HD2+         65 ASN  HB-         5.50    (#   2195:20  Unique         2.43, 3.49 A)
 &rst
  ixpk= 2195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 926, 927,
 igr2= 921, 922,
 &end
#
#   65 ASN  HD2+         65 ASN  HB+         7.00    (#   2196:20  Unique         2.43, 3.49 A)
 &rst
  ixpk= 2196, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 926, 927,
 igr2= 921, 922,
 &end
#
#   66 LEU  HN           65 ASN  HB-         7.00    (#   2197:20  Unique         1.93, 3.16 A)
 &rst
  ixpk= 2197, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 921, 922,
 &end
#
#   35 THR  HA            0 AMB  20-1:2198   7.00    (#   2198:20  Single Ambig)
 &rst
  ixpk= 2198, nxpk= 20, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 386, 387, 386, 387,
 &end
#
#   33 THR  MG2           0 AMB  20-1:2199   4.50    (#   2199:20  Single Ambig)
 &rst
  ixpk= 2199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 466, 467, 468,
 igr2= 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:2200     0 AMB  20-1:2200   7.00    (#   2200:20  Double Ambig)
 &rst
  ixpk= 2200, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1= 394, 426, 474,
 igr2= 386, 387, 386, 387, 386, 387,
 &end
#
#    0 AMB  20-2:2201     0 AMB  20-1:2201   7.00    (#   2201:20  Double Ambig)
 &rst
  ixpk= 2201, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1721,1722,1033,
 igr2=1733,1734,1084,1085,
 &end
#
#  120 THR  HN          119 GLU  HG+         7.00    (#   2203:20  Unique         4.28, 4.55 A)
 &rst
  ixpk= 2203, nxpk= 20, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1733,1734,
 &end
#
#   27 GLU  HN           28 GLU  HG+         7.00    (#   2207:20  Unique         4.28, 5.52 A)
 &rst
  ixpk= 2207, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 401, 402,
 &end
#
#  108 GLU  HN          108 GLU  HG-         5.50    (#   2208:20  Unique         2.56, 3.30 A)
 &rst
  ixpk= 2208, nxpk= 20, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1575,1576,
 &end
#
#  118 GLY  HA+         119 GLU  HG+         5.50    (#   2209:20  Unique         3.00, 4.77 A)
 &rst
  ixpk= 2209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1721,1722,
 igr2=1733,1734,
 &end
#
#  108 GLU  HA          108 GLU  HG+         5.50    (#   2210:20  Unique         3.00, 3.34 A)
 &rst
  ixpk= 2210, nxpk= 20, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1575,1576,
 &end
#
#   40 LEU  MDX          42 GLU  HG-         5.50    (#   2211:20  Unique         5.13, 7.03 A)
 &rst
  ixpk= 2211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 569, 570, 571, 573, 574, 575,
 igr2= 605, 606,
 &end
#
#    0 AMB  20-2:2212     0 AMB  20-1:2212   7.00    (#   2212:20  Double Ambig)
 &rst
  ixpk= 2212, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.61, r4=14.11,
 igr1=1747,1748,1749, 569, 570, 571, 573, 574, 575,
 igr2=1344,1345, 605, 606, 605, 606,
 &end
#
#    0 AMB  20-2:2213     0 AMB  20-1:2213   7.00    (#   2213:20  Double Ambig)
 &rst
  ixpk= 2213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 625,1109,
 igr2= 605, 606, 605, 606,1084,1085,
 &end
#
#   43 ASP  HN            0 AMB  20-1:2214   7.00    (#   2214:20  Single Ambig)
 &rst
  ixpk= 2214, nxpk= 20, iat= 613,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 605, 606, 605, 606,
 &end
#
#    0 AMB  20-2:2216     0 AMB  20-1:2216   5.50    (#   2216:20  Double Ambig)
 &rst
  ixpk= 2216, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1018,1721,1722,
 igr2=1023,1024,1733,1734,
 &end
#
#    0 AMB  20-2:2218     0 AMB  20-1:2218   4.50    (#   2218:20  Double Ambig)
 &rst
  ixpk= 2218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1745, 325,
 igr2=1344,1345, 401, 402,
 &end
#
#  120 THR  HB           93 ARG  HG-         4.50    (#   2219:20  Unique         3.00, 4.73 A)
 &rst
  ixpk= 2219, nxpk= 20, iat=1745,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1344,1345,
 &end
#
#   35 THR  HN           34 GLU  HG-         5.50    (#   2220:20  Unique         3.36, 4.19 A)
 &rst
  ixpk= 2220, nxpk= 20, iat= 489,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 481, 482,
 &end
#
#    0 AMB  20-2:2221     0 AMB  20-1:2221   7.00    (#   2221:20  Double Ambig)
 &rst
  ixpk= 2221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.34, r4=13.84,
 igr1= 512, 513, 514, 516, 517, 518,1050,1051,1052,1054,
      1055,1056,
 igr2= 481, 482,1575,1576,
 &end
#
#   94 GLU  HA           94 GLU  HG-         7.00    (#   2222:20  Unique         2.06, 3.08 A)
 &rst
  ixpk= 2222, nxpk= 20, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1368,1369,
 &end
#
#   94 GLU  HA           94 GLU  HG+         7.00    (#   2223:20  Unique         2.06, 3.08 A)
 &rst
  ixpk= 2223, nxpk= 20, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1368,1369,
 &end
#
#  116 GLN  HE2-        106 GLU  HG+         5.50    (#   2229:20  Unique         3.86, 6.01 A)
 &rst
  ixpk= 2229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1700,1701,
 igr2=1550,1551,
 &end
#
#   16 GLU  HA           16 GLU  HG+         5.50    (#   2230:20  Unique         3.56, 3.81 A)
 &rst
  ixpk= 2230, nxpk= 20, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 207, 208,
 &end
#
#  116 GLN  HE2-        106 GLU  HG-         7.00    (#   2234:20  Unique         3.86, 6.01 A)
 &rst
  ixpk= 2234, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1700,1701,
 igr2=1550,1551,
 &end
#
#  109 LEU  HN          106 GLU  HG+         7.00    (#   2235:20  Unique         5.30, 6.20 A)
 &rst
  ixpk= 2235, nxpk= 20, iat=1583,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1550,1551,
 &end
#
#    0 AMB  20-2:2236     0 AMB  20-1:2236   7.00    (#   2236:20  Double Ambig)
 &rst
  ixpk= 2236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 720,1249, 722,
 igr2= 605, 606, 605, 606,1550,1551, 605, 606,
 &end
#
#    0 AMB  20-2:2238    75 GLU  HG-         2.80    (#   2238:20  Single Ambig)
 &rst
  ixpk= 2238, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1081,1082,1081,1082,
 igr2=1084,1085,
 &end
#
#  122 LYS  HA          122 LYS  HB+         7.00    (#   2239:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 2239, nxpk= 20, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1778,1779,
 &end
#
#  112 SER  HB-          76 GLN  HG-         7.00    (#   2240:20  Unique         6.08, 6.77 A)
 &rst
  ixpk= 2240, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1642,1643,
 igr2=1099,1100,
 &end
#
#  112 SER  HB-          76 GLN  HG+         7.00    (#   2241:20  Unique         6.08, 6.77 A)
 &rst
  ixpk= 2241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1642,1643,
 igr2=1099,1100,
 &end
#
#  108 GLU  HG-          74 GLN  HG+         5.50    (#   2242:20  Unique         2.19, 3.83 A)
 &rst
  ixpk= 2242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1575,1576,
 igr2=1067,1068,
 &end
#
#   74 GLN  HE2+         74 GLN  HG+         5.50    (#   2243:20  Unique         2.15, 3.24 A)
 &rst
  ixpk= 2243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1072,1073,
 igr2=1067,1068,
 &end
#
#  147 LYS  HN          147 LYS  HB-         5.50    (#   2244:20  Unique         2.07, 2.71 A)
 &rst
  ixpk= 2244, nxpk= 20, iat=2175,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2179,2180,
 &end
#
#   74 GLN  HN           74 GLN  HG+         5.50    (#   2245:20  Unique         2.19, 2.34 A)
 &rst
  ixpk= 2245, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1067,1068,
 &end
#
#   74 GLN  HN           74 GLN  HG+         5.50    (#   2246:20  Unique         2.19, 2.34 A)
 &rst
  ixpk= 2246, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1067,1068,
 &end
#
#    0 AMB  20-2:2247    74 GLN  HG-         7.00    (#   2247:20  Single Ambig)
 &rst
  ixpk= 2247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1077, 995,
 igr2=1067,1068,
 &end
#
#  147 LYS  HA          147 LYS  HB+         7.00    (#   2249:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 2249, nxpk= 20, iat=2177,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2179,2180,
 &end
#
#   74 GLN  HN           74 GLN  HG-         5.50    (#   2250:20  Unique         2.19, 2.34 A)
 &rst
  ixpk= 2250, nxpk= 20, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1067,1068,
 &end
#
#    5 THR  HA           34 GLU  HB-         7.00    (#   2251:20  Unique         3.52, 3.64 A)
 &rst
  ixpk= 2251, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 478, 479,
 &end
#
#   34 GLU  HN           34 GLU  HB-         7.00    (#   2253:20  Unique         2.52, 2.83 A)
 &rst
  ixpk= 2253, nxpk= 20, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 478, 479,
 &end
#
#   36 LEU  MDY          34 GLU  HB-         7.00    (#   2254:20  Unique         2.27, 4.34 A)
 &rst
  ixpk= 2254, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 478, 479,
 &end
#
#    7 ILE  MD1          50 TRP  HB+         7.00    (#   2256:20  Unique         3.14, 4.98 A)
 &rst
  ixpk= 2256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 108, 109, 110,
 igr2= 709, 710,
 &end
#
#    0 AMB  20-2:2257    50 TRP  HB-         7.00    (#   2257:20  Single Ambig)
 &rst
  ixpk= 2257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1203,1204,1205,1207,1208,1209, 108, 109, 110,
 igr2= 709, 710,
 &end
#
#   83 VAL  MGY          50 TRP  HB+         7.00    (#   2258:20  Unique         2.68, 5.04 A)
 &rst
  ixpk= 2258, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1203,1204,1205,1207,1208,1209,
 igr2= 709, 710,
 &end
#
#   85 PHE  HB-          50 TRP  HB+         7.00    (#   2259:20  Unique         3.29, 4.86 A)
 &rst
  ixpk= 2259, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1241,1242,
 igr2= 709, 710,
 &end
#
#   50 TRP  HA           50 TRP  HB+         7.00    (#   2261:20  Unique         2.57, 2.80 A)
 &rst
  ixpk= 2261, nxpk= 20, iat= 707,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 709, 710,
 &end
#
#   50 TRP  HA           50 TRP  HB-         7.00    (#   2262:20  Unique         2.57, 2.80 A)
 &rst
  ixpk= 2262, nxpk= 20, iat= 707,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 709, 710,
 &end
#
#   51 LEU  HN           50 TRP  HB+         7.00    (#   2263:20  Unique         3.68, 4.09 A)
 &rst
  ixpk= 2263, nxpk= 20, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 709, 710,
 &end
#
#   51 LEU  HN           50 TRP  HB-         7.00    (#   2264:20  Unique         3.68, 4.09 A)
 &rst
  ixpk= 2264, nxpk= 20, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 709, 710,
 &end
#
#  116 GLN  HB+         116 GLN  HG+         7.00    (#   2266:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 2266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1692,1693,
 igr2=1695,1696,
 &end
#
#  116 GLN  HB+         116 GLN  HG+         5.50    (#   2267:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 2267, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1692,1693,
 igr2=1695,1696,
 &end
#
#    0 AMB  20-2:2268     0 AMB  20-1:2268   7.00    (#   2268:20  Double Ambig)
 &rst
  ixpk= 2268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1690,1259,1260,
 igr2=1695,1696,1695,1696,
 &end
#
#  117 THR  HN          116 GLN  HG+         7.00    (#   2269:20  Unique         2.84, 3.39 A)
 &rst
  ixpk= 2269, nxpk= 20, iat=1705,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1695,1696,
 &end
#
#  116 GLN  HB-         116 GLN  HG-         7.00    (#   2270:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 2270, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1692,1693,
 igr2=1695,1696,
 &end
#
#    0 AMB  20-2:2272     0 AMB  20-1:2272   5.50    (#   2272:20  Double Ambig)
 &rst
  ixpk= 2272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1132,1133,1526,
 igr2=1138,1139,1506,1507,
 &end
#
#  131 PRO  HA          131 PRO  HB+         5.50    (#   2274:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2274, nxpk= 20, iat=1937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1934,1935,
 &end
#
#    0 AMB  20-2:2275     0 AMB  20-1:2275   7.00    (#   2275:20  Double Ambig)
 &rst
  ixpk= 2275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.97, r4=12.47,
 igr1= 681, 682,1159,1189,1881,
 igr2=1201,1138,1139,1934,1935,
 &end
#
#   79 ASP  HN           78 PRO  HB-         5.50    (#   2276:20  Unique         2.06, 2.68 A)
 &rst
  ixpk= 2276, nxpk= 20, iat=1145,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1138,1139,
 &end
#
#   79 ASP  HN           78 PRO  HB+         7.00    (#   2277:20  Unique         2.06, 2.68 A)
 &rst
  ixpk= 2277, nxpk= 20, iat=1145,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1138,1139,
 &end
#
#   78 PRO  HD+          78 PRO  HB+         7.00    (#   2278:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2278, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1132,1133,
 igr2=1138,1139,
 &end
#
#   40 LEU  HN           39 PRO  HB+         7.00    (#   2279:20  Unique         2.84, 3.37 A)
 &rst
  ixpk= 2279, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 553, 554,
 &end
#
#  131 PRO  HA          131 PRO  HB-         5.50    (#   2280:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2280, nxpk= 20, iat=1937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1934,1935,
 &end
#
#  131 PRO  HA          131 PRO  HB-         7.00    (#   2281:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2281, nxpk= 20, iat=1937,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1934,1935,
 &end
#
#  107 ALA  HA            0 AMB  20-1:2282   7.00    (#   2282:20  Single Ambig)
 &rst
  ixpk= 2282, nxpk= 20, iat=1560,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=1606,1607,1606,1607,
 &end
#
#  111 ASN  HN            0 AMB  20-1:2283   7.00    (#   2283:20  Single Ambig)
 &rst
  ixpk= 2283, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=1606,1607,1606,1607,
 &end
#
#   46 ALA  HN           45 PRO  HB-         5.50    (#   2284:20  Unique         1.93, 2.56 A)
 &rst
  ixpk= 2284, nxpk= 20, iat= 658,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 651, 652,
 &end
#
#   80 LEU  HN           78 PRO  HB+         7.00    (#   2285:20  Unique         4.56, 5.45 A)
 &rst
  ixpk= 2285, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1138,1139,
 &end
#
#  120 THR  HN          119 GLU  HB+         7.00    (#   2286:20  Unique         2.29, 2.95 A)
 &rst
  ixpk= 2286, nxpk= 20, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1730,1731,
 &end
#
#    0 AMB  20-2:2289     0 AMB  20-1:2289   5.50    (#   2289:20  Double Ambig)
 &rst
  ixpk= 2289, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 569, 570, 571, 573, 574, 575, 166, 167, 168, 170,
       171, 172,
 igr2= 553, 554, 553, 554,
 &end
#
#    0 AMB  20-2:2290     0 AMB  20-1:2290   7.00    (#   2290:20  Double Ambig)
 &rst
  ixpk= 2290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.28, r4=14.78,
 igr1=1747,1748,1749,1533,1534,1535,1537,1538,1539,1921,
      1922,1923,
 igr2=1934,1935,1506,1507,1934,1935,
 &end
#
#  140 GLY  HA-         143 VAL  HB          7.00    (#   2291:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 2291, nxpk= 20, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2067,2068,
 &end
#
#  120 THR  HN          119 GLU  HB-         7.00    (#   2292:20  Unique         2.29, 2.95 A)
 &rst
  ixpk= 2292, nxpk= 20, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1730,1731,
 &end
#
#   45 PRO  HD+          45 PRO  HB-         7.00    (#   2294:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2294, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 645, 646,
 igr2= 651, 652,
 &end
#
#   45 PRO  HD+          45 PRO  HB+         7.00    (#   2295:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 645, 646,
 igr2= 651, 652,
 &end
#
#   46 ALA  HA           45 PRO  HB-         7.00    (#   2296:20  Unique         4.38, 5.02 A)
 &rst
  ixpk= 2296, nxpk= 20, iat= 660,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 651, 652,
 &end
#
#   47 SER  HN           45 PRO  HB-         5.50    (#   2299:20  Unique         3.51, 4.24 A)
 &rst
  ixpk= 2299, nxpk= 20, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 651, 652,
 &end
#
#   47 SER  HN           45 PRO  HB-         5.50    (#   2300:20  Unique         3.51, 4.24 A)
 &rst
  ixpk= 2300, nxpk= 20, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 651, 652,
 &end
#
#   45 PRO  HD-          45 PRO  HB-         5.50    (#   2301:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2301, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 645, 646,
 igr2= 651, 652,
 &end
#
#   45 PRO  HD-          45 PRO  HB+         7.00    (#   2302:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2302, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 645, 646,
 igr2= 651, 652,
 &end
#
#   46 ALA  HN           45 PRO  HB+         7.00    (#   2303:20  Unique         1.93, 2.56 A)
 &rst
  ixpk= 2303, nxpk= 20, iat= 658,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 651, 652,
 &end
#
#    0 AMB  20-2:2304   143 VAL  HB          5.50    (#   2304:20  Single Ambig)
 &rst
  ixpk= 2304, nxpk= 20, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 369, 370, 371, 373, 374, 375, 369, 370, 371, 373,
       374, 375,2146,2147,2148,2150,2151,2152,
 &end
#
#  144 ASN  HN          143 VAL  HB          5.50    (#   2306:20  Unique         2.36, 2.43 A)
 &rst
  ixpk= 2306, nxpk= 20, iat=2123,2111, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2307     6 LEU  HG          5.50    (#   2307:20  Single Ambig)
 &rst
  ixpk= 2307, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 495, 496, 497, 738, 739, 740, 742, 743, 744,
 &end
#
#   25 LYS  HG+          25 LYS  HB-         5.50    (#   2308:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 2308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 345, 346,
 igr2= 342, 343,
 &end
#
#   25 LYS  HG+          25 LYS  HB+         5.50    (#   2309:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 2309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 345, 346,
 igr2= 342, 343,
 &end
#
#    0 AMB  20-2:2310     0 AMB  20-1:2310   5.50    (#   2310:20  Double Ambig)
 &rst
  ixpk= 2310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 256, 257, 258, 774, 775,1116,1117,
 igr2= 240,1081,1082,
 &end
#
#   25 LYS  HG-          25 LYS  HB-         4.50    (#   2311:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 2311, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 345, 346,
 igr2= 342, 343,
 &end
#
#  139 LEU  MDY          25 LYS  HB-         5.50    (#   2312:20  Unique         2.10, 4.28 A)
 &rst
  ixpk= 2312, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2055,2056,2057,2059,2060,2061,
 igr2= 342, 343,
 &end
#
#  139 LEU  MDY          25 LYS  HB+         7.00    (#   2313:20  Unique         2.10, 4.28 A)
 &rst
  ixpk= 2313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2055,2056,2057,2059,2060,2061,
 igr2= 342, 343,
 &end
#
#    0 AMB  20-2:2314     0 AMB  20-1:2314   4.50    (#   2314:20  Double Ambig)
 &rst
  ixpk= 2314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 362,1094,
 igr2= 342, 343,1113,1114,
 &end
#
#    0 AMB  20-2:2319     6 LEU  HG          3.50    (#   2319:20  Single Ambig)
 &rst
  ixpk= 2319, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 &end
#
#    0 AMB  20-2:2320     6 LEU  HG          7.00    (#   2320:20  Single Ambig)
 &rst
  ixpk= 2320, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 256, 257, 258, 510, 774, 775,
 &end
#
#  128 HIS  HA          128 HIS  HB+         7.00    (#   2322:20  Unique         2.40, 2.73 A)
 &rst
  ixpk= 2322, nxpk= 20, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1883,1884,
 &end
#
#   69 PHE  HN           68 PRO  HB+         7.00    (#   2325:20  Unique         3.02, 3.57 A)
 &rst
  ixpk= 2325, nxpk= 20, iat= 975,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 968, 969,
 &end
#
#    0 AMB  20-2:2326    75 GLU  HB-         7.00    (#   2326:20  Single Ambig)
 &rst
  ixpk= 2326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=1067,1068,1045,1046,
 igr2=1081,1082,
 &end
#
#  121 LEU  MDX         138 TRP  HB+         5.50    (#   2328:20  Unique         2.02, 4.33 A)
 &rst
  ixpk= 2328, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1764,1765,1766,1768,1769,1770,
 igr2=2026,2027,
 &end
#
#  142 TRP  HE3         138 TRP  HB+         7.00    (#   2330:20  Unique         5.46, 6.30 A)
 &rst
  ixpk= 2330, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2026,2027,
 &end
#
#  142 TRP  HE3         138 TRP  HB+         7.00    (#   2331:20  Unique         5.46, 6.30 A)
 &rst
  ixpk= 2331, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2026,2027,
 &end
#
#  138 TRP  HN          138 TRP  HB+         4.50    (#   2332:20  Unique         2.08, 2.73 A)
 &rst
  ixpk= 2332, nxpk= 20, iat=2022,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2026,2027,
 &end
#
#    0 AMB  20-2:2333     0 AMB  20-1:2333   7.00    (#   2333:20  Double Ambig)
 &rst
  ixpk= 2333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=2046,2030,2041,
 igr2=2026,2027,2026,2027,2026,2027,
 &end
#
#   94 GLU  HN           94 GLU  HB+         5.50    (#   2335:20  Unique         2.40, 3.30 A)
 &rst
  ixpk= 2335, nxpk= 20, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1365,1366,
 &end
#
#   74 GLN  HA           74 GLN  HB-         4.50    (#   2336:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 2336, nxpk= 20, iat=1062,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1064,1065,
 &end
#
#   94 GLU  HA           94 GLU  HB+         4.50    (#   2337:20  Unique         2.24, 2.76 A)
 &rst
  ixpk= 2337, nxpk= 20, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1365,1366,
 &end
#
#   74 GLN  HA           74 GLN  HB+         5.50    (#   2338:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 2338, nxpk= 20, iat=1062,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1064,1065,
 &end
#
#    0 AMB  20-2:2339     0 AMB  20-1:2339   5.50    (#   2339:20  Double Ambig)
 &rst
  ixpk= 2339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1079,1321,1322,1413,1560,
 igr2=1064,1065,1341,1342,
 &end
#
#   77 LYS  HA           77 LYS  HB+         4.50    (#   2340:20  Unique         2.61, 2.81 A)
 &rst
  ixpk= 2340, nxpk= 20, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1113,1114,
 &end
#
#  136 GLU  HA          136 GLU  HB+         3.50    (#   2347:20  Unique         2.38, 2.45 A)
 &rst
  ixpk= 2347, nxpk= 20, iat=1994,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1996,1997,
 &end
#
#    0 AMB  20-2:2349     0 AMB  20-1:2349   5.50    (#   2349:20  Double Ambig)
 &rst
  ixpk= 2349, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1587,1588,1268,1269,1270,
 igr2=1547,1548,1547,1548,
 &end
#
#    0 AMB  20-2:2350     0 AMB  20-1:2350   7.00    (#   2350:20  Double Ambig)
 &rst
  ixpk= 2350, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.05, r4=13.55,
 igr1= 348, 349,1562,1563,1564, 348, 349,
 igr2= 398, 399,1547,1548,1996,1997,
 &end
#
#    0 AMB  20-2:2351   110 LYS  HD-         5.50    (#   2351:20  Single Ambig)
 &rst
  ixpk= 2351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1615,1616,1615,1616,
 igr2=1612,1613,
 &end
#
#   21 HIS  HA           24 GLU  HB+         5.50    (#   2352:20  Unique         2.73, 3.17 A)
 &rst
  ixpk= 2352, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 327, 328,
 &end
#
#   73 LEU  MDY         108 GLU  HB-         7.00    (#   2353:20  Unique         2.42, 4.31 A)
 &rst
  ixpk= 2353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1572,1573,
 &end
#
#    0 AMB  20-2:2354     0 AMB  20-1:2354   7.00    (#   2354:20  Double Ambig)
 &rst
  ixpk= 2354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1= 348, 349, 348, 349,
 igr2= 327, 328, 398, 399,
 &end
#
#    0 AMB  20-2:2355     0 AMB  20-1:2355   7.00    (#   2355:20  Double Ambig)
 &rst
  ixpk= 2355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1330,1331,1526,
 igr2=1612,1613,1612,1613,1612,1613,
 &end
#
#   73 LEU  MDY         108 GLU  HB+         7.00    (#   2356:20  Unique         2.42, 4.31 A)
 &rst
  ixpk= 2356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1572,1573,
 &end
#
#    0 AMB  20-2:2357   108 GLU  HB-         4.50    (#   2357:20  Single Ambig)
 &rst
  ixpk= 2357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1526,1642,1643,
 igr2=1572,1573,
 &end
#
#   74 GLN  HE2+        108 GLU  HB-         7.00    (#   2358:20  Unique         3.82, 4.90 A)
 &rst
  ixpk= 2358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1072,1073,
 igr2=1572,1573,
 &end
#
#    0 AMB  20-2:2359     0 AMB  20-1:2359   7.00    (#   2359:20  Double Ambig)
 &rst
  ixpk= 2359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1072,1073,1072,1073,
 igr2=1064,1065,1572,1573,
 &end
#
#    0 AMB  20-2:2360     0 AMB  20-1:2360   3.50    (#   2360:20  Double Ambig)
 &rst
  ixpk= 2360, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 330, 331, 401, 402,
 igr2= 327, 328, 398, 399,
 &end
#
#   24 GLU  HN           24 GLU  HB-         4.50    (#   2361:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 2361, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 327, 328,
 &end
#
#   73 LEU  MDY         108 GLU  HB-         7.00    (#   2362:20  Unique         2.42, 4.31 A)
 &rst
  ixpk= 2362, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1572,1573,
 &end
#
#    0 AMB  20-2:2363   108 GLU  HB-         5.50    (#   2363:20  Single Ambig)
 &rst
  ixpk= 2363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1119,1120,1562,1563,1564,
 igr2=1572,1573,
 &end
#
#  112 SER  HA          108 GLU  HB-         7.00    (#   2364:20  Unique         5.51, 6.41 A)
 &rst
  ixpk= 2364, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1572,1573,
 &end
#
#   27 GLU  HN            0 AMB  20-1:2365   7.00    (#   2365:20  Single Ambig)
 &rst
  ixpk= 2365, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 398, 399, 327, 328,
 &end
#
#   20 GLU  HN           24 GLU  HB+         7.00    (#   2366:20  Unique         6.70, 7.27 A)
 &rst
  ixpk= 2366, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 327, 328,
 &end
#
#    0 AMB  20-2:2367     0 AMB  20-1:2367   7.00    (#   2367:20  Double Ambig)
 &rst
  ixpk= 2367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 995,1077,
 igr2=1020,1021,1020,1021,1572,1573,
 &end
#
#  109 LEU  HN          108 GLU  HB-         7.00    (#   2368:20  Unique         2.71, 3.15 A)
 &rst
  ixpk= 2368, nxpk= 20, iat=1583,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1572,1573,
 &end
#
#  109 LEU  HN          108 GLU  HB-         7.00    (#   2369:20  Unique         2.71, 3.15 A)
 &rst
  ixpk= 2369, nxpk= 20, iat=1583,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1572,1573,
 &end
#
#   20 GLU  HN           20 GLU  HB+         7.00    (#   2370:20  Unique         2.07, 2.58 A)
 &rst
  ixpk= 2370, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 266, 267,
 &end
#
#  106 GLU  HN          106 GLU  HB+         4.50    (#   2372:20  Unique         2.16, 3.02 A)
 &rst
  ixpk= 2372, nxpk= 20, iat=1543,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1547,1548,
 &end
#
#    0 AMB  20-2:2373     0 AMB  20-1:2373   4.50    (#   2373:20  Double Ambig)
 &rst
  ixpk= 2373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1679,1680,1122,1123,
 igr2=1676,1677,1119,1120,
 &end
#
#   18 VAL  HA           21 HIS  HB+         5.50    (#   2374:20  Unique         2.52, 3.30 A)
 &rst
  ixpk= 2374, nxpk= 20, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 281, 282,
 &end
#
#   18 VAL  HA           21 HIS  HB-         5.50    (#   2375:20  Unique         2.52, 3.30 A)
 &rst
  ixpk= 2375, nxpk= 20, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 281, 282,
 &end
#
#   21 HIS  HA           21 HIS  HB+         7.00    (#   2376:20  Unique         2.40, 2.73 A)
 &rst
  ixpk= 2376, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 281, 282,
 &end
#
#   21 HIS  HA           21 HIS  HB-         7.00    (#   2377:20  Unique         2.40, 2.73 A)
 &rst
  ixpk= 2377, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 281, 282,
 &end
#
#   21 HIS  HN           21 HIS  HB+         5.50    (#   2378:20  Unique         2.41, 2.53 A)
 &rst
  ixpk= 2378, nxpk= 20, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 281, 282,
 &end
#
#   24 GLU  HA           24 GLU  HB-         3.50    (#   2379:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 2379, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 327, 328,
 &end
#
#   20 GLU  HN            0 AMB  20-1:2381   7.00    (#   2381:20  Single Ambig)
 &rst
  ixpk= 2381, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 266, 267, 266, 267,
 &end
#
#   20 GLU  HN           20 GLU  HB-         7.00    (#   2382:20  Unique         2.07, 2.58 A)
 &rst
  ixpk= 2382, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 266, 267,
 &end
#
#   78 PRO  HD-          76 GLN  HB-         7.00    (#   2383:20  Unique         2.21, 3.95 A)
 &rst
  ixpk= 2383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1132,1133,
 igr2=1096,1097,
 &end
#
#   78 PRO  HD-          76 GLN  HB+         7.00    (#   2384:20  Unique         2.21, 3.95 A)
 &rst
  ixpk= 2384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1132,1133,
 igr2=1096,1097,
 &end
#
#    0 AMB  20-2:2385    68 PRO  HG-         7.00    (#   2385:20  Single Ambig)
 &rst
  ixpk= 2385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 145, 971,
 igr2= 965, 966,
 &end
#
#   35 THR  HA            6 LEU  MDX         7.00    (#   2388:20  Unique         4.19, 5.00 A)
 &rst
  ixpk= 2388, nxpk= 20, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#   23 ALA  HN            6 LEU  MDX         7.00    (#   2389:20  Unique         3.78, 5.40 A)
 &rst
  ixpk= 2389, nxpk= 20, iat= 313,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#   21 HIS  HN            0 AMB  20-1:2390   7.00    (#   2390:20  Single Ambig)
 &rst
  ixpk= 2390, nxpk= 20, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2391     0 AMB  20-1:2391   3.50    (#   2391:20  Double Ambig)
 &rst
  ixpk= 2391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 269, 270, 269, 270,
 igr2= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2393     0 AMB  20-1:2393   7.00    (#   2393:20  Double Ambig)
 &rst
  ixpk= 2393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.82, r4=15.32,
 igr1=  68,  69,  70, 588, 589, 590, 592, 593, 594,1166,
      1167,1168,1170,1171,1172,
 igr2= 602, 603, 602, 603, 602, 603,
 &end
#
#   66 LEU  MDX          68 PRO  HG-         7.00    (#   2394:20  Unique         2.60, 6.68 A)
 &rst
  ixpk= 2394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 965, 966,
 &end
#
#   24 GLU  HA           27 GLU  HB+         4.50    (#   2395:20  Unique         2.69, 3.55 A)
 &rst
  ixpk= 2395, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   27 GLU  HA           27 GLU  HB+         4.50    (#   2396:20  Unique         2.63, 2.82 A)
 &rst
  ixpk= 2396, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#  116 GLN  HG+         116 GLN  HB-         5.50    (#   2398:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 2398, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1695,1696,
 igr2=1692,1693,
 &end
#
#  110 LYS  HE-         116 GLN  HB-         5.50    (#   2399:20  Unique         2.00, 3.46 A)
 &rst
  ixpk= 2399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1615,1616,
 igr2=1692,1693,
 &end
#
#  116 GLN  HE2-        116 GLN  HB-         5.50    (#   2400:20  Unique         4.09, 4.50 A)
 &rst
  ixpk= 2400, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1700,1701,
 igr2=1692,1693,
 &end
#
#    0 AMB  20-2:2401   116 GLN  HB-         7.00    (#   2401:20  Single Ambig)
 &rst
  ixpk= 2401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.27, r4=10.77,
 igr1=1247,1251,1245,1253,1688,
 igr2=1692,1693,
 &end
#
#  116 GLN  HG-         116 GLN  HB+         5.50    (#   2403:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 2403, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1695,1696,
 igr2=1692,1693,
 &end
#
#   88 ILE  MG2          90 ILE  HG1-        7.00    (#   2406:20  Unique         5.26, 6.41 A)
 &rst
  ixpk= 2406, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1280,1281,1282,
 igr2=1310,1311,
 &end
#
#  142 TRP  HA          142 TRP  HB-         7.00    (#   2407:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 2407, nxpk= 20, iat=2085,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2087,2088,
 &end
#
#   41 LEU  HA           41 LEU  HG          5.50    (#   2408:20  Unique         2.15, 2.18 A)
 &rst
  ixpk= 2408, nxpk= 20, iat= 581, 586, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2410     0 AMB  20-1:2410   5.50    (#   2410:20  Double Ambig)
 &rst
  ixpk= 2410, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1=1764,1765,1766,1768,1769,1770,2113,2114,2115,2117,
      2118,2119,2055,2056,2057,2059,2060,2061,
 igr2=2087,2088,2087,2088,2087,2088,
 &end
#
#  142 TRP  HA          142 TRP  HB+         7.00    (#   2411:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 2411, nxpk= 20, iat=2085,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2087,2088,
 &end
#
#  142 TRP  HE3         142 TRP  HB+         5.50    (#   2412:20  Unique         2.41, 3.18 A)
 &rst
  ixpk= 2412, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2087,2088,
 &end
#
#  143 VAL  HN          142 TRP  HB+         4.50    (#   2413:20  Unique         2.37, 3.18 A)
 &rst
  ixpk= 2413, nxpk= 20, iat=2107,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2087,2088,
 &end
#
#   49 ILE  HN           49 ILE  HG1-        7.00    (#   2416:20  Unique         2.41, 3.33 A)
 &rst
  ixpk= 2416, nxpk= 20, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 696, 697,
 &end
#
#   51 LEU  MDY          51 LEU  HG          4.50    (#   2417:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2417, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  20-2:2418     4 ILE  HG1-        7.00    (#   2418:20  Single Ambig)
 &rst
  ixpk= 2418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 696, 697,  47,
 igr2=  53,  54,
 &end
#
#   49 ILE  HB            4 ILE  HG1-        7.00    (#   2419:20  Unique         1.97, 2.85 A)
 &rst
  ixpk= 2419, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  53,  54,
 &end
#
#   49 ILE  HN           49 ILE  HG1-        5.50    (#   2420:20  Unique         2.41, 3.33 A)
 &rst
  ixpk= 2420, nxpk= 20, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 696, 697,
 &end
#
#    4 ILE  MD1           4 ILE  HG1+        7.00    (#   2421:20  Unique         2.35, 2.62 A)
 &rst
  ixpk= 2421, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  56,  57,  58,
 igr2=  53,  54,
 &end
#
#  123 ILE  MG2         123 ILE  HG1-        4.50    (#   2422:20  Unique         2.25, 3.12 A)
 &rst
  ixpk= 2422, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1802,1803,1804,
 igr2=1806,1807,
 &end
#
#    0 AMB  20-2:2423     0 AMB  20-1:2423   4.50    (#   2423:20  Double Ambig)
 &rst
  ixpk= 2423, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 696, 697,  47,
 igr2=  53,  54,  53,  54,
 &end
#
#    4 ILE  HA            4 ILE  HG1+        5.50    (#   2424:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 2424, nxpk= 20, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  53,  54,
 &end
#
#    3 ASP  HB-           4 ILE  HG1-        7.00    (#   2425:20  Unique         2.61, 4.13 A)
 &rst
  ixpk= 2425, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=  35,  36,
 igr2=  53,  54,
 &end
#
#    0 AMB  20-2:2426     7 ILE  HG1-        7.00    (#   2426:20  Single Ambig)
 &rst
  ixpk= 2426, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.34, r4=12.84,
 igr1=  68,  69,  70, 512, 513, 514, 516, 517, 518, 754,
       755, 756, 758, 759, 760,
 igr2= 105, 106,
 &end
#
#   49 ILE  HB           49 ILE  HG1+        7.00    (#   2427:20  Unique         2.43, 2.46 A)
 &rst
  ixpk= 2427, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 696, 697,
 &end
#
#   49 ILE  HA           49 ILE  HG1+        5.50    (#   2428:20  Unique         3.16, 3.57 A)
 &rst
  ixpk= 2428, nxpk= 20, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 696, 697,
 &end
#
#   25 LYS  HE-          25 LYS  HD+         7.00    (#   2429:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 2429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 351, 352,
 igr2= 348, 349,
 &end
#
#    0 AMB  20-2:2430     0 AMB  20-1:2430   7.00    (#   2430:20  Double Ambig)
 &rst
  ixpk= 2430, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1615,1616,1223,1224,
 igr2=1609,1610,1220,1221,
 &end
#
#   25 LYS  HA           25 LYS  HD+         4.50    (#   2431:20  Unique         2.21, 2.99 A)
 &rst
  ixpk= 2431, nxpk= 20, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 348, 349,
 &end
#
#    0 AMB  20-2:2432     0 AMB  20-1:2432   7.00    (#   2432:20  Double Ambig)
 &rst
  ixpk= 2432, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.34, r4=12.84,
 igr1=  53,  54,1528,1529,1692,1693,
 igr2= 696, 697,1531,1609,1610,
 &end
#
#   22 LEU  HB-          53 ILE  HG1+        4.50    (#   2433:20  Unique         3.86, 4.86 A)
 &rst
  ixpk= 2433, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 298, 299,
 igr2= 774, 775,
 &end
#
#    0 AMB  20-2:2434     0 AMB  20-1:2434   5.50    (#   2434:20  Double Ambig)
 &rst
  ixpk= 2434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 505, 750,
 igr2= 510, 774, 775,
 &end
#
#    0 AMB  20-2:2435    36 LEU  HG          7.00    (#   2435:20  Single Ambig)
 &rst
  ixpk= 2435, nxpk= 20, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=  80,  81, 478, 479,
 &end
#
#   88 ILE  MD1          53 ILE  HG1+        5.50    (#   2437:20  Unique         2.05, 3.28 A)
 &rst
  ixpk= 2437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1287,1288,1289,
 igr2= 774, 775,
 &end
#
#   51 LEU  MDX          51 LEU  HG          4.50    (#   2438:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2438, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 738, 739, 740, 742, 743, 744,
 &end
#
#   51 LEU  HB+          51 LEU  HG          5.50    (#   2439:20  Unique         2.38, 2.71 A)
 &rst
  ixpk= 2439, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   51 LEU  HB+          51 LEU  HG          5.50    (#   2440:20  Unique         2.38, 2.71 A)
 &rst
  ixpk= 2440, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#    0 AMB  20-2:2441     0 AMB  20-1:2441   3.50    (#   2441:20  Double Ambig)
 &rst
  ixpk= 2441, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1166,1167,1168,1170,1171,1172, 369, 370, 371, 373,
       374, 375,
 igr2=1135,1136, 367,
 &end
#
#    0 AMB  20-2:2442     0 AMB  20-1:2442   5.50    (#   2442:20  Double Ambig)
 &rst
  ixpk= 2442, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 362,1111,
 igr2= 367,1135,1136,
 &end
#
#    0 AMB  20-2:2445     0 AMB  20-1:2445   7.00    (#   2445:20  Double Ambig)
 &rst
  ixpk= 2445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 362,1111,
 igr2= 367,1135,1136,
 &end
#
#    0 AMB  20-2:2446     0 AMB  20-1:2446   5.50    (#   2446:20  Double Ambig)
 &rst
  ixpk= 2446, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.95, r4=10.45,
 igr1= 541, 542, 296,1994,2158,
 igr2= 586, 348, 349, 348, 349,1220,1221,
 &end
#
#   84 ARG  HA           84 ARG  HG-         7.00    (#   2448:20  Unique         3.55, 3.84 A)
 &rst
  ixpk= 2448, nxpk= 20, iat=1215,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1220,1221,
 &end
#
#   25 LYS  HN           25 LYS  HD+         7.00    (#   2449:20  Unique         2.37, 3.04 A)
 &rst
  ixpk= 2449, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 348, 349,
 &end
#
#    0 AMB  20-2:2450   123 ILE  HG1-        7.00    (#   2450:20  Single Ambig)
 &rst
  ixpk= 2450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1928,1929, 254,
 igr2=1806,1807,
 &end
#
#  123 ILE  HA          123 ILE  HG1-        7.00    (#   2451:20  Unique         3.40, 3.84 A)
 &rst
  ixpk= 2451, nxpk= 20, iat=1798,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1806,1807,
 &end
#
#   36 LEU  HN           36 LEU  HG          5.50    (#   2452:20  Unique         2.37, 2.39 A)
 &rst
  ixpk= 2452, nxpk= 20, iat= 503, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2453     0 AMB  20-1:2453   5.50    (#   2453:20  Double Ambig)
 &rst
  ixpk= 2453, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 242, 243, 244, 246, 247, 248,1809,1810,1811, 770,
       771, 772,
 igr2=1806,1807,1806,1807,1806,1807,
 &end
#
#    0 AMB  20-2:2454    51 LEU  HG          4.50    (#   2454:20  Single Ambig)
 &rst
  ixpk= 2454, nxpk= 20, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  49,  50,  51, 692, 693, 694,
 &end
#
#   78 PRO  HD-          78 PRO  HG+         5.50    (#   2455:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1132,1133,
 igr2=1135,1136,
 &end
#
#    0 AMB  20-2:2457     0 AMB  20-1:2457   5.50    (#   2457:20  Double Ambig)
 &rst
  ixpk= 2457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1615,1616,1223,1224,
 igr2=1609,1610,1220,1221,
 &end
#
#   40 LEU  HA           40 LEU  HG          5.50    (#   2458:20  Unique         2.94, 2.95 A)
 &rst
  ixpk= 2458, nxpk= 20, iat= 562, 567, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   83 VAL  HA           84 ARG  HG+         7.00    (#   2460:20  Unique         3.39, 4.90 A)
 &rst
  ixpk= 2460, nxpk= 20, iat=1199,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1220,1221,
 &end
#
#  123 ILE  HA          123 ILE  HG1-        5.50    (#   2461:20  Unique         3.40, 3.84 A)
 &rst
  ixpk= 2461, nxpk= 20, iat=1798,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1806,1807,
 &end
#
#  130 ILE  HB          130 ILE  HG1-        5.50    (#   2463:20  Unique         2.44, 2.62 A)
 &rst
  ixpk= 2463, nxpk= 20, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1918,1919,
 &end
#
#   84 ARG  HD-          84 ARG  HG-         5.50    (#   2464:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 2464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1223,1224,
 igr2=1220,1221,
 &end
#
#  130 ILE  HA          130 ILE  HG1-        7.00    (#   2465:20  Unique         2.07, 2.93 A)
 &rst
  ixpk= 2465, nxpk= 20, iat=1910,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1918,1919,
 &end
#
#  130 ILE  HN          130 ILE  HG1-        7.00    (#   2467:20  Unique         3.74, 4.23 A)
 &rst
  ixpk= 2467, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1918,1919,
 &end
#
#    0 AMB  20-2:2468     0 AMB  20-1:2468   7.00    (#   2468:20  Double Ambig)
 &rst
  ixpk= 2468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1908,1197,
 igr2=1918,1919,1164,
 &end
#
#  130 ILE  HN          130 ILE  HG1+        7.00    (#   2469:20  Unique         3.74, 4.23 A)
 &rst
  ixpk= 2469, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1918,1919,
 &end
#
#  105 LEU  HG          105 LEU  MDX         3.50    (#   2472:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2472, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:2477     0 AMB  20-1:2477   5.50    (#   2477:20  Double Ambig)
 &rst
  ixpk= 2477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1806,1807, 345, 346,
 igr2=1764,1765,1766,1768,1769,1770,2055,2056,2057,2059,
      2060,2061,
 &end
#
#   26 LEU  HA          139 LEU  MDY         7.00    (#   2478:20  Unique         2.29, 4.51 A)
 &rst
  ixpk= 2478, nxpk= 20, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#  121 LEU  HN          121 LEU  MDY         7.00    (#   2479:20  Unique         3.26, 5.07 A)
 &rst
  ixpk= 2479, nxpk= 20, iat=1755,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1764,1765,1766,1768,1769,1770,
 &end
#
#  142 TRP  HE3         139 LEU  MDY         7.00    (#   2480:20  Unique         2.20, 4.90 A)
 &rst
  ixpk= 2480, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  20-2:2481   105 LEU  MDX         7.00    (#   2481:20  Single Ambig)
 &rst
  ixpk= 2481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 979, 980, 999,1000,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:2482     0 AMB  20-1:2482   7.00    (#   2482:20  Double Ambig)
 &rst
  ixpk= 2482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.34, r4=13.84,
 igr1= 787, 788,2026,2027,
 igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
       374, 375,
 &end
#
#  145 LEU  HN          145 LEU  HG          7.00    (#   2483:20  Unique         4.15, 4.28 A)
 &rst
  ixpk= 2483, nxpk= 20, iat=2137,2144, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   44 LEU  MDX          44 LEU  HG          5.50    (#   2485:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 2485, nxpk= 20, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#   73 LEU  MDY         109 LEU  HG          7.00    (#   2487:20  Unique         2.95, 4.17 A)
 &rst
  ixpk= 2487, nxpk= 20, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:2488     0 AMB  20-1:2488   7.00    (#   2488:20  Double Ambig)
 &rst
  ixpk= 2488, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 921, 922,  35,  36,
 igr2=1509,1510, 632,
 &end
#
#    0 AMB  20-2:2489   109 LEU  HG          5.50    (#   2489:20  Single Ambig)
 &rst
  ixpk= 2489, nxpk= 20, iat=  -1,1590, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1545,1585,
 &end
#
#  109 LEU  HN          109 LEU  HG          7.00    (#   2490:20  Unique         2.37, 2.41 A)
 &rst
  ixpk= 2490, nxpk= 20, iat=1583,1590, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  104 LYS  HN          104 LYS  HG+         7.00    (#   2494:20  Unique         2.43, 2.69 A)
 &rst
  ixpk= 2494, nxpk= 20, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1509,1510,
 &end
#
#  104 LYS  HN          104 LYS  HG-         5.50    (#   2497:20  Unique         2.43, 2.69 A)
 &rst
  ixpk= 2497, nxpk= 20, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1509,1510,
 &end
#
#   73 LEU  HN           73 LEU  HG          7.00    (#   2498:20  Unique         2.51, 2.58 A)
 &rst
  ixpk= 2498, nxpk= 20, iat=1041,1048, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  104 LYS  HA          104 LYS  HG-         7.00    (#   2499:20  Unique         2.29, 2.92 A)
 &rst
  ixpk= 2499, nxpk= 20, iat=1504,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1509,1510,
 &end
#
#   42 GLU  HG-          41 LEU  MDX         5.50    (#   2500:20  Unique         2.53, 5.92 A)
 &rst
  ixpk= 2500, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 605, 606,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   36 LEU  HG           36 LEU  MDX         4.50    (#   2501:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 2501, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 512, 513, 514, 516, 517, 518,
 &end
#
#    0 AMB  20-2:2504    73 LEU  MDY         7.00    (#   2504:20  Single Ambig)
 &rst
  ixpk= 2504, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.34, r4=12.84,
 igr1=1526,1642,1643,1132,1133,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  20-2:2508    26 LEU  MDY         5.50    (#   2508:20  Single Ambig)
 &rst
  ixpk= 2508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 413, 414, 415, 733, 734,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:2509    41 LEU  MDX         7.00    (#   2509:20  Single Ambig)
 &rst
  ixpk= 2509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1043, 979, 980,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   26 LEU  HA           26 LEU  MDY         7.00    (#   2511:20  Unique         1.99, 3.10 A)
 &rst
  ixpk= 2511, nxpk= 20, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:2513    41 LEU  MDX         7.00    (#   2513:20  Single Ambig)
 &rst
  ixpk= 2513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1041,1031,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:2514    73 LEU  MDY         7.00    (#   2514:20  Single Ambig)
 &rst
  ixpk= 2514, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.28, r4=14.78,
 igr1=1533,1534,1535,1537,1538,1539, 588, 589, 590, 592,
       593, 594,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  108 GLU  HB+          73 LEU  MDY         7.00    (#   2515:20  Unique         2.42, 4.31 A)
 &rst
  ixpk= 2515, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1572,1573,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  108 GLU  HB-          73 LEU  MDY         7.00    (#   2516:20  Unique         2.42, 4.31 A)
 &rst
  ixpk= 2516, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1572,1573,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HN           73 LEU  MDY         7.00    (#   2518:20  Unique         3.86, 4.51 A)
 &rst
  ixpk= 2518, nxpk= 20, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  142 TRP  HE3         121 LEU  HG          7.00    (#   2520:20  Unique         5.86, 6.40 A)
 &rst
  ixpk= 2520, nxpk= 20, iat=2102,1762, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    7 ILE  HA            6 LEU  MDY         7.00    (#   2522:20  Unique         5.04, 6.69 A)
 &rst
  ixpk= 2522, nxpk= 20, iat=  97,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HA            6 LEU  MDY         7.00    (#   2523:20  Unique         2.23, 3.06 A)
 &rst
  ixpk= 2523, nxpk= 20, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:2524     6 LEU  MDY         7.00    (#   2524:20  Single Ambig)
 &rst
  ixpk= 2524, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 462, 116,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:2525     0 AMB  20-1:2525   7.00    (#   2525:20  Double Ambig)
 &rst
  ixpk= 2525, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 560, 252,
 igr2= 569, 570, 571, 573, 574, 575,  85,  86,  87,  89,
        90,  91,
 &end
#
#  147 LYS  HN          147 LYS  HG+         5.50    (#   2527:20  Unique         3.50, 4.00 A)
 &rst
  ixpk= 2527, nxpk= 20, iat=2175,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2182,2183,
 &end
#
#  147 LYS  HN          147 LYS  HG-         7.00    (#   2528:20  Unique         3.50, 4.00 A)
 &rst
  ixpk= 2528, nxpk= 20, iat=2175,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2182,2183,
 &end
#
#   88 ILE  MG2          88 ILE  HG1+        5.50    (#   2531:20  Unique         2.25, 3.50 A)
 &rst
  ixpk= 2531, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1280,1281,1282,
 igr2=1284,1285,
 &end
#
#    0 AMB  20-2:2535   109 LEU  MDY         7.00    (#   2535:20  Single Ambig)
 &rst
  ixpk= 2535, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=1572,1573,1528,1529,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#   76 GLN  HE2+        109 LEU  MDY         5.50    (#   2536:20  Unique         6.44, 8.64 A)
 &rst
  ixpk= 2536, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1104,1105,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#    0 AMB  20-2:2539   109 LEU  MDX         5.50    (#   2539:20  Single Ambig)
 &rst
  ixpk= 2539, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1572,1573,1528,1529,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#   77 LYS  HE+          77 LYS  HG-         7.00    (#   2547:20  Unique         2.07, 3.05 A)
 &rst
  ixpk= 2547, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1122,1123,
 igr2=1116,1117,
 &end
#
#   77 LYS  HA           77 LYS  HG-         7.00    (#   2548:20  Unique         2.15, 2.78 A)
 &rst
  ixpk= 2548, nxpk= 20, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1116,1117,
 &end
#
#   77 LYS  HN           77 LYS  HG-         7.00    (#   2549:20  Unique         3.03, 3.23 A)
 &rst
  ixpk= 2549, nxpk= 20, iat=1109,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1116,1117,
 &end
#
#   77 LYS  HN           77 LYS  HG+         7.00    (#   2550:20  Unique         3.03, 3.23 A)
 &rst
  ixpk= 2550, nxpk= 20, iat=1109,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1116,1117,
 &end
#
#  111 ASN  HD2-         77 LYS  HG-         7.00    (#   2552:20  Unique         4.00, 5.05 A)
 &rst
  ixpk= 2552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1633,1634,
 igr2=1116,1117,
 &end
#
#  109 LEU  HA           73 LEU  MDX         7.00    (#   2553:20  Unique         2.95, 4.32 A)
 &rst
  ixpk= 2553, nxpk= 20, iat=1585,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  112 SER  HB+          73 LEU  MDX         7.00    (#   2554:20  Unique         3.68, 6.18 A)
 &rst
  ixpk= 2554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1642,1643,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  111 ASN  HD2+         73 LEU  MDX         7.00    (#   2555:20  Unique         5.66, 7.58 A)
 &rst
  ixpk= 2555, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1633,1634,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  HN           73 LEU  MDX         7.00    (#   2556:20  Unique         3.86, 4.51 A)
 &rst
  ixpk= 2556, nxpk= 20, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1050,1051,1052,1054,1055,1056,
 &end
#
#  143 VAL  HA          146 LEU  MDY         5.50    (#   2557:20  Unique         1.97, 4.02 A)
 &rst
  ixpk= 2557, nxpk= 20, iat=2109,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2165,2166,2167,2169,2170,2171,
 &end
#
#  109 LEU  HN          109 LEU  MDX         5.50    (#   2562:20  Unique         2.95, 4.29 A)
 &rst
  ixpk= 2562, nxpk= 20, iat=1583,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1592,1593,1594,1596,1597,1598,
 &end
#
#   73 LEU  MDY         105 LEU  MDY         7.00    (#   2564:20  Unique         2.01, 4.98 A)
 &rst
  ixpk= 2564, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1=1050,1051,1052,1054,1055,1056,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#  105 LEU  HB+         105 LEU  MDY         5.50    (#   2565:20  Unique         2.23, 3.48 A)
 &rst
  ixpk= 2565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1528,1529,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  20-2:2566   105 LEU  MDY         7.00    (#   2566:20  Single Ambig)
 &rst
  ixpk= 2566, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 979, 980, 999,1000,
 igr2=1533,1534,1535,1537,1538,1539,
 &end
#
#   25 LYS  HB+          25 LYS  HG+         4.50    (#   2568:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 2568, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 342, 343,
 igr2= 345, 346,
 &end
#
#   25 LYS  HD+          25 LYS  HG+         3.50    (#   2570:20  Unique         2.41, 2.58 A)
 &rst
  ixpk= 2570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 348, 349,
 igr2= 345, 346,
 &end
#
#  115 LYS  HB+         115 LYS  HG+         4.50    (#   2571:20  Unique         2.22, 2.72 A)
 &rst
  ixpk= 2571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1670,1671,
 igr2=1673,1674,
 &end
#
#    0 AMB  20-2:2572     0 AMB  20-1:2572   7.00    (#   2572:20  Double Ambig)
 &rst
  ixpk= 2572, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 296,1994,
 igr2= 345, 346, 345, 346,
 &end
#
#    0 AMB  20-2:2573    25 LYS  HG-         7.00    (#   2573:20  Single Ambig)
 &rst
  ixpk= 2573, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 296,1994,
 igr2= 345, 346,
 &end
#
#   25 LYS  HA           25 LYS  HG-         7.00    (#   2574:20  Unique         3.35, 3.57 A)
 &rst
  ixpk= 2574, nxpk= 20, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 345, 346,
 &end
#
#   25 LYS  HN           25 LYS  HG-         7.00    (#   2575:20  Unique         1.99, 2.77 A)
 &rst
  ixpk= 2575, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 345, 346,
 &end
#
#   50 TRP  HD1          44 LEU  MDX         7.00    (#   2593:20  Unique         4.20, 6.39 A)
 &rst
  ixpk= 2593, nxpk= 20, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   44 LEU  HN           44 LEU  MDX         7.00    (#   2594:20  Unique         3.61, 4.70 A)
 &rst
  ixpk= 2594, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 634, 635, 636, 638, 639, 640,
 &end
#
#   73 LEU  HA           41 LEU  MDY         7.00    (#   2596:20  Unique         3.21, 5.06 A)
 &rst
  ixpk= 2596, nxpk= 20, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   76 GLN  HE2+         41 LEU  MDY         3.50    (#   2599:20  Unique         2.12, 3.85 A)
 &rst
  ixpk= 2599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1104,1105,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#   41 LEU  HN           41 LEU  MDY         7.00    (#   2600:20  Unique         3.75, 5.37 A)
 &rst
  ixpk= 2600, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 588, 589, 590, 592, 593, 594,
 &end
#
#    0 AMB  20-2:2602    26 LEU  MDX         3.50    (#   2602:20  Single Ambig)
 &rst
  ixpk= 2602, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 298, 299, 466, 467, 468,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:2603     0 AMB  20-1:2603   4.50    (#   2603:20  Double Ambig)
 &rst
  ixpk= 2603, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 413, 414, 415,1217,1218,
 igr2= 369, 370, 371, 373, 374, 375,1711,1712,1713,
 &end
#
#   26 LEU  HB+          26 LEU  MDX         7.00    (#   2604:20  Unique         2.10, 3.48 A)
 &rst
  ixpk= 2604, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 364, 365,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:2605     0 AMB  20-1:2605   5.50    (#   2605:20  Double Ambig)
 &rst
  ixpk= 2605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.88, r4=11.38,
 igr1= 481, 482, 301,2050,2051,
 igr2= 512, 513, 514, 516, 517, 518, 369, 370, 371, 373,
       374, 375,
 &end
#
#  117 THR  HA          117 THR  MG2         3.50    (#   2606:20  Unique         2.34, 3.14 A)
 &rst
  ixpk= 2606, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1711,1712,1713,
 &end
#
#    0 AMB  20-2:2607   120 THR  MG2         7.00    (#   2607:20  Single Ambig)
 &rst
  ixpk= 2607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1700,1701,1350,
 igr2=1747,1748,1749,
 &end
#
#    0 AMB  20-2:2608     0 AMB  20-1:2608   7.00    (#   2608:20  Double Ambig)
 &rst
  ixpk= 2608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1=1401,1402, 617, 618,
 igr2=1747,1748,1749, 569, 570, 571, 573, 574, 575,
 &end
#
#   40 LEU  HB-          40 LEU  MDY         4.50    (#   2609:20  Unique         2.33, 3.28 A)
 &rst
  ixpk= 2609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 564, 565,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    0 AMB  20-2:2610     0 AMB  20-1:2610   3.50    (#   2610:20  Double Ambig)
 &rst
  ixpk= 2610, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1=2139,1721,1722,
 igr2=2146,2147,2148,2150,2151,2152,1711,1712,1713,
 &end
#
#  120 THR  HN          120 THR  MG2         5.50    (#   2611:20  Unique         1.96, 3.59 A)
 &rst
  ixpk= 2611, nxpk= 20, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1747,1748,1749,
 &end
#
#  118 GLY  HN          117 THR  MG2         7.00    (#   2612:20  Unique         2.13, 3.39 A)
 &rst
  ixpk= 2612, nxpk= 20, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1711,1712,1713,
 &end
#
#  120 THR  HB          120 THR  MG2         4.50    (#   2613:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2613, nxpk= 20, iat=1745,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1747,1748,1749,
 &end
#
#   18 VAL  HN           18 VAL  MGX         5.50    (#   2614:20  Unique         2.16, 3.86 A)
 &rst
  ixpk= 2614, nxpk= 20, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:2616    33 THR  MG2         5.50    (#   2616:20  Single Ambig)
 &rst
  ixpk= 2616, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 360, 313,
 igr2= 466, 467, 468,
 &end
#
#   27 GLU  HA           33 THR  MG2         5.50    (#   2617:20  Unique         2.37, 3.29 A)
 &rst
  ixpk= 2617, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 466, 467, 468,
 &end
#
#    0 AMB  20-2:2618    33 THR  MG2         7.00    (#   2618:20  Single Ambig)
 &rst
  ixpk= 2618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.12, r4=12.62,
 igr1=  56,  57,  58, 738, 739, 740, 742, 743, 744,
 igr2= 466, 467, 468,
 &end
#
#   86 GLY  HA+          51 LEU  MDY         5.50    (#   2619:20  Unique         2.42, 5.45 A)
 &rst
  ixpk= 2619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1259,1260,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#   87 ALA  HA           51 LEU  MDY         7.00    (#   2620:20  Unique         5.35, 7.64 A)
 &rst
  ixpk= 2620, nxpk= 20, iat=1266,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#  142 TRP  HE3          51 LEU  MDY         7.00    (#   2622:20  Unique         5.79, 7.09 A)
 &rst
  ixpk= 2622, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#   86 GLY  HN           51 LEU  MDY         7.00    (#   2623:20  Unique         3.69, 5.88 A)
 &rst
  ixpk= 2623, nxpk= 20, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 738, 739, 740, 742, 743, 744,
 &end
#
#   94 GLU  HA           97 THR  MG2         5.50    (#   2624:20  Unique         2.13, 4.11 A)
 &rst
  ixpk= 2624, nxpk= 20, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1415,1416,1417,
 &end
#
#   40 LEU  HB-          40 LEU  MDY         4.50    (#   2625:20  Unique         2.33, 3.28 A)
 &rst
  ixpk= 2625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 564, 565,
 igr2= 569, 570, 571, 573, 574, 575,
 &end
#
#    0 AMB  20-2:2626     0 AMB  20-1:2626   3.50    (#   2626:20  Double Ambig)
 &rst
  ixpk= 2626, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2141,2142,1806,1807,1806,1807,
 igr2=2146,2147,2148,2150,2151,2152, 303, 304, 305, 307,
       308, 309,1764,1765,1766,1768,1769,1770,
 &end
#
#    0 AMB  20-2:2627     0 AMB  20-1:2627   3.50    (#   2627:20  Double Ambig)
 &rst
  ixpk= 2627, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1757,1721,1722,
 igr2=1764,1765,1766,1768,1769,1770,2146,2147,2148,2150,
      2151,2152,
 &end
#
#    0 AMB  20-2:2628   145 LEU  MDX         5.50    (#   2628:20  Single Ambig)
 &rst
  ixpk= 2628, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2123,2132,2133,
 igr2=2146,2147,2148,2150,2151,2152,
 &end
#
#    0 AMB  20-2:2630    87 ALA  MB          7.00    (#   2630:20  Single Ambig)
 &rst
  ixpk= 2630, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.99, r4=11.49,
 igr1=1259,1260, 766,1295,1296,
 igr2=1268,1269,1270,
 &end
#
#  116 GLN  HE2+         87 ALA  MB          7.00    (#   2631:20  Unique         1.95, 3.34 A)
 &rst
  ixpk= 2631, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1700,1701,
 igr2=1268,1269,1270,
 &end
#
#  116 GLN  HE2-         87 ALA  MB          7.00    (#   2632:20  Unique         1.95, 3.34 A)
 &rst
  ixpk= 2632, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1700,1701,
 igr2=1268,1269,1270,
 &end
#
#    0 AMB  20-2:2634     0 AMB  20-1:2634   3.50    (#   2634:20  Double Ambig)
 &rst
  ixpk= 2634, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1413, 809,
 igr2=1415,1416,1417, 811, 812, 813,
 &end
#
#    0 AMB  20-2:2635    87 ALA  MB          7.00    (#   2635:20  Single Ambig)
 &rst
  ixpk= 2635, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1550,1551,1344,1345,1547,1548,
 igr2=1268,1269,1270,
 &end
#
#   97 THR  HN           97 THR  MG2         7.00    (#   2636:20  Unique         2.06, 3.44 A)
 &rst
  ixpk= 2636, nxpk= 20, iat=1409,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1415,1416,1417,
 &end
#
#    0 AMB  20-2:2639    56 THR  MG2         5.50    (#   2639:20  Single Ambig)
 &rst
  ixpk= 2639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 855, 856,1545,
 igr2= 811, 812, 813,
 &end
#
#    0 AMB  20-2:2643     0 AMB  20-1:2643   4.50    (#   2643:20  Double Ambig)
 &rst
  ixpk= 2643, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1=1203,1204,1205,1207,1208,1209, 108, 109, 110,
 igr2=1166,1167,1168,1170,1171,1172, 754, 755, 756, 758,
       759, 760,
 &end
#
#   23 ALA  MB           35 THR  MG2         7.00    (#   2644:20  Unique         2.42, 4.24 A)
 &rst
  ixpk= 2644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1= 317, 318, 319,
 igr2= 495, 496, 497,
 &end
#
#   18 VAL  HA           22 LEU  MDX         7.00    (#   2646:20  Unique         3.92, 5.89 A)
 &rst
  ixpk= 2646, nxpk= 20, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 303, 304, 305, 307, 308, 309,
 &end
#
#  121 LEU  HA          121 LEU  MDX         3.50    (#   2647:20  Unique         2.54, 4.12 A)
 &rst
  ixpk= 2647, nxpk= 20, iat=1757,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1764,1765,1766,1768,1769,1770,
 &end
#
#   80 LEU  HN           80 LEU  MDX         7.00    (#   2648:20  Unique         2.10, 3.55 A)
 &rst
  ixpk= 2648, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1166,1167,1168,1170,1171,1172,
 &end
#
#   20 GLU  HA           35 THR  MG2         7.00    (#   2649:20  Unique         2.15, 3.55 A)
 &rst
  ixpk= 2649, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 495, 496, 497,
 &end
#
#    0 AMB  20-2:2650     0 AMB  20-1:2650   3.50    (#   2650:20  Double Ambig)
 &rst
  ixpk= 2650, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 629, 630,1138,1139,1800,
 igr2=  68,  69,  70,1166,1167,1168,1170,1171,1172, 303,
       304, 305, 307, 308, 309,
 &end
#
#   51 LEU  HA           52 VAL  MGX         7.00    (#   2651:20  Unique         3.81, 5.63 A)
 &rst
  ixpk= 2651, nxpk= 20, iat= 731,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   54 SER  HB-          52 VAL  MGX         7.00    (#   2652:20  Unique         2.82, 5.65 A)
 &rst
  ixpk= 2652, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 787, 788,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#   50 TRP  HB+          52 VAL  MGX         7.00    (#   2653:20  Unique         4.45, 7.01 A)
 &rst
  ixpk= 2653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 709, 710,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#    0 AMB  20-2:2656    52 VAL  MGY         3.50    (#   2656:20  Single Ambig)
 &rst
  ixpk= 2656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  99,1268,1269,1270,
 igr2= 754, 755, 756, 758, 759, 760,
 &end
#
#    0 AMB  20-2:2657     0 AMB  20-1:2657   4.50    (#   2657:20  Double Ambig)
 &rst
  ixpk= 2657, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1135,1136,1135,1136,
 igr2=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 &end
#
#   88 ILE  MG2          18 VAL  MGY         5.50    (#   2658:20  Unique         3.36, 5.63 A)
 &rst
  ixpk= 2658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1280,1281,1282,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   22 LEU  HA           18 VAL  MGY         7.00    (#   2660:20  Unique         4.44, 6.36 A)
 &rst
  ixpk= 2660, nxpk= 20, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   19 ALA  HN           18 VAL  MGY         5.50    (#   2661:20  Unique         2.15, 4.05 A)
 &rst
  ixpk= 2661, nxpk= 20, iat= 252,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   50 TRP  HD1          83 VAL  MGX         7.00    (#   2663:20  Unique         2.14, 3.81 A)
 &rst
  ixpk= 2663, nxpk= 20, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   47 SER  HN           83 VAL  MGX         7.00    (#   2664:20  Unique         3.34, 4.49 A)
 &rst
  ixpk= 2664, nxpk= 20, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   84 ARG  HN           83 VAL  MGX         7.00    (#   2665:20  Unique         1.86, 3.82 A)
 &rst
  ixpk= 2665, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   83 VAL  HB           83 VAL  MGX         5.50    (#   2666:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2666, nxpk= 20, iat=1201,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   82 ALA  HN           83 VAL  MGX         7.00    (#   2667:20  Unique         3.03, 5.32 A)
 &rst
  ixpk= 2667, nxpk= 20, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#   50 TRP  HE1          83 VAL  MGX         7.00    (#   2668:20  Unique         2.89, 4.12 A)
 &rst
  ixpk= 2668, nxpk= 20, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:2676    72 ALA  MB          7.00    (#   2676:20  Single Ambig)
 &rst
  ixpk= 2676, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1099,1100,1099,1100,
 igr2=1035,1036,1037,
 &end
#
#   76 GLN  HE2+         72 ALA  MB          5.50    (#   2677:20  Unique         1.94, 3.18 A)
 &rst
  ixpk= 2677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1104,1105,
 igr2=1035,1036,1037,
 &end
#
#   76 GLN  HE2-         72 ALA  MB          7.00    (#   2678:20  Unique         1.94, 3.18 A)
 &rst
  ixpk= 2678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1104,1105,
 igr2=1035,1036,1037,
 &end
#
#    4 ILE  HB            2 ALA  MB          7.00    (#   2679:20  Unique         4.22, 5.21 A)
 &rst
  ixpk= 2679, nxpk= 20, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  25,  26,  27,
 &end
#
#   33 THR  HN            2 ALA  MB          7.00    (#   2681:20  Unique         2.80, 3.84 A)
 &rst
  ixpk= 2681, nxpk= 20, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  25,  26,  27,
 &end
#
#   49 ILE  HN           49 ILE  MG2         7.00    (#   2682:20  Unique         4.52, 4.78 A)
 &rst
  ixpk= 2682, nxpk= 20, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 692, 693, 694,
 &end
#
#   49 ILE  HA           83 VAL  MGY         7.00    (#   2685:20  Unique         2.39, 4.72 A)
 &rst
  ixpk= 2685, nxpk= 20, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  20-2:2686   114 ALA  MB          7.00    (#   2686:20  Single Ambig)
 &rst
  ixpk= 2686, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1642,1643, 660,
 igr2=1660,1661,1662,
 &end
#
#    0 AMB  20-2:2688    29 ALA  MB          7.00    (#   2688:20  Single Ambig)
 &rst
  ixpk= 2688, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 364, 365, 398, 399,
 igr2= 413, 414, 415,
 &end
#
#   30 GLY  HN           29 ALA  MB          7.00    (#   2690:20  Unique         2.92, 3.65 A)
 &rst
  ixpk= 2690, nxpk= 20, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 413, 414, 415,
 &end
#
#    0 AMB  20-2:2691   130 ILE  MG2         5.50    (#   2691:20  Single Ambig)
 &rst
  ixpk= 2691, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1934,1935,1931,1932,
 igr2=1914,1915,1916,
 &end
#
#    0 AMB  20-2:2692     0 AMB  20-1:2692   5.50    (#   2692:20  Double Ambig)
 &rst
  ixpk= 2692, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1321,1322, 809,
 igr2=1914,1915,1916,1306,1307,1308,
 &end
#
#    0 AMB  20-2:2693   130 ILE  MG2         7.00    (#   2693:20  Single Ambig)
 &rst
  ixpk= 2693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1321,1322,1910,
 igr2=1914,1915,1916,
 &end
#
#   55 SER  HA            0 AMB  20-1:2694   7.00    (#   2694:20  Single Ambig)
 &rst
  ixpk= 2694, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1306,1307,1308,1914,1915,1916,
 &end
#
#    0 AMB  20-2:2695   107 ALA  MB          5.50    (#   2695:20  Single Ambig)
 &rst
  ixpk= 2695, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1570,1492,
 igr2=1562,1563,1564,
 &end
#
#   59 ALA  HN           59 ALA  MB          5.50    (#   2697:20  Unique         2.22, 3.35 A)
 &rst
  ixpk= 2697, nxpk= 20, iat= 843,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 847, 848, 849,
 &end
#
#    0 AMB  20-2:2698   130 ILE  MG2         5.50    (#   2698:20  Single Ambig)
 &rst
  ixpk= 2698, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1321,1322,1910,
 igr2=1914,1915,1916,
 &end
#
#   91 GLY  HN          130 ILE  MG2         7.00    (#   2699:20  Unique         3.90, 5.93 A)
 &rst
  ixpk= 2699, nxpk= 20, iat=1319,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1914,1915,1916,
 &end
#
#    0 AMB  20-2:2701    19 ALA  MB          3.50    (#   2701:20  Single Ambig)
 &rst
  ixpk= 2701, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 495, 496, 497, 777, 778, 779,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:2702    46 ALA  MB          5.50    (#   2702:20  Single Ambig)
 &rst
  ixpk= 2702, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 672, 673, 672, 673,
 igr2= 662, 663, 664,
 &end
#
#   47 SER  HN           46 ALA  MB          5.50    (#   2703:20  Unique         4.31, 4.47 A)
 &rst
  ixpk= 2703, nxpk= 20, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 662, 663, 664,
 &end
#
#    6 LEU  HB+          23 ALA  MB          7.00    (#   2704:20  Unique         3.63, 5.13 A)
 &rst
  ixpk= 2704, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  80,  81,
 igr2= 317, 318, 319,
 &end
#
#   25 LYS  HN           23 ALA  MB          7.00    (#   2705:20  Unique         5.41, 6.02 A)
 &rst
  ixpk= 2705, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 317, 318, 319,
 &end
#
#   88 ILE  MD1          53 ILE  MG2         7.00    (#   2706:20  Unique         3.05, 5.49 A)
 &rst
  ixpk= 2706, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1287,1288,1289,
 igr2= 770, 771, 772,
 &end
#
#    4 ILE  HB            4 ILE  MG2         3.50    (#   2708:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2708, nxpk= 20, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  49,  50,  51,
 &end
#
#   50 TRP  HA            4 ILE  MG2         7.00    (#   2709:20  Unique         3.82, 4.70 A)
 &rst
  ixpk= 2709, nxpk= 20, iat= 707,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  49,  50,  51,
 &end
#
#   88 ILE  MG2         123 ILE  MG2         7.00    (#   2710:20  Unique         2.02, 3.34 A)
 &rst
  ixpk= 2710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1280,1281,1282,
 igr2=1802,1803,1804,
 &end
#
#  122 LYS  HA          123 ILE  MG2         7.00    (#   2711:20  Unique         3.82, 5.24 A)
 &rst
  ixpk= 2711, nxpk= 20, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1802,1803,1804,
 &end
#
#  124 ASN  HN          123 ILE  MG2         7.00    (#   2712:20  Unique         3.68, 4.69 A)
 &rst
  ixpk= 2712, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:2713     7 ILE  MG2         5.50    (#   2713:20  Single Ambig)
 &rst
  ixpk= 2713, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 750, 562,
 igr2= 101, 102, 103,
 &end
#
#    8 SER  HN            7 ILE  MG2         7.00    (#   2715:20  Unique         3.51, 4.10 A)
 &rst
  ixpk= 2715, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:2717     4 ILE  MG2         4.50    (#   2717:20  Single Ambig)
 &rst
  ixpk= 2717, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=  80,  81,  25,  26,  27,
 igr2=  49,  50,  51,
 &end
#
#  121 LEU  MDY          88 ILE  MG2         7.00    (#   2722:20  Unique         1.98, 4.62 A)
 &rst
  ixpk= 2722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1764,1765,1766,1768,1769,1770,
 igr2=1280,1281,1282,
 &end
#
#   88 ILE  HN           88 ILE  MG2         5.50    (#   2723:20  Unique         4.41, 4.69 A)
 &rst
  ixpk= 2723, nxpk= 20, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1280,1281,1282,
 &end
#
#    0 AMB  20-2:2724    53 ILE  MD1         7.00    (#   2724:20  Single Ambig)
 &rst
  ixpk= 2724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  78, 766,
 igr2= 777, 778, 779,
 &end
#
#    7 ILE  HG1-          7 ILE  MD1         3.50    (#   2725:20  Unique         2.23, 2.62 A)
 &rst
  ixpk= 2725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 105, 106,
 igr2= 108, 109, 110,
 &end
#
#   90 ILE  HA            0 AMB  20-1:2734   5.50    (#   2734:20  Single Ambig)
 &rst
  ixpk= 2734, nxpk= 20, iat=1302,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1313,1314,1315,1809,1810,1811,
 &end
#
#    0 AMB  20-2:2735    88 ILE  MD1         7.00    (#   2735:20  Single Ambig)
 &rst
  ixpk= 2735, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1=2055,2056,2057,2059,2060,2061, 754, 755, 756, 758,
       759, 760,
 igr2=1287,1288,1289,
 &end
#
#   89 GLY  HA+          88 ILE  MD1         7.00    (#   2736:20  Unique         6.69, 7.88 A)
 &rst
  ixpk= 2736, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1295,1296,
 igr2=1287,1288,1289,
 &end
#
#    0 AMB  20-2:2737    49 ILE  MD1         7.00    (#   2737:20  Single Ambig)
 &rst
  ixpk= 2737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.12, r4=12.62,
 igr1=  56,  57,  58, 738, 739, 740, 742, 743, 744,
 igr2= 699, 700, 701,
 &end
#
#    4 ILE  HG1+         49 ILE  MD1         7.00    (#   2738:20  Unique         4.45, 5.60 A)
 &rst
  ixpk= 2738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  53,  54,
 igr2= 699, 700, 701,
 &end
#
#   49 ILE  HA           49 ILE  MD1         7.00    (#   2740:20  Unique         2.03, 3.12 A)
 &rst
  ixpk= 2740, nxpk= 20, iat= 688,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 699, 700, 701,
 &end
#
#   50 TRP  HA           49 ILE  MD1         7.00    (#   2741:20  Unique         6.30, 7.27 A)
 &rst
  ixpk= 2741, nxpk= 20, iat= 707,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 699, 700, 701,
 &end
#
#   91 GLY  HA+          90 ILE  MD1         7.00    (#   2748:20  Unique         6.73, 7.93 A)
 &rst
  ixpk= 2748, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1321,1322,
 igr2=1313,1314,1315,
 &end
#
#    4 ILE  HG1-          4 ILE  MD1         4.50    (#   2750:20  Unique         2.35, 2.62 A)
 &rst
  ixpk= 2750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  53,  54,
 igr2=  56,  57,  58,
 &end
#
#   49 ILE  HB            4 ILE  MD1         7.00    (#   2751:20  Unique         2.59, 3.48 A)
 &rst
  ixpk= 2751, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  56,  57,  58,
 &end
#
#    4 ILE  HA            4 ILE  MD1         7.00    (#   2752:20  Unique         4.30, 4.57 A)
 &rst
  ixpk= 2752, nxpk= 20, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  56,  57,  58,
 &end
#
#  142 TRP  HE3           4 ILE  MD1         7.00    (#   2753:20  Unique         7.11, 7.66 A)
 &rst
  ixpk= 2753, nxpk= 20, iat=2102,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  56,  57,  58,
 &end
#
#  110 LYS  HG+         110 LYS  HA          5.50    (#   2759:20  Unique         2.81, 2.94 A)
 &rst
  ixpk= 2759, nxpk= 20, iat=  -1,1604, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1609,1610,
 &end
#
#   46 ALA  HN           45 PRO  HA          3.50    (#   2760:20  Unique         2.66, 2.70 A)
 &rst
  ixpk= 2760, nxpk= 20, iat= 658, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 PRO  HB-          45 PRO  HA          3.50    (#   2761:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2761, nxpk= 20, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 651, 652,
 &end
#
#   45 PRO  HB+          45 PRO  HA          3.50    (#   2762:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2762, nxpk= 20, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 651, 652,
 &end
#
#    0 AMB  20-2:2771    11 THR  HB          7.00    (#   2771:20  Single Ambig)
 &rst
  ixpk= 2771, nxpk= 20, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 136, 137, 136, 137,
 &end
#
#   65 ASN  HD2-         11 THR  HB          7.00    (#   2772:20  Unique         4.65, 6.01 A)
 &rst
  ixpk= 2772, nxpk= 20, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 926, 927,
 &end
#
#   10 SER  HN           11 THR  HA          7.00    (#   2774:20  Unique         5.22, 5.38 A)
 &rst
  ixpk= 2774, nxpk= 20, iat= 132, 145, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:2776     3 ASP  HA          7.00    (#   2776:20  Single Ambig)
 &rst
  ixpk= 2776, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=  23, 681, 682,
 &end
#
#    4 ILE  HN            3 ASP  HB-         5.50    (#   2778:20  Unique         3.20, 3.52 A)
 &rst
  ixpk= 2778, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  35,  36,
 &end
#
#    3 ASP  HN            3 ASP  HB-         7.00    (#   2779:20  Unique         2.44, 2.75 A)
 &rst
  ixpk= 2779, nxpk= 20, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  35,  36,
 &end
#
#    0 AMB  20-2:2781     0 AMB  20-1:2781   7.00    (#   2781:20  Double Ambig)
 &rst
  ixpk= 2781, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=2156,2102,
 igr2=2188,2189,2188,2189,
 &end
#
#    0 AMB  20-2:2782     4 ILE  HB          4.50    (#   2782:20  Single Ambig)
 &rst
  ixpk= 2782, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=  56,  57,  58, 738, 739, 740, 742, 743, 744,
 &end
#
#    4 ILE  HG1-          4 ILE  HB          7.00    (#   2783:20  Unique         2.44, 2.73 A)
 &rst
  ixpk= 2783, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  53,  54,
 &end
#
#    4 ILE  HG1+          4 ILE  HB          4.50    (#   2784:20  Unique         2.44, 2.73 A)
 &rst
  ixpk= 2784, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  53,  54,
 &end
#
#    4 ILE  HA            4 ILE  HB          7.00    (#   2785:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 2785, nxpk= 20, iat=  45,  47, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    4 ILE  HN            4 ILE  HB          5.50    (#   2786:20  Unique         2.64, 2.65 A)
 &rst
  ixpk= 2786, nxpk= 20, iat=  43,  47, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 THR  HA            4 ILE  HB          7.00    (#   2787:20  Unique         2.42, 2.48 A)
 &rst
  ixpk= 2787, nxpk= 20, iat= 462,  47, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    4 ILE  MG2           4 ILE  HG1-        4.50    (#   2791:20  Unique         2.49, 3.52 A)
 &rst
  ixpk= 2791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  49,  50,  51,
 igr2=  53,  54,
 &end
#
#    4 ILE  MG2           4 ILE  HG1+        4.50    (#   2792:20  Unique         2.49, 3.52 A)
 &rst
  ixpk= 2792, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  49,  50,  51,
 igr2=  53,  54,
 &end
#
#    5 THR  HB            4 ILE  HG1-        7.00    (#   2793:20  Unique         6.73, 7.09 A)
 &rst
  ixpk= 2793, nxpk= 20, iat=  66,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  53,  54,
 &end
#
#    4 ILE  HA            4 ILE  HG1-        7.00    (#   2794:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 2794, nxpk= 20, iat=  45,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  53,  54,
 &end
#
#    4 ILE  HN            4 ILE  HG1+        7.00    (#   2796:20  Unique         2.97, 3.52 A)
 &rst
  ixpk= 2796, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  53,  54,
 &end
#
#    4 ILE  MG2           4 ILE  MD1         3.50    (#   2797:20  Unique         1.99, 3.56 A)
 &rst
  ixpk= 2797, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  49,  50,  51,
 igr2=  56,  57,  58,
 &end
#
#    0 AMB  20-2:2798     4 ILE  MD1         7.00    (#   2798:20  Single Ambig)
 &rst
  ixpk= 2798, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1=2165,2166,2167,2169,2170,2171, 634, 635, 636, 638,
       639, 640,
 igr2=  56,  57,  58,
 &end
#
#   31 PHE  HB-           4 ILE  MD1         7.00    (#   2799:20  Unique         3.11, 4.26 A)
 &rst
  ixpk= 2799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 430, 431,
 igr2=  56,  57,  58,
 &end
#
#    4 ILE  HN            4 ILE  MD1         7.00    (#   2800:20  Unique         4.58, 5.11 A)
 &rst
  ixpk= 2800, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  56,  57,  58,
 &end
#
#    0 AMB  20-2:2805     4 ILE  MG2         4.50    (#   2805:20  Single Ambig)
 &rst
  ixpk= 2805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 466, 467, 468, 733, 734,
 igr2=  49,  50,  51,
 &end
#
#    0 AMB  20-2:2806     4 ILE  MG2         3.50    (#   2806:20  Single Ambig)
 &rst
  ixpk= 2806, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 733, 734, 696, 697,
 igr2=  49,  50,  51,
 &end
#
#    4 ILE  HN            4 ILE  MG2         7.00    (#   2807:20  Unique         4.32, 4.65 A)
 &rst
  ixpk= 2807, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=  49,  50,  51,
 &end
#
#   51 LEU  MDX           4 ILE  MG2         7.00    (#   2808:20  Unique         2.00, 4.16 A)
 &rst
  ixpk= 2808, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2=  49,  50,  51,
 &end
#
#    0 AMB  20-2:2810     5 THR  HB          5.50    (#   2810:20  Single Ambig)
 &rst
  ixpk= 2810, nxpk= 20, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  85,  86,  87,  89,  90,  91, 692, 693, 694,
 &end
#
#   50 TRP  HB-           5 THR  HB          7.00    (#   2811:20  Unique         6.19, 6.68 A)
 &rst
  ixpk= 2811, nxpk= 20, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 709, 710,
 &end
#
#    0 AMB  20-2:2812     0 AMB  20-1:2812   5.50    (#   2812:20  Double Ambig)
 &rst
  ixpk= 2812, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1774,2083,
 igr2=1764,1765,1766,1768,1769,1770,2146,2147,2148,2150,
      2151,2152,
 &end
#
#   50 TRP  HE1           0 AMB  20-1:2814   7.00    (#   2814:20  Single Ambig)
 &rst
  ixpk= 2814, nxpk= 20, iat= 715,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr2=  68,  69,  70,1166,1167,1168,1170,1171,1172,
 &end
#
#    6 LEU  HB+           6 LEU  HA          5.50    (#   2815:20  Unique         2.71, 2.83 A)
 &rst
  ixpk= 2815, nxpk= 20, iat=  -1,  78, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  80,  81,
 &end
#
#    6 LEU  MDY           6 LEU  HA          5.50    (#   2816:20  Unique         2.23, 3.06 A)
 &rst
  ixpk= 2816, nxpk= 20, iat=  -1,  78, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HB-           6 LEU  HA          7.00    (#   2817:20  Unique         2.71, 2.83 A)
 &rst
  ixpk= 2817, nxpk= 20, iat=  -1,  78, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  80,  81,
 &end
#
#    7 ILE  HN            6 LEU  HA          4.50    (#   2819:20  Unique         2.14, 2.14 A)
 &rst
  ixpk= 2819, nxpk= 20, iat=  95,  78, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 LEU  HG            6 LEU  HB+         7.00    (#   2820:20  Unique         2.37, 2.43 A)
 &rst
  ixpk= 2820, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  80,  81,
 &end
#
#   53 ILE  HN            6 LEU  HB-         7.00    (#   2823:20  Unique         6.20, 7.09 A)
 &rst
  ixpk= 2823, nxpk= 20, iat= 764,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  80,  81,
 &end
#
#    6 LEU  HB-           6 LEU  HG          7.00    (#   2824:20  Unique         2.37, 2.43 A)
 &rst
  ixpk= 2824, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  80,  81,
 &end
#
#    0 AMB  20-2:2825     6 LEU  HG          7.00    (#   2825:20  Single Ambig)
 &rst
  ixpk= 2825, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
 igr1= 298, 299, 733, 734, 466, 467, 468,
 &end
#
#    6 LEU  HB+           6 LEU  HG          7.00    (#   2826:20  Unique         2.37, 2.43 A)
 &rst
  ixpk= 2826, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  80,  81,
 &end
#
#   51 LEU  HN            6 LEU  HG          7.00    (#   2829:20  Unique         6.50, 6.58 A)
 &rst
  ixpk= 2829, nxpk= 20, iat= 729,  83, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:2832     6 LEU  MDX         4.50    (#   2832:20  Single Ambig)
 &rst
  ixpk= 2832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 733, 734, 298, 299,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#   23 ALA  HA            6 LEU  MDY         3.50    (#   2833:20  Unique         3.05, 4.51 A)
 &rst
  ixpk= 2833, nxpk= 20, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    6 LEU  HB-           6 LEU  MDY         3.50    (#   2834:20  Unique         2.24, 3.48 A)
 &rst
  ixpk= 2834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  80,  81,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#   51 LEU  MDX           6 LEU  MDY         7.00    (#   2835:20  Unique         1.98, 5.13 A)
 &rst
  ixpk= 2835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1= 738, 739, 740, 742, 743, 744,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  20-2:2836     0 AMB  20-1:2836   7.00    (#   2836:20  Double Ambig)
 &rst
  ixpk= 2836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1= 301, 602, 603,
 igr2=  85,  86,  87,  89,  90,  91, 569, 570, 571, 573,
       574, 575,
 &end
#
#   34 GLU  HN            6 LEU  MDY         5.50    (#   2837:20  Unique         2.95, 5.38 A)
 &rst
  ixpk= 2837, nxpk= 20, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=  85,  86,  87,  89,  90,  91,
 &end
#
#    7 ILE  HG1+          7 ILE  HA          7.00    (#   2838:20  Unique         2.77, 3.08 A)
 &rst
  ixpk= 2838, nxpk= 20, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 105, 106,
 &end
#
#   53 ILE  MD1           7 ILE  HA          7.00    (#   2839:20  Unique         4.69, 5.17 A)
 &rst
  ixpk= 2839, nxpk= 20, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 777, 778, 779,
 &end
#
#    0 AMB  20-2:2841     7 ILE  HA          7.00    (#   2841:20  Single Ambig)
 &rst
  ixpk= 2841, nxpk= 20, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 539,  95, 547, 548, 547, 548,
 &end
#
#    8 SER  HN            7 ILE  HA          5.50    (#   2843:20  Unique         2.16, 2.16 A)
 &rst
  ixpk= 2843, nxpk= 20, iat= 114,  97, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2848     7 ILE  HB          5.50    (#   2848:20  Single Ambig)
 &rst
  ixpk= 2848, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 985, 989,  95, 987,
 &end
#
#    7 ILE  HB            7 ILE  HG1-        5.50    (#   2853:20  Unique         2.46, 2.75 A)
 &rst
  ixpk= 2853, nxpk= 20, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 105, 106,
 &end
#
#    7 ILE  MG2           7 ILE  HG1-        3.50    (#   2854:20  Unique         2.56, 3.49 A)
 &rst
  ixpk= 2854, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 101, 102, 103,
 igr2= 105, 106,
 &end
#
#    7 ILE  HA            7 ILE  HG1-        7.00    (#   2857:20  Unique         2.77, 3.08 A)
 &rst
  ixpk= 2857, nxpk= 20, iat=  97,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 105, 106,
 &end
#
#   50 TRP  HB+           7 ILE  HG1-        7.00    (#   2859:20  Unique         4.51, 5.83 A)
 &rst
  ixpk= 2859, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 709, 710,
 igr2= 105, 106,
 &end
#
#    0 AMB  20-2:2860     0 AMB  20-1:2860   5.50    (#   2860:20  Double Ambig)
 &rst
  ixpk= 2860, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=  68,  69,  70, 754, 755, 756, 758, 759, 760,
 igr2= 105, 106, 105, 106,
 &end
#
#    7 ILE  HB            7 ILE  HG1+        4.50    (#   2861:20  Unique         2.46, 2.75 A)
 &rst
  ixpk= 2861, nxpk= 20, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 105, 106,
 &end
#
#    7 ILE  HA            7 ILE  HG1+        7.00    (#   2862:20  Unique         2.77, 3.08 A)
 &rst
  ixpk= 2862, nxpk= 20, iat=  97,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 105, 106,
 &end
#
#   50 TRP  HB-           7 ILE  MD1         4.50    (#   2864:20  Unique         3.14, 4.98 A)
 &rst
  ixpk= 2864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 709, 710,
 igr2= 108, 109, 110,
 &end
#
#    0 AMB  20-2:2865     7 ILE  MD1         7.00    (#   2865:20  Single Ambig)
 &rst
  ixpk= 2865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 987,1247,1251,1249,
 igr2= 108, 109, 110,
 &end
#
#   51 LEU  HN            7 ILE  MD1         7.00    (#   2866:20  Unique         4.26, 5.32 A)
 &rst
  ixpk= 2866, nxpk= 20, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 108, 109, 110,
 &end
#
#    7 ILE  MD1           7 ILE  MG2         3.50    (#   2868:20  Unique         1.99, 3.64 A)
 &rst
  ixpk= 2868, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 108, 109, 110,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:2869     7 ILE  MG2         3.50    (#   2869:20  Single Ambig)
 &rst
  ixpk= 2869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 754, 755, 756, 758, 759, 760, 512, 513, 514, 516,
       517, 518, 588, 589, 590, 592, 593, 594,
 igr2= 101, 102, 103,
 &end
#
#    0 AMB  20-2:2870     7 ILE  MG2         7.00    (#   2870:20  Single Ambig)
 &rst
  ixpk= 2870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1= 985, 989, 987,
 igr2= 101, 102, 103,
 &end
#
#   41 LEU  HN            7 ILE  MG2         7.00    (#   2871:20  Unique         3.55, 4.48 A)
 &rst
  ixpk= 2871, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 101, 102, 103,
 &end
#
#   19 ALA  MB            0 AMB  20-1:2872   5.50    (#   2872:20  Single Ambig)
 &rst
  ixpk= 2872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 256, 257, 258,
 igr2= 118, 119, 118, 119,
 &end
#
#    8 SER  HA            0 AMB  20-1:2873   7.00    (#   2873:20  Single Ambig)
 &rst
  ixpk= 2873, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 118, 119, 118, 119,
 &end
#
#    8 SER  HN            0 AMB  20-1:2874   7.00    (#   2874:20  Single Ambig)
 &rst
  ixpk= 2874, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 118, 119, 118, 119,
 &end
#
#   53 ILE  HA           10 SER  HB-         7.00    (#   2885:20  Unique         6.35, 7.77 A)
 &rst
  ixpk= 2885, nxpk= 20, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 136, 137,
 &end
#
#   10 SER  HA           10 SER  HB-         7.00    (#   2886:20  Unique         2.24, 2.50 A)
 &rst
  ixpk= 2886, nxpk= 20, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 136, 137,
 &end
#
#   66 LEU  HN           10 SER  HB-         7.00    (#   2887:20  Unique         3.52, 5.68 A)
 &rst
  ixpk= 2887, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 136, 137,
 &end
#
#   55 SER  HA           10 SER  HB-         7.00    (#   2889:20  Unique         5.18, 6.27 A)
 &rst
  ixpk= 2889, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 136, 137,
 &end
#
#  105 LEU  HG           10 SER  HB+         7.00    (#   2890:20  Unique         5.76, 6.35 A)
 &rst
  ixpk= 2890, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 136, 137,
 &end
#
#   11 THR  HA           11 THR  MG2         4.50    (#   2891:20  Unique         2.23, 3.73 A)
 &rst
  ixpk= 2891, nxpk= 20, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 149, 150, 151,
 &end
#
#   11 THR  HB           11 THR  MG2         3.50    (#   2892:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2892, nxpk= 20, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 149, 150, 151,
 &end
#
#   12 LEU  MDY          12 LEU  HA          3.50    (#   2893:20  Unique         2.10, 3.75 A)
 &rst
  ixpk= 2893, nxpk= 20, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 166, 167, 168, 170, 171, 172,
 &end
#
#    0 AMB  20-2:2894     0 AMB  20-1:2894   2.80    (#   2894:20  Double Ambig)
 &rst
  ixpk= 2894, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 166, 167, 168, 170, 171, 172, 569, 570, 571, 573,
       574, 575, 569, 570, 571, 573, 574, 575,
 igr2= 161, 162, 564, 565,
 &end
#
#   12 LEU  HA           12 LEU  HB+         5.50    (#   2895:20  Unique         2.43, 2.82 A)
 &rst
  ixpk= 2895, nxpk= 20, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 161, 162,
 &end
#
#    0 AMB  20-2:2896    40 LEU  HB-         5.50    (#   2896:20  Single Ambig)
 &rst
  ixpk= 2896, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 562, 615,
 igr2= 564, 565,
 &end
#
#   41 LEU  HN           40 LEU  HB-         7.00    (#   2897:20  Unique         3.68, 3.95 A)
 &rst
  ixpk= 2897, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 564, 565,
 &end
#
#   12 LEU  HA           12 LEU  HG          7.00    (#   2900:20  Unique         2.57, 2.73 A)
 &rst
  ixpk= 2900, nxpk= 20, iat= 159, 164, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   12 LEU  HG           12 LEU  MDX         3.50    (#   2902:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2902, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 166, 167, 168, 170, 171, 172,
 &end
#
#    0 AMB  20-2:2903     0 AMB  20-1:2903   2.80    (#   2903:20  Double Ambig)
 &rst
  ixpk= 2903, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 161, 162,2160,2161,
 igr2= 166, 167, 168, 170, 171, 172,2163,
 &end
#
#  146 LEU  HB+         146 LEU  HG          4.50    (#   2904:20  Unique         2.66, 2.82 A)
 &rst
  ixpk= 2904, nxpk= 20, iat=  -1,2163, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2160,2161,
 &end
#
#   12 LEU  HB+          12 LEU  MDY         3.50    (#   2905:20  Unique         2.11, 3.28 A)
 &rst
  ixpk= 2905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 161, 162,
 igr2= 166, 167, 168, 170, 171, 172,
 &end
#
#    0 AMB  20-2:2906     0 AMB  20-1:2906   7.00    (#   2906:20  Double Ambig)
 &rst
  ixpk= 2906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 562,1276,
 igr2= 166, 167, 168, 170, 171, 172, 369, 370, 371, 373,
       374, 375,
 &end
#
#   13 GLY  HN           13 GLY  HA-         7.00    (#   2907:20  Unique         2.37, 2.75 A)
 &rst
  ixpk= 2907, nxpk= 20, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 178, 179,
 &end
#
#  137 GLU  HA          140 GLY  HA-         7.00    (#   2909:20  Unique         4.01, 4.82 A)
 &rst
  ixpk= 2909, nxpk= 20, iat=2009,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=2067,2068,
 &end
#
#  137 GLU  HA          140 GLY  HA+         5.50    (#   2910:20  Unique         4.01, 4.82 A)
 &rst
  ixpk= 2910, nxpk= 20, iat=2009,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2067,2068,
 &end
#
#    8 SER  HA           14 GLY  HA+         7.00    (#   2915:20  Unique         5.31, 7.04 A)
 &rst
  ixpk= 2915, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 185, 186,
 &end
#
#    0 AMB  20-2:2919    16 GLU  HA          7.00    (#   2919:20  Single Ambig)
 &rst
  ixpk= 2919, nxpk= 20, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 768,  83,
 &end
#
#   16 GLU  HG+          16 GLU  HA          5.50    (#   2920:20  Unique         3.56, 3.81 A)
 &rst
  ixpk= 2920, nxpk= 20, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 207, 208,
 &end
#
#   16 GLU  HB-          16 GLU  HG+         5.50    (#   2925:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 2925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 204, 205,
 igr2= 207, 208,
 &end
#
#   16 GLU  HA           16 GLU  HB+         7.00    (#   2926:20  Unique         2.37, 2.45 A)
 &rst
  ixpk= 2926, nxpk= 20, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 204, 205,
 &end
#
#   16 GLU  HA           16 GLU  HB-         7.00    (#   2927:20  Unique         2.37, 2.45 A)
 &rst
  ixpk= 2927, nxpk= 20, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 204, 205,
 &end
#
#   17 TYR  HB-          17 TYR  HA          5.50    (#   2928:20  Unique         2.61, 2.82 A)
 &rst
  ixpk= 2928, nxpk= 20, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 219, 220,
 &end
#
#    0 AMB  20-2:2929     0 AMB  20-1:2929   5.50    (#   2929:20  Double Ambig)
 &rst
  ixpk= 2929, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1615,1616, 281, 282,
 igr2=1604, 217,
 &end
#
#   18 VAL  HN           17 TYR  HA          7.00    (#   2930:20  Unique         3.51, 3.56 A)
 &rst
  ixpk= 2930, nxpk= 20, iat= 236, 217, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:2931     0 AMB  20-1:2931   7.00    (#   2931:20  Double Ambig)
 &rst
  ixpk= 2931, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1633,1634,1633,1634,
 igr2=1628,1629,1628,1629,
 &end
#
#    0 AMB  20-2:2932    18 VAL  HA          7.00    (#   2932:20  Single Ambig)
 &rst
  ixpk= 2932, nxpk= 20, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1= 301, 266, 267, 266, 267,
 &end
#
#   18 VAL  HB           18 VAL  HA          7.00    (#   2933:20  Unique         2.51, 2.55 A)
 &rst
  ixpk= 2933, nxpk= 20, iat= 240, 238, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   21 HIS  HB-          18 VAL  HA          7.00    (#   2934:20  Unique         2.52, 3.30 A)
 &rst
  ixpk= 2934, nxpk= 20, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 281, 282,
 &end
#
#   21 HIS  HB+          18 VAL  HA          7.00    (#   2935:20  Unique         2.52, 3.30 A)
 &rst
  ixpk= 2935, nxpk= 20, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 281, 282,
 &end
#
#   17 TYR  HN           18 VAL  HA          7.00    (#   2937:20  Unique         5.40, 5.46 A)
 &rst
  ixpk= 2937, nxpk= 20, iat= 215, 238, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   19 ALA  HA           18 VAL  HA          7.00    (#   2938:20  Unique         4.80, 4.84 A)
 &rst
  ixpk= 2938, nxpk= 20, iat= 254, 238, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   18 VAL  HN           18 VAL  HB          5.50    (#   2939:20  Unique         2.55, 2.63 A)
 &rst
  ixpk= 2939, nxpk= 20, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2940     0 AMB  20-1:2940   7.00    (#   2940:20  Double Ambig)
 &rst
  ixpk= 2940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 962, 963, 296,
 igr2= 968, 969, 342, 343,
 &end
#
#    0 AMB  20-2:2941     0 AMB  20-1:2941   5.50    (#   2941:20  Double Ambig)
 &rst
  ixpk= 2941, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 238, 962, 963,
 igr2= 240, 968, 969,
 &end
#
#    0 AMB  20-2:2942     0 AMB  20-1:2942   7.00    (#   2942:20  Double Ambig)
 &rst
  ixpk= 2942, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1099,1100, 330, 331,
 igr2=1081,1082, 342, 343,
 &end
#
#    0 AMB  20-2:2943     0 AMB  20-1:2943   7.00    (#   2943:20  Double Ambig)
 &rst
  ixpk= 2943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1= 164, 348, 349,1035,1036,1037,
 igr2= 968, 969, 342, 343,1081,1082,
 &end
#
#   88 ILE  MG2          18 VAL  MGY         7.00    (#   2945:20  Unique         3.36, 5.63 A)
 &rst
  ixpk= 2945, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1280,1281,1282,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   22 LEU  HB-          18 VAL  MGY         7.00    (#   2946:20  Unique         3.59, 5.47 A)
 &rst
  ixpk= 2946, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 298, 299,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   19 ALA  HA           18 VAL  MGY         7.00    (#   2947:20  Unique         3.09, 4.66 A)
 &rst
  ixpk= 2947, nxpk= 20, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#   21 HIS  HN           18 VAL  MGY         7.00    (#   2950:20  Unique         4.80, 6.20 A)
 &rst
  ixpk= 2950, nxpk= 20, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:2951    18 VAL  MGY         3.50    (#   2951:20  Single Ambig)
 &rst
  ixpk= 2951, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 301, 240,
 igr2= 242, 243, 244, 246, 247, 248,
 &end
#
#    0 AMB  20-2:2953     0 AMB  20-1:2953   4.50    (#   2953:20  Double Ambig)
 &rst
  ixpk= 2953, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 252,1361,
 igr2= 242, 243, 244, 246, 247, 248,1747,1748,1749,
 &end
#
#   22 LEU  HB-          19 ALA  HA          7.00    (#   2954:20  Unique         2.58, 3.43 A)
 &rst
  ixpk= 2954, nxpk= 20, iat=  -1, 254, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 298, 299,
 &end
#
#   35 THR  HA           19 ALA  MB          7.00    (#   2957:20  Unique         4.41, 5.48 A)
 &rst
  ixpk= 2957, nxpk= 20, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 256, 257, 258,
 &end
#
#    0 AMB  20-2:2960    20 GLU  HA          3.50    (#   2960:20  Single Ambig)
 &rst
  ixpk= 2960, nxpk= 20, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 266, 267, 266, 267,
 &end
#
#    0 AMB  20-2:2961    24 GLU  HA          3.50    (#   2961:20  Single Ambig)
 &rst
  ixpk= 2961, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 327, 328, 383, 384,
 &end
#
#   19 ALA  MB           20 GLU  HA          7.00    (#   2962:20  Unique         3.76, 4.70 A)
 &rst
  ixpk= 2962, nxpk= 20, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 256, 257, 258,
 &end
#
#    0 AMB  20-2:2963    20 GLU  HA          7.00    (#   2963:20  Single Ambig)
 &rst
  ixpk= 2963, nxpk= 20, iat=  -1, 264, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=  85,  86,  87,  89,  90,  91, 242, 243, 244, 246,
       247, 248,
 &end
#
#   35 THR  MG2          20 GLU  HA          5.50    (#   2964:20  Unique         2.15, 3.55 A)
 &rst
  ixpk= 2964, nxpk= 20, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 495, 496, 497,
 &end
#
#   21 HIS  HN           20 GLU  HA          7.00    (#   2965:20  Unique         3.54, 3.56 A)
 &rst
  ixpk= 2965, nxpk= 20, iat= 277, 264, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   20 GLU  HN           20 GLU  HA          7.00    (#   2966:20  Unique         2.75, 2.76 A)
 &rst
  ixpk= 2966, nxpk= 20, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   20 GLU  HN           20 GLU  HA          7.00    (#   2967:20  Unique         2.75, 2.76 A)
 &rst
  ixpk= 2967, nxpk= 20, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:2968     0 AMB  20-1:2968   7.00    (#   2968:20  Double Ambig)
 &rst
  ixpk= 2968, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1= 379,1423, 294,
 igr2= 325,1445, 264,
 &end
#
#  100 GLY  HN           99 CYS  HA          7.00    (#   2969:20  Unique         2.15, 2.36 A)
 &rst
  ixpk= 2969, nxpk= 20, iat=1454,1445, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   20 GLU  HA            0 AMB  20-1:2970   4.50    (#   2970:20  Single Ambig)
 &rst
  ixpk= 2970, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 266, 267, 266, 267,
 &end
#
#   35 THR  MG2          20 GLU  HG+         7.00    (#   2971:20  Unique         3.24, 5.38 A)
 &rst
  ixpk= 2971, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 495, 496, 497,
 igr2= 269, 270,
 &end
#
#   21 HIS  HB-          21 HIS  HA          4.50    (#   2972:20  Unique         2.40, 2.73 A)
 &rst
  ixpk= 2972, nxpk= 20, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 281, 282,
 &end
#
#   24 GLU  HB-          21 HIS  HA          7.00    (#   2973:20  Unique         2.73, 3.17 A)
 &rst
  ixpk= 2973, nxpk= 20, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 327, 328,
 &end
#
#   19 ALA  HA           21 HIS  HA          7.00    (#   2976:20  Unique         6.64, 6.77 A)
 &rst
  ixpk= 2976, nxpk= 20, iat= 254, 279, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   18 VAL  HN           21 HIS  HB+         7.00    (#   2977:20  Unique         5.07, 5.79 A)
 &rst
  ixpk= 2977, nxpk= 20, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 281, 282,
 &end
#
#   22 LEU  HB+          22 LEU  HA          5.50    (#   2978:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 2978, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 298, 299,
 &end
#
#   22 LEU  HB+          22 LEU  HA          5.50    (#   2979:20  Unique         2.63, 2.81 A)
 &rst
  ixpk= 2979, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 298, 299,
 &end
#
#    0 AMB  20-2:2980     0 AMB  20-1:2980   4.50    (#   2980:20  Double Ambig)
 &rst
  ixpk= 2980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2053,2050,2051, 342, 343,
 igr2=2048, 296,
 &end
#
#   25 LYS  HB+          22 LEU  HA          4.50    (#   2981:20  Unique         3.24, 4.19 A)
 &rst
  ixpk= 2981, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 342, 343,
 &end
#
#   25 LYS  HN           22 LEU  HA          7.00    (#   2982:20  Unique         3.86, 3.91 A)
 &rst
  ixpk= 2982, nxpk= 20, iat= 338, 296, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:2983     0 AMB  20-1:2983   4.50    (#   2983:20  Double Ambig)
 &rst
  ixpk= 2983, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 301,2050,2051,
 igr2= 296,2048,
 &end
#
#    0 AMB  20-2:2984    22 LEU  HG          7.00    (#   2984:20  Single Ambig)
 &rst
  ixpk= 2984, nxpk= 20, iat=  -1, 301, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1= 303, 304, 305, 307, 308, 309,1802,1803,1804,
 &end
#
#    0 AMB  20-2:2985     0 AMB  20-1:2985   3.50    (#   2985:20  Double Ambig)
 &rst
  ixpk= 2985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 298, 299,1806,1807,1806,1807,
 igr2= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
      1769,1770,
 &end
#
#  145 LEU  HB-         145 LEU  MDX         3.50    (#   2986:20  Unique         2.08, 3.26 A)
 &rst
  ixpk= 2986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2141,2142,
 igr2=2146,2147,2148,2150,2151,2152,
 &end
#
#    0 AMB  20-2:2987     0 AMB  20-1:2987   4.50    (#   2987:20  Double Ambig)
 &rst
  ixpk= 2987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1135,1136, 367,
 igr2=1166,1167,1168,1170,1171,1172, 303, 304, 305, 307,
       308, 309,
 &end
#
#   21 HIS  HA           23 ALA  MB          7.00    (#   2991:20  Unique         5.41, 6.38 A)
 &rst
  ixpk= 2991, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 317, 318, 319,
 &end
#
#   82 ALA  HA           82 ALA  MB          4.50    (#   2992:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2992, nxpk= 20, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1191,1192,1193,
 &end
#
#    0 AMB  20-2:2993    24 GLU  HA          2.80    (#   2993:20  Single Ambig)
 &rst
  ixpk= 2993, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 327, 328, 383, 384,
 &end
#
#    0 AMB  20-2:2994     0 AMB  20-1:2994   4.50    (#   2994:20  Double Ambig)
 &rst
  ixpk= 2994, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 269, 270, 330, 331,
 igr2= 264, 325,
 &end
#
#   25 LYS  HN           24 GLU  HA          7.00    (#   2995:20  Unique         3.57, 3.57 A)
 &rst
  ixpk= 2995, nxpk= 20, iat= 338, 325, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   21 HIS  HA           24 GLU  HB-         5.50    (#   2996:20  Unique         2.73, 3.17 A)
 &rst
  ixpk= 2996, nxpk= 20, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 327, 328,
 &end
#
#   25 LYS  HB-          25 LYS  HA          4.50    (#   2997:20  Unique         2.39, 2.71 A)
 &rst
  ixpk= 2997, nxpk= 20, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 342, 343,
 &end
#
#    0 AMB  20-2:2998     0 AMB  20-1:2998   4.50    (#   2998:20  Double Ambig)
 &rst
  ixpk= 2998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1368,1369,1096,1097, 342, 343,
 igr2=1363,1094, 340,
 &end
#
#   25 LYS  HN           25 LYS  HA          5.50    (#   3000:20  Unique         2.76, 2.77 A)
 &rst
  ixpk= 3000, nxpk= 20, iat= 338, 340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3001     0 AMB  20-1:3001   7.00    (#   3001:20  Double Ambig)
 &rst
  ixpk= 3001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 296,1994,
 igr2= 342, 343, 342, 343,
 &end
#
#   25 LYS  HN           25 LYS  HB-         7.00    (#   3002:20  Unique         2.70, 3.15 A)
 &rst
  ixpk= 3002, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 342, 343,
 &end
#
#   25 LYS  HN           25 LYS  HB+         7.00    (#   3003:20  Unique         2.70, 3.15 A)
 &rst
  ixpk= 3003, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 342, 343,
 &end
#
#   26 LEU  HN           25 LYS  HB+         7.00    (#   3004:20  Unique         2.24, 2.91 A)
 &rst
  ixpk= 3004, nxpk= 20, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 342, 343,
 &end
#
#   26 LEU  HN           25 LYS  HB-         7.00    (#   3005:20  Unique         2.24, 2.91 A)
 &rst
  ixpk= 3005, nxpk= 20, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 342, 343,
 &end
#
#   25 LYS  HB-          25 LYS  HG+         5.50    (#   3006:20  Unique         2.33, 2.55 A)
 &rst
  ixpk= 3006, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 342, 343,
 igr2= 345, 346,
 &end
#
#    0 AMB  20-2:3007     0 AMB  20-1:3007   7.00    (#   3007:20  Double Ambig)
 &rst
  ixpk= 3007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.53, r4=12.03,
 igr1= 962, 963, 296,1994,
 igr2= 164, 348, 349, 348, 349,
 &end
#
#    0 AMB  20-2:3008     0 AMB  20-1:3008   7.00    (#   3008:20  Double Ambig)
 &rst
  ixpk= 3008, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.34, r4=12.84,
 igr1= 327, 328, 398, 399, 605, 606,
 igr2= 348, 349, 348, 349, 586,
 &end
#
#   25 LYS  HG+          25 LYS  HE-         7.00    (#   3009:20  Unique         2.43, 3.40 A)
 &rst
  ixpk= 3009, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 345, 346,
 igr2= 351, 352,
 &end
#
#    0 AMB  20-2:3010     0 AMB  20-1:3010   7.00    (#   3010:20  Double Ambig)
 &rst
  ixpk= 3010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=2182,2183, 345, 346,
 igr2=2188,2189, 351, 352,
 &end
#
#    0 AMB  20-2:3011     0 AMB  20-1:3011   7.00    (#   3011:20  Double Ambig)
 &rst
  ixpk= 3011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.27, r4=10.77,
 igr1= 564, 565, 586, 348, 349,
 igr2= 600, 362,
 &end
#
#  139 LEU  MDY          26 LEU  HA          5.50    (#   3012:20  Unique         2.29, 4.51 A)
 &rst
  ixpk= 3012, nxpk= 20, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#   26 LEU  HN           26 LEU  HA          7.00    (#   3014:20  Unique         2.74, 2.75 A)
 &rst
  ixpk= 3014, nxpk= 20, iat= 360, 362, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   26 LEU  MDY          26 LEU  HA          4.50    (#   3015:20  Unique         1.99, 3.10 A)
 &rst
  ixpk= 3015, nxpk= 20, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 369, 370, 371, 373, 374, 375,
 &end
#
#   27 GLU  HN           26 LEU  HB+         7.00    (#   3018:20  Unique         2.76, 3.06 A)
 &rst
  ixpk= 3018, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 364, 365,
 &end
#
#    0 AMB  20-2:3019    26 LEU  HG          7.00    (#   3019:20  Single Ambig)
 &rst
  ixpk= 3019, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
 igr1=2055,2056,2057,2059,2060,2061, 736,
 &end
#
#    0 AMB  20-2:3020     0 AMB  20-1:3020   3.50    (#   3020:20  Double Ambig)
 &rst
  ixpk= 3020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 igr2=1135,1136,1135,1136,
 &end
#
#   78 PRO  HA           78 PRO  HG+         7.00    (#   3021:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 3021, nxpk= 20, iat=1141,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1135,1136,
 &end
#
#    0 AMB  20-2:3022     0 AMB  20-1:3022   7.00    (#   3022:20  Double Ambig)
 &rst
  ixpk= 3022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1176,  43,
 igr2=1135,1136, 367,
 &end
#
#    0 AMB  20-2:3023    26 LEU  HG          5.50    (#   3023:20  Single Ambig)
 &rst
  ixpk= 3023, nxpk= 20, iat=  -1, 367, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 313,
 &end
#
#    0 AMB  20-2:3024     0 AMB  20-1:3024   7.00    (#   3024:20  Double Ambig)
 &rst
  ixpk= 3024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1157, 379,
 igr2=1135,1136, 367,
 &end
#
#    0 AMB  20-2:3025    26 LEU  MDY         5.50    (#   3025:20  Single Ambig)
 &rst
  ixpk= 3025, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=2087,2088,  83, 348, 349,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#   26 LEU  HN           26 LEU  MDY         7.00    (#   3026:20  Unique         1.94, 3.86 A)
 &rst
  ixpk= 3026, nxpk= 20, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  20-2:3028    27 GLU  HA          3.50    (#   3028:20  Single Ambig)
 &rst
  ixpk= 3028, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 383, 384, 383, 384,
 &end
#
#   27 GLU  HG+          27 GLU  HA          3.50    (#   3029:20  Unique         2.13, 2.69 A)
 &rst
  ixpk= 3029, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 386, 387,
 &end
#
#   27 GLU  HN           27 GLU  HA          4.50    (#   3030:20  Unique         2.81, 2.83 A)
 &rst
  ixpk= 3030, nxpk= 20, iat= 379, 381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 GLU  HN           27 GLU  HB-         5.50    (#   3031:20  Unique         2.72, 3.08 A)
 &rst
  ixpk= 3031, nxpk= 20, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 383, 384,
 &end
#
#    0 AMB  20-2:3032    27 GLU  HB-         4.50    (#   3032:20  Single Ambig)
 &rst
  ixpk= 3032, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 386, 387, 386, 387,
 igr2= 383, 384,
 &end
#
#   28 GLU  HB+          28 GLU  HA          3.50    (#   3033:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 3033, nxpk= 20, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 398, 399,
 &end
#
#   30 GLY  HN           28 GLU  HA          7.00    (#   3034:20  Unique         3.65, 3.67 A)
 &rst
  ixpk= 3034, nxpk= 20, iat= 419, 396, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   28 GLU  HG+          28 GLU  HB-         3.50    (#   3036:20  Unique         2.27, 2.56 A)
 &rst
  ixpk= 3036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 401, 402,
 igr2= 398, 399,
 &end
#
#    0 AMB  20-2:3037     0 AMB  20-1:3037   3.50    (#   3037:20  Double Ambig)
 &rst
  ixpk= 3037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 340, 396,
 igr2= 398, 399, 398, 399,
 &end
#
#   29 ALA  HN           28 GLU  HB-         7.00    (#   3038:20  Unique         3.22, 3.68 A)
 &rst
  ixpk= 3038, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 398, 399,
 &end
#
#  107 ALA  HN          106 GLU  HB+         5.50    (#   3039:20  Unique         2.78, 3.28 A)
 &rst
  ixpk= 3039, nxpk= 20, iat=1558,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1547,1548,
 &end
#
#    0 AMB  20-2:3041     0 AMB  20-1:3041   7.00    (#   3041:20  Double Ambig)
 &rst
  ixpk= 3041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=1361, 805,
 igr2=1547,1548,1547,1548,
 &end
#
#    0 AMB  20-2:3043    29 ALA  HA          5.50    (#   3043:20  Single Ambig)
 &rst
  ixpk= 3043, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 421, 422, 396, 362, 340,
 &end
#
#    0 AMB  20-2:3047    29 ALA  MB          4.50    (#   3047:20  Single Ambig)
 &rst
  ixpk= 3047, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 421, 422, 340, 396,
 igr2= 413, 414, 415,
 &end
#
#    0 AMB  20-2:3048    29 ALA  MB          7.00    (#   3048:20  Single Ambig)
 &rst
  ixpk= 3048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=2111, 398, 399,
 igr2= 413, 414, 415,
 &end
#
#  146 LEU  MDY          29 ALA  MB          7.00    (#   3051:20  Unique         5.03, 7.70 A)
 &rst
  ixpk= 3051, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=2165,2166,2167,2169,2170,2171,
 igr2= 413, 414, 415,
 &end
#
#  143 VAL  MGX          29 ALA  MB          4.50    (#   3052:20  Unique         1.99, 4.08 A)
 &rst
  ixpk= 3052, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2113,2114,2115,2117,2118,2119,
 igr2= 413, 414, 415,
 &end
#
#   31 PHE  HN           30 GLY  HA+         7.00    (#   3053:20  Unique         3.11, 3.27 A)
 &rst
  ixpk= 3053, nxpk= 20, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 421, 422,
 &end
#
#   31 PHE  HN           30 GLY  HA-         7.00    (#   3054:20  Unique         3.11, 3.27 A)
 &rst
  ixpk= 3054, nxpk= 20, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 421, 422,
 &end
#
#   33 THR  MG2          31 PHE  HB+         7.00    (#   3055:20  Unique         3.78, 5.50 A)
 &rst
  ixpk= 3055, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 466, 467, 468,
 igr2= 430, 431,
 &end
#
#   33 THR  HA           32 THR  HA          4.50    (#   3057:20  Unique         4.43, 4.44 A)
 &rst
  ixpk= 3057, nxpk= 20, iat= 462, 448, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 THR  HN           32 THR  HA          4.50    (#   3059:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 3059, nxpk= 20, iat= 446, 448, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 THR  HN           32 THR  HA          3.50    (#   3061:20  Unique         2.24, 2.25 A)
 &rst
  ixpk= 3061, nxpk= 20, iat= 460, 448, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 THR  HB           32 THR  HA          3.50    (#   3062:20  Unique         2.58, 2.58 A)
 &rst
  ixpk= 3062, nxpk= 20, iat= 450, 448, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 THR  MG2          32 THR  HA          4.50    (#   3063:20  Unique         2.32, 2.94 A)
 &rst
  ixpk= 3063, nxpk= 20, iat=  -1, 448, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 452, 453, 454,
 &end
#
#    2 ALA  MB           32 THR  HB          4.50    (#   3064:20  Unique         2.02, 3.16 A)
 &rst
  ixpk= 3064, nxpk= 20, iat=  -1, 450, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  25,  26,  27,
 &end
#
#    4 ILE  HN           32 THR  MG2         7.00    (#   3065:20  Unique         6.31, 6.46 A)
 &rst
  ixpk= 3065, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 452, 453, 454,
 &end
#
#    3 ASP  HN           33 THR  HA          7.00    (#   3068:20  Unique         3.35, 3.49 A)
 &rst
  ixpk= 3068, nxpk= 20, iat=  31, 462, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    4 ILE  HB           33 THR  HA          7.00    (#   3069:20  Unique         2.42, 2.48 A)
 &rst
  ixpk= 3069, nxpk= 20, iat=  47, 462, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   23 ALA  MB           33 THR  HB          7.00    (#   3070:20  Unique         3.86, 4.97 A)
 &rst
  ixpk= 3070, nxpk= 20, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 317, 318, 319,
 &end
#
#   33 THR  HN           33 THR  HB          7.00    (#   3072:20  Unique         3.89, 3.92 A)
 &rst
  ixpk= 3072, nxpk= 20, iat= 460, 464, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   35 THR  HA           33 THR  HB          7.00    (#   3073:20  Unique         5.32, 5.37 A)
 &rst
  ixpk= 3073, nxpk= 20, iat= 491, 464, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   34 GLU  HA           33 THR  HB          7.00    (#   3074:20  Unique         4.79, 4.82 A)
 &rst
  ixpk= 3074, nxpk= 20, iat= 476, 464, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-2:3075    33 THR  HB          7.00    (#   3075:20  Single Ambig)
 &rst
  ixpk= 3075, nxpk= 20, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 364, 365, 383, 384,
 &end
#
#   23 ALA  HA           33 THR  MG2         3.50    (#   3077:20  Unique         3.64, 4.42 A)
 &rst
  ixpk= 3077, nxpk= 20, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 466, 467, 468,
 &end
#
#    0 AMB  20-2:3078    33 THR  MG2         4.50    (#   3078:20  Single Ambig)
 &rst
  ixpk= 3078, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 383, 384, 383, 384,
 igr2= 466, 467, 468,
 &end
#
#    0 AMB  20-2:3079    33 THR  MG2         2.80    (#   3079:20  Single Ambig)
 &rst
  ixpk= 3079, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1=  85,  86,  87,  89,  90,  91,  49,  50,  51, 369,
       370, 371, 373, 374, 375,
 igr2= 466, 467, 468,
 &end
#
#   34 GLU  HN           34 GLU  HA          7.00    (#   3080:20  Unique         2.95, 2.95 A)
 &rst
  ixpk= 3080, nxpk= 20, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  113 GLY  HN          111 ASN  HA          7.00    (#   3081:20  Unique         3.58, 3.75 A)
 &rst
  ixpk= 3081, nxpk= 20, iat=1649,1626, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   34 GLU  HG+          34 GLU  HA          4.50    (#   3083:20  Unique         2.06, 2.59 A)
 &rst
  ixpk= 3083, nxpk= 20, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 481, 482,
 &end
#
#   34 GLU  HB-          34 GLU  HA          3.50    (#   3084:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 3084, nxpk= 20, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   36 LEU  MDY          34 GLU  HA          7.00    (#   3085:20  Unique         3.77, 5.71 A)
 &rst
  ixpk= 3085, nxpk= 20, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#   36 LEU  MDY          34 GLU  HB+         7.00    (#   3086:20  Unique         2.27, 4.34 A)
 &rst
  ixpk= 3086, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 512, 513, 514, 516, 517, 518,
 igr2= 478, 479,
 &end
#
#   34 GLU  HG-          34 GLU  HB-         4.50    (#   3087:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 3087, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 481, 482,
 igr2= 478, 479,
 &end
#
#   34 GLU  HG-          34 GLU  HB+         4.50    (#   3088:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 3088, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 481, 482,
 igr2= 478, 479,
 &end
#
#   74 GLN  HE2-         74 GLN  HG-         7.00    (#   3091:20  Unique         2.15, 3.24 A)
 &rst
  ixpk= 3091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1072,1073,
 igr2=1067,1068,
 &end
#
#   34 GLU  HB-          34 GLU  HG-         2.80    (#   3093:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 3093, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 478, 479,
 igr2= 481, 482,
 &end
#
#    0 AMB  20-2:3094     0 AMB  20-1:3094   2.80    (#   3094:20  Double Ambig)
 &rst
  ixpk= 3094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1067,1068, 478, 479,1572,1573,
 igr2=1575,1576, 481, 482,
 &end
#
#   35 THR  HN           34 GLU  HG+         7.00    (#   3097:20  Unique         3.36, 4.19 A)
 &rst
  ixpk= 3097, nxpk= 20, iat= 489,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 481, 482,
 &end
#
#    0 AMB  20-2:3100     0 AMB  20-1:3100   7.00    (#   3100:20  Double Ambig)
 &rst
  ixpk= 3100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1=  64,  45,
 igr2= 481, 482, 481, 482,
 &end
#
#   34 GLU  HA           34 GLU  HG-         7.00    (#   3101:20  Unique         2.06, 2.59 A)
 &rst
  ixpk= 3101, nxpk= 20, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 481, 482,
 &end
#
#   3 ASP  HN     32 THR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  31, 446, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, 
      rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
 &end
#
#   4 ILE  HN     32 THR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  43, 446, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   4 ILE  HN     33 THR  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  43, 462, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#   6 LEU  HN     34 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  76, 474, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   6 LEU  HN     36 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  76, 503, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   5 THR  HN     51 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  62, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   6 LEU  HA     51 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  78, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   6 LEU  HN     43 ASP  HN      6.50
 &rst
  ixpk= 0, nxpk= 0, iat=  76, 613, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   7 ILE  HN     51 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  95, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   7 ILE  HN     52 VAL  HA      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  95, 750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   7 ILE  HN     53 ILE  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  95, 764, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   8 SER  HA     53 ILE  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 764, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   8 SER  HN     36 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 503, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  29 ALA  HN     31 PHE  QD      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 434, 442,
 &end
#
#  30 GLY  HN     31 PHE  QD      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 434, 442,
 &end
#
#  31 PHE  HN     31 PHE  QD      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 426,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 434, 442,
 &end
#
#  32 THR  HN     31 PHE  QD      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 434, 442,
 &end
#
#  36 LEU  HN      8 SER  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  36 LEU  HN      6 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 503,  76, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  38 GLY	 HN      8 SER  HN      7.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 114, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  40 LEU  HN     43 ASP  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 613, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  42 GLU  HN     44 LEU  HN      5.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  46 ALA  HN     50 TRP  HE1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 715, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  47 SER  HN     50 TRP  HE1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 715, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  47 SER  HN     45 PRO  HB2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 651, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  47 SER  HN     45 PRO  HB3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 652, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  48 GLY  HN     84 ARG  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 679,1213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  49 ILE  HA     84 ARG  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 688,1213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  50 TRP  HN     84 ARG  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 705,1213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  50 TRP  HN     85 PHE  HA      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 705,1239, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  50 TRP  HN     86 GLY  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 705,1257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  51 LEU  HA     86 GLY  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 731,1257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  52 VAL  HN     86 GLY  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 748,1257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  52 VAL  HN     87 ALA  HA      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 748,1266, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  52 VAL  HN     88 ILE  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 748,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  54 SER  HN     88 ILE  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 783,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  60 GLY  HA2    56 THR  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 855, 807, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  60 GLY  HA3    56 THR  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 856, 807, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  65 ASN  HN     67 SER  HN      7.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 917, 950, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  47 SER  HB2    82 ALA  QB      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1191,1192,1193,
 &end
#
#  47 SER  HB3    82 ALA  QB      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 673,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1191,1192,1193,
 &end
#
#  67 SER  HN     68 PRO  HD2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 962, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  67 SER  HN     68 PRO  HD3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 963, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  69 PHE  HN     68 PRO  HB2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 968, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  69 PHE  HN     68 PRO  HB3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 969, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  69 PHE  HN     68 PRO  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 971, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  69 PHE  HN     68 PRO  HD2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 962, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  69 PHE  HN     68 PRO  HD3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 963, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  70 TYR  HN     73 LEU  HG      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 995,1048, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  72 ALA  HA     71 GLU  HB2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1020, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  72 ALA  HA     71 GLU  HB3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1021, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  73 LEU  HN     41 LEU  QD1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 588, 589, 590,
 &end
#
#  73 LEU  HA     41 LEU  QD1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 588, 589, 590,
 &end
#
#  77 LYS  HN     78 PRO  HD2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1132, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  77 LYS  HN     78 PRO  HD3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1133, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  77 LYS  HA     78 PRO  HD2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1132, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  77 LYS  HA     78 PRO  HD3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1111,1133, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  79 ASP  HN     78 PRO  QG      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1145,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1135,1136,
 &end
#
#  80 LEU  HN     83 VAL  QG1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1203,1204,1205,
 &end
#
#  80 LEU  QD1    50 TRP  HD1     5.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1166,1167,1168,
 &end
#
#  85 PHE  HN    116 GLN  HA      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1690, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  85 PHE  HN    117 THR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1705, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  85 PHE  HN    115 LYS  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1666, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  86 GLY  HA2   117 THR  HN      5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1705, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  86 GLY  HA3   117 THR  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1260,1705, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  88 ILE  HA    121 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1755, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  89 GLY  HN    121 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1755, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  89 GLY  HN    122 LYS  HA      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1776, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  89 GLY  HN    123 ILE  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1796, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  82 ALA  QB     47 SER  HB2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1191,1192,1193,
 &end
#
#  82 ALA  QB     47 SER  HB3     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 673, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1191,1192,1193,
 &end
#
#  83 VAL  QG1    50 TRP  HD1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1203,1204,1205,
 &end
#
#  83 VAL  QG2    50 TRP  HD1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1207,1208,1209,
 &end
#
#  83 VAL  QG1    47 SER  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1203,1204,1205,
 &end
#
#  83 VAL  QG1    81 SER  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1203,1204,1205,
 &end
#
#  83 VAL  QG1    82 ALA  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1203,1204,1205,
 &end
#
#  48 GLY  HN     83 VAL  QG1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 679,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1203,1204,1205,
 &end
#
#  48 GLY  HN     83 VAL  QG2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 679,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1207,1208,1209,
 &end
#
#  85 PHE  HN     83 VAL  QG2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1237,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1207,1208,1209,
 &end
#
#  86 GLY  HN     85 PHE  QD      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1245,1253,
 &end
#
#  87 ALA  QB    120 THR  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1743, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1268,1269,1270,
 &end
#
#  87 ALA  QB    120 THR  QG2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1268,1269,1270,
 igr2=1747,1748,1749,
 &end
#
#  89 GLY  HN     88 ILE  QG2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1280,1281,1282,
 &end
#
#  89 GLY  HN     88 ILE  QG1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1284,1285,
 &end
#
#  88 ILE  HN     90 ILE  QG2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1306,1307,1308,
 &end
#
#  84 ARG  HE    117 THR  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1226,1705, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  97 THR  QG2    95 TYR  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1415,1416,1417,
 &end
#
# 105 LEU  QD2    70 TYR  QD      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1537,1538,1539,
 igr2=1003,1012,
 &end
#
# 108 GLU  HN    105 LEU  QD1     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1533,1534,1535,
 &end
#
# 108 GLU  HN    105 LEU  QD2     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1537,1538,1539,
 &end
#
#  83 VAL  HN    114 ALA  QB      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1197,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1660,1661,1662,
 &end
#
# 114 ALA  QB     83 VAL  HB      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1660,1661,1662,
 &end
#
# 115 LYS  HN     84 ARG  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1666,1215, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 115 LYS  HB2    84 ARG  HA      7.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1670,1215, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 115 LYS  HB3    84 ARG  HA      7.00
 &rst
  ixpk= 0, nxpk= 0, iat=1671,1215, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 117 THR  HN     84 ARG  HE      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1705,1226, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 117 THR  HB     84 ARG  HE      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1709,1226, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 118 GLY  HN    117 THR  QG2     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1719,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1711,1712,1713,
 &end
#
# 119 GLU  HN    117 THR  QG2     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1711,1712,1713,
 &end
#
# 119 GLU  HN    138 TRP  HE1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1726,2032, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 120 THR  HN    119 GLU  HG2     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1733, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 120 THR  HN    119 GLU  HG3     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1734, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 130 ILE  HA    131 PRO  HD2     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1910,1928, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 130 ILE  HA    131 PRO  HD3     5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1910,1929, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 138 TRP  HA    121 LEU  HG      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2024,1762, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 138 TRP  HA    121 LEU  QD1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2024,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1764,1765,1766,
 &end
#
# 139 LEU  HN    121 LEU  HG      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2046,1762, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 139 LEU  HN    121 LEU  QD1     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2046,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1764,1765,1766,
 &end
#
#   4 ILE  HN      3 ASP  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  31, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   4 ILE  HN      3 ASP  HA      3.50  
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  33, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   4 ILE  HN      3 ASP  HB3     5.30  
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  36, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   4 ILE  HN      3 ASP  HB2     5.30  
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  35, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   5 THR  HN      4 ILE  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  43, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   5 THR  HN      4 ILE  HA      3.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  45, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#   5 THR  HN      4 ILE  HB      5.30  
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  47, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   6 LEU  HN      5 THR  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  62, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   6 LEU  HN      5 THR  HA      3.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  64, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#   6 LEU  HN      5 THR  HB      5.30  
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  66, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   7 ILE  HN      6 LEU  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  76, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   7 ILE  HN      6 LEU  HA      3.00  
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  78, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#   7 ILE  HN      6 LEU  HB3     5.30  
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  81, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   7 ILE  HN      6 LEU  HB2     5.30  
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  80, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   8 SER  HN      7 ILE  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  95, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   8 SER  HN      7 ILE  HA      3.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  97, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#   8 SER  HN      7 ILE  HB      5.30  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  99, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  10 SER  HN      9 GLY  HA2     4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 127, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  10 SER  HN      9 GLY  HA3     4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 128, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  18 VAL  HN     17 TYR  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 215, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  18 VAL  HN     17 TYR  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 217, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  18 VAL  HN     17 TYR  HB3     5.30  
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 220, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  18 VAL  HN     17 TYR  HB2     5.30  
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 219, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  19 ALA  HN     18 VAL  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 236, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  18 VAL  HN     18 VAL  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 238, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  18 VAL  HN     18 VAL  HB      5.30  
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  20 GLU  HN     19 ALA  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 252, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  20 GLU  HN     19 ALA  QB      5.30  
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2= 256, 257, 258,
 &end
#
#  21 HIS  HN     20 GLU  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 262, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  21 HIS  HN     20 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 264, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  21 HIS  HN     20 GLU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 267, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  21 HIS  HN     20 GLU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 266, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  21 HIS  HN     18 VAL  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 238, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  22 LEU  HN     21 HIS  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 277, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  22 LEU  HN     21 HIS  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 279, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  22 LEU  HN     21 HIS  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 282, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  22 LEU  HN     21 HIS  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 281, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  22 LEU  HN     19 ALA  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 254, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  23 ALA  HN     22 LEU  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 294, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  23 ALA  HN     22 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 296, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  23 ALA  HN     22 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 299, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  23 ALA  HN     22 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 298, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  23 ALA  HN     21 HIS  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 277, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  24 GLU  HN     23 ALA  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 313, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  24 GLU  HN     23 ALA  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 315, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  24 GLU  HN     23 ALA  QB	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 317, 318, 319,
 &end
#
#  24 GLU  HN     21 HIS  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 279, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  24 GLU  HN     22 LEU  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 294, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  25 LYS  HN     24 GLU  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 323, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  25 LYS  HN     24 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 325, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  25 LYS  HN     24 GLU  HB3	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 328, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  25 LYS  HN     24 GLU  HB2	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 327, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  25 LYS  HN     22 LEU  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 296, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  26 LEU  HN     25 LYS  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 338, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  26 LEU  HN     25 LYS  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 340, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  26 LEU  HN     25 LYS  HB3	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 343, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  26 LEU  HN     25 LYS  HB2	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 342, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  26 LEU  HN	23 ALA  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 315, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  26 LEU  HN	24 GLU  HN	5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 323, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  27 GLU  HN     26 LEU  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 360, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  27 GLU  HN	26 LEU  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 362, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  27 GLU  HN	26 LEU  HB3	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 365, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  27 GLU  HN	26 LEU  HB2	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 364, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  27 GLU  HN	24 GLU  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 325, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  27 GLU  HN	25 LYS  HN	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 338, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  28 GLU  HN     27 GLU  HN      3.40  
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 379, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  28 GLU  HN	27 GLU  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 381, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  28 GLU  HN	27 GLU  HB3	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 384, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  28 GLU  HN	27 GLU  HB2	4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 383, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  28 GLU  HN	25 LYS  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 340, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  28 GLU  HN	26 LEU  HN	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 360, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  29 ALA  HN     28 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 394, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  29 ALA  HN	28 GLU  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 396, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  29 ALA  HN	28 GLU  HB3	  4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 399, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  29 ALA  HN	28 GLU  HB2	  4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 398, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  29 ALA  HN	26 LEU  HA	  4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 362, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  30 GLY  HN     29 ALA  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 409, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  30 GLY  HN	29 ALA  HA	4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 411, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  30 GLY  HN	29 ALA  QB	  4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 413, 414, 415,
 &end
#
#  30 GLY  HN	27 GLU  HA	  4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 381, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  30 GLY  HN	28 GLU  HN	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 394, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  31 PHE  HN     30 GLY  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 419, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  31 PHE  HN	30 GLY  HA2	4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 421, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  31 PHE  HN	30 GLY  HA3	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 422, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  31 PHE  HN	29 ALA  HN	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 409, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  32 THR  HN     31 PHE  HN      6.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 426, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  32 THR  HN	31 PHE  HA	4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 428, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  32 THR  HN	31 PHE  HB	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 430, 431,
 &end
#
#  33 THR  HN     32 THR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 446, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  33 THR  HN	32 THR  HA	4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 448, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  33 THR  HN	32 THR  HB	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 450, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  34 GLU  HN     33 THR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 460, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  34 GLU  HN	33 THR  HA	3.80  
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 462, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  34 GLU  HN	33 THR  HB	5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 464, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  35 THR  HN     34 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 474, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  35 THR  HN     34 GLU  HA      3.80  
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 476, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  35 THR  HN     34 GLU  HB2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 478, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  35 THR	 HN     34 GLU  HB2     5.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 478, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  70 TYR  HN     69 PHE  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 975, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  70 TYR	 HN     69 PHE  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 977, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  70 TYR	 HN     69 PHE  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 979, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  70 TYR  HN     69 PHE  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 980, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  71 GLU  HN     70 TYR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1016, 995, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  71 GLU	 HN     70 TYR  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1016, 997, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  72 ALA  HN     71 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  72 ALA	 HN     71 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1018, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  72 ALA	 HN     71 GLU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1020, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  72 ALA  HN     71 GLU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1021, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  72 ALA	 HN     70 TYR  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1031, 995, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  72 ALA	 HN     69 PHE  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1031, 977, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  73 LEU  HN     72 ALA  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1033, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  73 LEU	 HN     72 ALA  QB      4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1035,1036,1037,
 &end
#
#  73 LEU  HN     71 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  73 LEU	 HN     70 TYR  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1041, 997, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  74 GLN  HN     73 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1041, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  74 GLN	 HN     73 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1043, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  74 GLN	 HN     73 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1045, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  74 GLN  HN     73 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1046, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  75 GLU  HN     74 GLN  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1060, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  75 GLU	 HN     74 GLN  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1062, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  75 GLU	 HN     74 GLN  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1064, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  75 GLU  HN     74 GLN  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1065, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  75 GLU	 HN     73 LEU  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1041, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  75 GLU	 HN     72 ALA  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1033, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  76 GLN  HN     75 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1077, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  76 GLN	 HN     75 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1079, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  76 GLN	 HN     75 GLU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1081, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  76 GLN  HN     75 GLU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1082, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  76 GLN	 HN     73 LEU  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1043, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 104 LYS  HN    103 ASP  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1492, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 104 LYS	 HN    103 ASP  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1494, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 104 LYS  HN    103 ASP  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1495, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 105 LEU  HN    104 LYS  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1524,1502, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 LEU	 HN    104 LYS  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1524,1506, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 105 LEU  HN    104 LYS  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1524,1507, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 106 GLU  HN    105 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1524, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 106 GLU	 HN    105 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1526, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 106 GLU	 HN    105 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1528, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 106 GLU  HN    105 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1529, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 106 GLU  HN    104 LYS  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1502, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 106 GLU	 HN    103 ASP  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1492, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 107 ALA  HN    106 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1543, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 107 ALA	 HN    106 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1545, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 107 ALA	 HN    106 GLU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1547, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 107 ALA  HN    106 GLU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1548, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 107 ALA	 HN    105 LEU  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1524, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 107 ALA	 HN    103 ASP  HA      4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1492, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 108 GLU  HN    107 ALA  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1558, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 108 GLU	 HN    107 ALA  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1560, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 108 GLU	 HN    107 ALA  QB      4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1562,1563,1564,
 &end
#
# 108 GLU  HN    106 GLU  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1543, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 109 LEU  HN    108 GLU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1568, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 109 LEU	 HN    108 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1570, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 109 LEU	 HN    108 GLU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1572, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 109 LEU  HN    108 GLU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1573, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 109 LEU	 HN    107 ALA  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1558, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 109 LEU	 HN    106 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1545, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 110 LYS  HN    109 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1583, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 110 LYS	 HN    109 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 110 LYS	 HN    109 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1587, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 110 LYS  HN    109 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1588, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 110 LYS	 HN    108 GLU  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1568, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 110 LYS	 HN    107 ALA  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1560, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 111 ASN  HN    110 LYS  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1602, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 111 ASN	 HN    110 LYS  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1604, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 111 ASN	 HN    110 LYS  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1606, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 111 ASN  HN    110 LYS  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1607, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 111 ASN	 HN    109 LEU  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1585, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 111 ASN	 HN    108 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1570, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 111 ASN	 HN    107 ALA  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1560, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 112 SER  HN    111 ASN  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1624, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 112 SER	 HN    111 ASN  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1626, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 112 SER	 HN    111 ASN  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1628, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 112 SER  HN    111 ASN  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1629, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 112 SER	 HN    110 LYS  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1602, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 112 SER	 HN    110 LYS  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1604, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 112 SER	 HN    109 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 113 GLY  HN    112 SER  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1638, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 113 GLY	 HN    112 SER  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1640, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 113 GLY	 HN    112 SER  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1642, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 113 GLY  HN    112 SER  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1643, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 113 GLY	 HN    111 ASN  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1624, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 113 GLY	 HN    110 LYS  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1604, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 138 TRP  HN    137 GLU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2022,2009, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 139 LEU  HN    138 TRP  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2022, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 139 LEU	 HN    138 TRP  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2024, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 139 LEU	 HN    138 TRP  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2026, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 139 LEU  HN    138 TRP  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2027, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 140 GLY  HN    139 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2046, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 140 GLY	 HN    139 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2048, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 140 GLY	 HN    139 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2050, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 140 GLY  HN    139 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2051, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 140 GLY	 HN    137 GLU  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2009, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 141 SER  HN    140 GLY  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2065, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 141 SER	 HN    140 GLY  HA2     4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2067, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 141 SER	 HN    140 GLY  HA3     4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2068, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 141 SER  HN    138 TRP  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2024, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 142 TRP  HN    141 SER  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2072, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 142 TRP	 HN    141 SER  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2074, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 142 TRP	 HN    141 SER  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2076, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 142 TRP  HN    141 SER  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2077, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 143 VAL  HN    142 TRP  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2083, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 143 VAL	 HN    142 TRP  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2085, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 143 VAL	 HN    142 TRP  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2087, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 143 VAL  HN    142 TRP  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2088, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 144 ASN  HN    143 VAL  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2107, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 144 ASN	 HN    143 VAL  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2109, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 144 ASN	 HN    143 VAL  HB      4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2111, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 144 ASN  HN    141 SER  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2074, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 145 LEU  HN    144 ASN  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 145 LEU	 HN    144 ASN  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2127, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 145 LEU	 HN    144 ASN  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2128, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 145 LEU  HN    143 VAL  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2107, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 146 LEU  HN    145 LEU  HN      4.50  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2137, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 146 LEU	 HN    145 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2139, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 146 LEU	 HN    145 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2141, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 146 LEU  HN    145 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2142, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 146 LEU	 HN    144 ASN  HN      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2123, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 146 LEU	 HN    143 VAL  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2109, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 146 LEU  HN    146 LEU  HN      4.50  
#This appears to be self-referential: ignoring
#
# 146 LEU	 HN    146 LEU  HA      4.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2158, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 146 LEU	 HN    146 LEU  HB2     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2160, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 146 LEU  HN    146 LEU  HB3     4.70  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2161, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 146 LEU	 HN    145 LEU  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2139, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 146 LEU	 HN    144 ASN  HA      5.00  
 &rst
  ixpk= 0, nxpk= 0, iat=2156,2125, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:11       6 LEU  HN          3.20    (#     11:10  Single Ambig)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=  80,  81, 510,
 &end
#
#    0 AMB  10-2:15      50 TRP  HN          3.20    (#     15:10  Single Ambig)
 &rst
  ixpk= 15, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1=1239, 713,
 &end
#
#    0 AMB  10-2:31      36 LEU  HN          2.60    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 510,  80,  81,
 &end
#
#    0 AMB  10-2:43      84 ARG  HN          4.00    (#     43:10  Single Ambig)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 679,1197, 686,
 &end
#
#    0 AMB  10-2:59      52 VAL  HN          4.80    (#     59:10  Single Ambig)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
 igr1=1284,1285, 738, 739, 740, 742, 743, 744, 774, 775,
       777, 778, 779,
 &end
#
#    0 AMB  10-2:61     116 GLN  HN          4.80    (#     61:10  Single Ambig)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1666,1602,
 &end
#
#    0 AMB  10-2:65     116 GLN  HN          3.00    (#     65:10  Single Ambig)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=1690,1241,1242,
 &end
#
#    0 AMB  10-2:67     116 GLN  HN          4.80    (#     67:10  Single Ambig)
 &rst
  ixpk= 67, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1695,1696,1547,1548,
 &end
#
#    0 AMB  10-2:92     117 THR  HN          2.40    (#     92:10  Single Ambig)
 &rst
  ixpk= 92, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr1=1690,1259,1260,
 &end
#
#    0 AMB  10-2:105     84 ARG  HE          2.60    (#    105:10  Single Ambig)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1=2093,2096,
 &end
#
#    0 AMB  10-2:112      5 THR  HN          2.40    (#    112:10  Single Ambig)
 &rst
  ixpk= 112, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr1=  45,  64,
 &end
#
#    0 AMB  10-2:114      5 THR  HN          4.80    (#    114:10  Single Ambig)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1=  53,  54,  25,  26,  27,
 &end
#
#    0 AMB  10-2:124     51 LEU  HN          5.00    (#    124:10  Single Ambig)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 713,1239,
 &end
#
#    0 AMB  10-2:137     51 LEU  HN          4.80    (#    137:10  Single Ambig)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 738, 739, 740, 742, 743, 744, 105, 106,
 &end
#
#    0 AMB  10-2:154     50 TRP  HE1         4.00    (#    154:10  Single Ambig)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 629, 630,1201,
 &end
#
#    0 AMB  10-2:184     82 ALA  HN          4.00    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1180,1181,1180,1181,
 &end
#
#    0 AMB  10-2:200      0 AMB  10-1:200    4.30    (#    200:10  Double Ambig)
 &rst
  ixpk= 200, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 474, 394,
 igr2= 489, 360,
 &end
#
#    0 AMB  10-2:269     23 ALA  HN          3.20    (#    269:10  Single Ambig)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1= 315, 296,
 &end
#
#    0 AMB  10-2:270     23 ALA  HN          5.00    (#    270:10  Single Ambig)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 301, 266, 267,
 &end
#
#    0 AMB  10-2:300    109 LEU  HN          3.00    (#    300:10  Single Ambig)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr1=1585,1545,
 &end
#
#    0 AMB  10-2:309     72 ALA  HN          3.80    (#    309:10  Single Ambig)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=1018, 997,
 &end
#
#    0 AMB  10-2:313     72 ALA  HN          5.20    (#    313:10  Single Ambig)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1048, 583, 584,
 &end
#
#    0 AMB  10-2:322     27 GLU  HN          4.00    (#    322:10  Single Ambig)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 409, 338,
 &end
#
#    0 AMB  10-2:331    139 LEU  HN          3.20    (#    331:10  Single Ambig)
 &rst
  ixpk= 331, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1=2022,2007,
 &end
#
#    0 AMB  10-2:371    104 LYS  HN          3.50    (#    371:10  Single Ambig)
 &rst
  ixpk= 371, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1492, 907,
 &end
#
#    0 AMB  10-2:423     88 ILE  HN          4.00    (#    423:10  Single Ambig)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1284,1285, 774, 775,
 &end
#
#    0 AMB  10-2:439     70 TYR  HN          5.50    (#    439:10  Single Ambig)
 &rst
  ixpk= 439, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 940, 941, 942, 944, 945, 946, 588, 589, 590, 592,
       593, 594,
 &end
#
#    0 AMB  10-2:448    110 LYS  HN          4.00    (#    448:10  Single Ambig)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1585,1545,
 &end
#
#    0 AMB  10-2:478    107 ALA  HN          6.50    (#    478:10  Single Ambig)
 &rst
  ixpk= 478, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 8.50, r4= 9.00,
 igr1=1609,1610,1531,1045,1046,
 &end
#
#    0 AMB  10-2:481    106 GLU  HN          4.50    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1531,1609,1610,
 &end
#
#    0 AMB  10-2:488    106 GLU  HN          4.50    (#    488:10  Single Ambig)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1330,1331,1526,
 &end
#
#    0 AMB  10-2:498     21 HIS  HN          3.00    (#    498:10  Single Ambig)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr1= 262, 252,
 &end
#
#    0 AMB  10-2:517     73 LEU  HN          4.00    (#    517:10  Single Ambig)
 &rst
  ixpk= 517, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1033, 977,
 &end
#
#    0 AMB  10-2:560     25 LYS  HN          4.00    (#    560:10  Single Ambig)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 296, 315,
 &end
#
#    0 AMB  10-2:582     71 GLU  HN          3.20    (#    582:10  Single Ambig)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1=1031,1041,
 &end
#
#    0 AMB  10-2:585     71 GLU  HN          3.00    (#    585:10  Single Ambig)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr1=1018, 997,
 &end
#
#    0 AMB  10-2:613     85 PHE  HN          3.30    (#    613:10  Single Ambig)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1241,1242,1690,
 &end
#
#    0 AMB  10-2:619     75 GLU  HN          4.00    (#    619:10  Single Ambig)
 &rst
  ixpk= 619, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1041,1031,
 &end
#
#    0 AMB  10-2:620     75 GLU  HN          3.80    (#    620:10  Single Ambig)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=1062,1018,
 &end
#
#    0 AMB  10-2:625     65 ASN  HN          4.00    (#    625:10  Single Ambig)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 909, 910, 864, 865,
 &end
#
#    0 AMB  10-2:667     91 GLY  HN          5.00    (#    667:10  Single Ambig)
 &rst
  ixpk= 667, nxpk= 10, iat=  -1,1319, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1=1310,1311,1268,1269,1270,
 &end
#
#    0 AMB  10-2:677     56 THR  HN          4.00    (#    677:10  Single Ambig)
 &rst
  ixpk= 677, nxpk= 10, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 809,1321,1322,
 &end
#
#    0 AMB  10-2:682      0 AMB  10-1:682    4.50    (#    682:10  Double Ambig)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2024,1033,
 igr2=2072,1060,
 &end
#
#    0 AMB  10-2:705     42 GLU  HN          4.10    (#    705:10  Single Ambig)
 &rst
  ixpk= 705, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 583, 584, 567,
 &end
#
#    0 AMB  10-2:717     77 LYS  HN          4.20    (#    717:10  Single Ambig)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1=1096,1097,1135,1136,
 &end
#
#    0 AMB  10-2:725     81 SER  HN          3.20    (#    725:10  Single Ambig)
 &rst
  ixpk= 725, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1=1159,1658,
 &end
#
#    0 AMB  10-2:755     32 THR  HN          4.00    (#    755:10  Single Ambig)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 450,  33,
 &end
#
#    0 AMB  10-2:765      0 AMB  10-1:765    5.00    (#    765:10  Double Ambig)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1=1572,1573,1575,1576,
 igr2=1633,1634,1633,1634,
 &end
#
#    0 AMB  10-2:769      0 AMB  10-1:769    4.20    (#    769:10  Double Ambig)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 583, 584,1138,1139,
 igr2=1104,1105,1104,1105,
 &end
#
#    0 AMB  10-2:785      0 AMB  10-1:785    4.00    (#    785:10  Double Ambig)
 &rst
  ixpk= 785, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1064,1065,1067,1068,
 igr2=1072,1073,1072,1073,
 &end
#
#    0 AMB  10-2:787     74 GLN  HE2-        4.00    (#    787:10  Single Ambig)
 &rst
  ixpk= 787, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1064,1065,1067,1068,
 igr2=1072,1073,
 &end
#
#    0 AMB  10-2:793     33 THR  HN          3.00    (#    793:10  Single Ambig)
 &rst
  ixpk= 793, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 386, 387, 386, 387,
 &end
#
#    0 AMB  10-2:825    113 GLY  HN          2.40    (#    825:10  Single Ambig)
 &rst
  ixpk= 825, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr1=1656,1638,
 &end
#
#    0 AMB  10-2:833     48 GLY  HN          2.40    (#    833:10  Single Ambig)
 &rst
  ixpk= 833, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr1=1199, 670,
 &end
#
#    0 AMB  10-2:871      6 LEU  HN          4.80    (#    871:10  Single Ambig)
 &rst
  ixpk= 871, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=  83, 317, 318, 319,
 &end
#
#    0 AMB  10-2:879     36 LEU  HN          4.50    (#    879:10  Single Ambig)
 &rst
  ixpk= 879, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 493, 254,
 &end
#
#    0 AMB  10-2:912    122 LYS  HN          4.00    (#    912:10  Single Ambig)
 &rst
  ixpk= 912, nxpk= 10, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1762,1280,1281,1282,
 &end
#
#    0 AMB  10-2:921      5 THR  HN          4.50    (#    921:10  Single Ambig)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 629, 630,  53,  54,
 &end
#
#    0 AMB  10-2:923      5 THR  HN          4.50    (#    923:10  Single Ambig)
 &rst
  ixpk= 923, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  47, 696, 697,
 &end
#
#    0 AMB  10-2:928      5 THR  HN          5.00    (#    928:10  Single Ambig)
 &rst
  ixpk= 928, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1=  76,1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  10-2:944    120 THR  HN          4.50    (#    944:10  Single Ambig)
 &rst
  ixpk= 944, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1755,1361,
 &end
#
#    0 AMB  10-2:947     50 TRP  HE1         5.50    (#    947:10  Single Ambig)
 &rst
  ixpk= 947, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 686, 679,
 &end
#
#    0 AMB  10-2:952     50 TRP  HE1         6.00    (#    952:10  Single Ambig)
 &rst
  ixpk= 952, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 662, 663, 664, 632,
 &end
#
#    0 AMB  10-2:953     50 TRP  HE1         5.00    (#    953:10  Single Ambig)
 &rst
  ixpk= 953, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1=  68,  69,  70,1166,1167,1168,1170,1171,1172,1166,
      1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  10-2:955     50 TRP  HE1         6.50    (#    955:10  Single Ambig)
 &rst
  ixpk= 955, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 681, 682, 654,1159,
 &end
#
#    0 AMB  10-2:967     87 ALA  HN          4.80    (#    967:10  Single Ambig)
 &rst
  ixpk= 967, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1257,1741,
 &end
#
#    0 AMB  10-2:974    147 LYS  HN          6.50    (#    974:10  Single Ambig)
 &rst
  ixpk= 974, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#    0 AMB  10-2:987     41 LEU  HN          5.50    (#    987:10  Single Ambig)
 &rst
  ixpk= 987, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 613,1104,1105,
 &end
#
#    0 AMB  10-2:991     26 LEU  HN          5.50    (#    991:10  Single Ambig)
 &rst
  ixpk= 991, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 348, 349, 317, 318, 319,  83,
 &end
#
#    0 AMB  10-2:1008   114 ALA  HN          4.80    (#   1008:10  Single Ambig)
 &rst
  ixpk= 1008, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1642,1643,1180,1181,
 &end
#
#    0 AMB  10-2:1019    23 ALA  HN          6.00    (#   1019:10  Single Ambig)
 &rst
  ixpk= 1019, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 256, 257, 258, 774, 775,
 &end
#
#    0 AMB  10-2:1027    69 PHE  HN          4.00    (#   1027:10  Single Ambig)
 &rst
  ixpk= 1027, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 971, 145,
 &end
#
#    0 AMB  10-2:1036    72 ALA  HN          5.00    (#   1036:10  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1023,1024,1084,1085,
 &end
#
#    0 AMB  10-2:1043   111 ASN  HN          5.00    (#   1043:10  Single Ambig)
 &rst
  ixpk= 1043, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1609,1610,1045,1046,
 &end
#
#    0 AMB  10-2:1046   111 ASN  HN          5.00    (#   1046:10  Single Ambig)
 &rst
  ixpk= 1046, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1585,1545,
 &end
#
#    0 AMB  10-2:1049   111 ASN  HN          4.50    (#   1049:10  Single Ambig)
 &rst
  ixpk= 1049, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1649,1568,
 &end
#
#    0 AMB  10-2:1055    27 GLU  HN          4.00    (#   1055:10  Single Ambig)
 &rst
  ixpk= 1055, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 362, 340,
 &end
#
#    0 AMB  10-2:1070    49 ILE  HN          5.20    (#   1070:10  Single Ambig)
 &rst
  ixpk= 1070, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1213,  43,
 &end
#
#    0 AMB  10-2:1083    94 GLU  HN          4.00    (#   1083:10  Single Ambig)
 &rst
  ixpk= 1083, nxpk= 10, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1341,1342,1368,1369,
 &end
#
#    0 AMB  10-2:1088    44 LEU  HN          4.50    (#   1088:10  Single Ambig)
 &rst
  ixpk= 1088, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=  68,  69,  70, 512, 513, 514, 516, 517, 518,
 &end
#
#    0 AMB  10-2:1101    18 VAL  HN          6.30    (#   1101:10  Single Ambig)
 &rst
  ixpk= 1101, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1= 207, 208, 298, 299,
 &end
#
#    0 AMB  10-2:1133    70 TYR  HN          6.20    (#   1133:10  Single Ambig)
 &rst
  ixpk= 1133, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 9.38, r4= 9.88,
 igr1=1533,1534,1535,1537,1538,1539, 588, 589, 590, 592,
       593, 594,
 &end
#
#    0 AMB  10-2:1134    70 TYR  HN          5.50    (#   1134:10  Single Ambig)
 &rst
  ixpk= 1134, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 940, 941, 942, 944, 945, 946,1533,1534,1535,1537,
      1538,1539,
 &end
#
#    0 AMB  10-2:1154   110 LYS  HN          5.00    (#   1154:10  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1590,1562,1563,1564,
 &end
#
#    0 AMB  10-2:1171   107 ALA  HN          4.80    (#   1171:10  Single Ambig)
 &rst
  ixpk= 1171, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1492,1570,
 &end
#
#    0 AMB  10-2:1185    73 LEU  HN          4.00    (#   1185:10  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1077, 995,
 &end
#
#    0 AMB  10-2:1214    67 SER  HN          6.00    (#   1214:10  Single Ambig)
 &rst
  ixpk= 1214, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 999,1000, 979, 980,
 &end
#
#    0 AMB  10-2:1242    10 SER  HN          3.00    (#   1242:10  Single Ambig)
 &rst
  ixpk= 1242, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 127, 128, 787, 788,
 &end
#
#    0 AMB  10-2:1268    65 ASN  HN          3.80    (#   1268:10  Single Ambig)
 &rst
  ixpk= 1268, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 921, 922, 999,1000,
 &end
#
#    0 AMB  10-2:1282    24 GLU  HN          4.50    (#   1282:10  Single Ambig)
 &rst
  ixpk= 1282, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 294, 379,
 &end
#
#    0 AMB  10-2:1286     4 ILE  HN          4.50    (#   1286:10  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  23,  66,
 &end
#
#    0 AMB  10-2:1318    77 LYS  HN          4.00    (#   1318:10  Single Ambig)
 &rst
  ixpk= 1318, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1096,1097,1081,1082,
 &end
#
#    0 AMB  10-2:1340    89 GLY  HN          4.50    (#   1340:10  Single Ambig)
 &rst
  ixpk= 1340, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1806,1807,1781,1782,
 &end
#
#    0 AMB  10-2:1358     0 AMB  10-1:1358   4.00    (#   1358:10  Double Ambig)
 &rst
  ixpk= 1358, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 583, 584,1113,1114,1138,1139,
 igr2=1104,1105,1633,1634,
 &end
#
#    0 AMB  10-2:1361   143 VAL  HN          4.80    (#   1361:10  Single Ambig)
 &rst
  ixpk= 1361, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=2067,2068,2076,2077,
 &end
#
#    0 AMB  10-2:1362   143 VAL  HN          4.20    (#   1362:10  Single Ambig)
 &rst
  ixpk= 1362, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=2048,2076,2077,
 &end
#
#    0 AMB  10-2:1377     0 AMB  10-1:1377   4.20    (#   1377:10  Double Ambig)
 &rst
  ixpk= 1377, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 464, 541, 542,
 igr2= 460, 176,
 &end
#
#    0 AMB  10-2:1378    33 THR  HN          5.00    (#   1378:10  Single Ambig)
 &rst
  ixpk= 1378, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 474, 426,
 &end
#
#    0 AMB  10-2:1380    47 SER  HN          4.00    (#   1380:10  Single Ambig)
 &rst
  ixpk= 1380, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 679, 686,
 &end
#
#    0 AMB  10-2:1390     0 AMB  10-1:1390   6.20    (#   1390:10  Double Ambig)
 &rst
  ixpk= 1390, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.82, r4=12.32,
 igr1=1747,1748,1749,1306,1307,1308,1310,1311,
 igr2=1700,1701,1700,1701,1700,1701,
 &end
#
#    0 AMB  10-2:1403   113 GLY  HN          6.00    (#   1403:10  Single Ambig)
 &rst
  ixpk= 1403, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=1606,1607,1606,1607,
 &end
#
#    0 AMB  10-2:1418   140 GLY  HN          5.00    (#   1418:10  Single Ambig)
 &rst
  ixpk= 1418, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=2022,2007,
 &end
#
#    0 AMB  10-2:1421   140 GLY  HN          5.80    (#   1421:10  Single Ambig)
 &rst
  ixpk= 1421, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
 igr1=1996,1997,2111,2011,2012,
 &end
#
#    0 AMB  10-2:1426     3 ASP  HN          6.20    (#   1426:10  Single Ambig)
 &rst
  ixpk= 1426, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
 igr1= 428, 381,
 &end
#
#    0 AMB  10-2:1435    50 TRP  HN          4.50    (#   1435:10  Single Ambig)
 &rst
  ixpk= 1435, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 686, 679,
 &end
#
#    0 AMB  10-2:1441    52 VAL  HN          4.80    (#   1441:10  Single Ambig)
 &rst
  ixpk= 1441, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1259,1260,1241,1242,
 &end
#
#    0 AMB  10-2:1448    57 HIS  HN          3.00    (#   1448:10  Single Ambig)
 &rst
  ixpk= 1448, nxpk= 10, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 823, 824, 823, 824,
 &end
#
#    0 AMB  10-2:1464   110 LYS  HN          5.50    (#   1464:10  Single Ambig)
 &rst
  ixpk= 1464, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1615,1616,1615,1616,
 &end
#
#    0 AMB  10-2:1465   112 SER  HN          5.50    (#   1465:10  Single Ambig)
 &rst
  ixpk= 1465, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1651,1652,1111,
 &end
#
# 120 THR HA 121 LEU HN 2.40  (# 0.0000 1:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1743,1755, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, 
      rk2=80.0, rk3=80.0, ir6=1, ialtd=0,
 &end
#
# 121 LEU QD2 121 LEU HN 5.00  (# 0.0000 2:10 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1768,1769,1770,
 &end
#
# 88 ILE HG12 121 LEU HN 4.80  (# 0.9045 4:10 3.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1755, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 34 GLU HN 6 LEU HN 3.80  (# 0.0000 7:10 3.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474,  76, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 6 LEU HA 6 LEU HN 3.20  (# 0.0000 8:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  76, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 5 THR HA 6 LEU HN 2.40  (# 0.9978 9:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  76, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 6 LEU HB2 6 LEU HN 3.20  (# 0.9085 10:10 2.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  76, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 49 ILE HA 50 TRP HN 2.40  (# 0.0000 16:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688, 705, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 50 TRP HB2 50 TRP HN 3.30  (# 0.0000 18:10 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 705, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 50 TRP HB3 50 TRP HN 4.00  (# 0.0000 19:10 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 710, 705, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 7 ILE HA 36 LEU HN 5.00  (# 0.0000 24:10 4.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 503, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 35 THR HN 36 LEU HN 5.00  (# 0.0000 26:10 4.29,)
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 503, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 35 THR HA 36 LEU HN 2.40  (# 0.9996 27:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 491, 503, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 36 LEU HA 36 LEU HN 3.20  (# 0.9970 28:10 2.87,)
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 503, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 6 LEU HB2 36 LEU HN 3.30  (# 0.9724 29:10 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 503, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 36 LEU HB3 36 LEU HN 4.00  (# 0.0000 32:10 3.01,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 503, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 79 ASP HA 80 LEU HN 2.40  (# 0.0000 35:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1157, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 80 LEU HA 80 LEU HN 3.20  (# 0.9132 36:10 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1159,1157, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 80 LEU HG 80 LEU HN 4.30  (# 0.0000 39:10 3.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1164,1157, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 80 LEU HB3 80 LEU HN 5.00  (# 0.0000 40:10 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1162,1157, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 79 ASP HB3 80 LEU HN 4.80  (# 0.9724 42:10 4.33,)
 &rst
  ixpk= 0, nxpk= 0, iat=1150,1157, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 85 PHE HN 84 ARG HN 4.90  (# 0.9784 44:10 4.53,)
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1213, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 84 ARG HA 84 ARG HN 3.20  (# 0.0000 45:10 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1215,1213, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 49 ILE QD1 84 ARG HN 4.80  (# 0.9733 47:10 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 699, 700, 701,
 &end
#
# 83 VAL QG1 84 ARG HN 4.00  (# 0.9994 48:10 1.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1203,1204,1205,
 &end
#
# 83 VAL HA 84 ARG HN 2.40  (# 0.9934 49:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1199,1213, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 84 ARG HB2 84 ARG HN 3.80  (# 0.9527 50:10 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1213, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 51 LEU HA 52 VAL HN 2.40  (# 0.0000 52:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731, 748, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 52 VAL HB 52 VAL HN 3.40  (# 0.0000 53:10 3.09,)
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 748, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 52 VAL QG2 52 VAL HN 4.00  (# 0.9970 55:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 758, 759, 760,
 &end
#
# 87 ALA HA 52 VAL HN 4.10  (# 0.0000 56:10 3.77,)
 &rst
  ixpk= 0, nxpk= 0, iat=1266, 748, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 52 VAL HA 52 VAL HN 3.20  (# 0.0000 57:10 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 750, 748, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 115 LYS HA 116 GLN HN 2.40  (# 0.9997 64:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1668,1688, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 53 ILE HA 53 ILE HN 3.20  (# 0.9659 73:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 764, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 52 VAL HA 53 ILE HN 2.40  (# 0.0000 75:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 750, 764, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 53 ILE HB 53 ILE HN 3.00  (# 0.9984 76:10 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 768, 764, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 141 SER HN 142 TRP HN 3.00  (# 0.0000 78:10 2.68,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2083, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 141 SER HB3 142 TRP HN 3.00  (# 0.9555 79:10 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=2077,2083, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HA 142 TRP HN 3.00  (# 0.0000 80:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2083, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HB2 142 TRP HN 2.80  (# 0.0000 81:10 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=2087,2083, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 142 TRP HB3 142 TRP HN 2.80  (# 0.9982 82:10 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=2088,2083, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 141 SER HA 142 TRP HN 4.00  (# 0.0000 83:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2083, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 58 GLY HA3 59 ALA HN 3.80  (# 0.0000 85:10 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 839, 843, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 86 GLY HA2 117 THR HN 4.30  (# 0.0000 89:10 3.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1705, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 117 THR HA 117 THR HN 3.00  (# 0.9968 90:10 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1707,1705, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 117 THR HB 117 THR HN 2.80  (# 0.0000 91:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1709,1705, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 123 ILE HN 122 LYS HN 4.80  (# 0.0000 98:10 4.05,)
 &rst
  ixpk= 0, nxpk= 0, iat=1796,1774, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 122 LYS HA 122 LYS HN 3.00  (# 0.9977 99:10 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1774, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 121 LEU HA 122 LYS HN 2.60  (# 0.0000 100:10 2.24,)
 &rst
  ixpk= 0, nxpk= 0, iat=1757,1774, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 122 LYS HB2 122 LYS HN 3.30  (# 0.9995 101:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=1778,1774, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 5 THR HN 51 LEU HN 4.00  (# 0.9713 117:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=  62, 729, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 50 TRP HA 51 LEU HN 2.40  (# 0.0000 118:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 707, 729, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 6 LEU HA 51 LEU HN 4.00  (# 0.9254 119:10 3.44,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78, 729, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 LEU HA 51 LEU HN 3.20  (# 0.0000 120:10 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat= 731, 729, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 50 TRP HB3 51 LEU HN 4.20  (# 0.0000 121:10 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 710, 729, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 51 LEU HB2 51 LEU HN 3.20  (# 0.9973 122:10 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 729, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU HB3 51 LEU HN 4.00  (# 0.9981 125:10 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat= 734, 729, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 7 ILE QD1 51 LEU HN 5.00  (# 0.9914 126:10 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 108, 109, 110,
 &end
#
# 46 ALA HA 46 ALA HN 3.00  (# 0.0000 132:10 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat= 660, 658, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HB2 46 ALA HN 3.00  (# 0.0000 133:10 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 658, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 PRO HB3 46 ALA HN 3.00  (# 0.9981 134:10 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 658, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 123 ILE HA 124 ASN HN 2.40  (# 0.0000 138:10 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1798,1815, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 119 GLU HN 120 THR HN 5.00  (# 0.0000 140:10 4.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1726,1741, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 119 GLU HA 120 THR HN 2.60  (# 0.0000 143:10 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1741, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 119 GLU HB2 120 THR HN 3.30  (# 0.0000 146:10 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1741, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 119 GLU HB3 120 THR HN 4.00  (# 0.0000 147:10 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1731,1741, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 120 THR QG2 120 THR HN 4.00  (# 0.9980 148:10 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1747,1748,1749,
 &end
#
# 47 SER HN 50 TRP HE1 3.50  (# 0.0000 149:10 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 715, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 44 LEU HB3 50 TRP HE1 4.00  (# 0.9928 155:10 3.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 715, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 8 SER HN 7 ILE HN 4.50  (# 0.0000 158:10 4.11,)
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  95, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6 LEU HA 7 ILE HN 2.40  (# 0.9977 159:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  95, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 52 VAL HA 7 ILE HN 3.00  (# 0.9994 160:10 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat= 750,  95, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7 ILE HA 7 ILE HN 3.20  (# 0.0000 161:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=  97,  95, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU HB2 7 ILE HN 4.50  (# 0.0000 162:10 3.41,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733,  95, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7 ILE HG12 7 ILE HN 3.80  (# 0.9882 165:10 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat= 105,  95, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 6 LEU QD1 7 ILE HN 4.80  (# 0.9931 166:10 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=  85,  86,  87,
 &end
#
# 7 ILE QD1 7 ILE HN 4.00  (# 0.0000 167:10 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 108, 109, 110,
 &end
#
# 86 GLY HA2 87 ALA HN 2.80  (# 0.9991 168:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1264, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 120 THR HA 87 ALA HN 4.80  (# 0.9552 169:10 3.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=1743,1264, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 86 GLY HA3 87 ALA HN 3.80  (# 0.0000 170:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1260,1264, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 116 GLN HE22 87 ALA HN 4.00  (# 0.0000 173:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1701,1264, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 122 LYS HA 123 ILE HN 2.40  (# 0.9992 175:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1796, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 122 LYS HB2 123 ILE HN 4.00  (# 0.9988 177:10 2.59,)
 &rst
  ixpk= 0, nxpk= 0, iat=1778,1796, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 123 ILE HG12 123 ILE HN 3.80  (# 0.9997 178:10 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1796, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 123 ILE QD1 123 ILE HN 3.30  (# 0.9959 179:10 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1809,1810,1811,
 &end
#
# 83 VAL HN 82 ALA HN 2.20  (# 0.9983 180:10 1.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1197,1187, r1= 1.30, r2= 1.80, r3= 2.20, r4= 2.70,  &end
#
# 80 LEU HB2 82 ALA HN 5.00  (# 0.0000 187:10 3.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1161,1187, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 146 LEU HA 147 LYS HN 3.80  (# 0.0000 189:10 3.45,)
 &rst
  ixpk= 0, nxpk= 0, iat=2158,2175, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 147 LYS HB3 147 LYS HN 4.00  (# 0.0000 190:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2180,2175, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 147 LYS HG2 147 LYS HN 4.50  (# 0.0000 193:10 2.85,)
 &rst
  ixpk= 0, nxpk= 0, iat=2182,2175, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 146 LEU HB2 147 LYS HN 4.00  (# 0.0000 194:10 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat=2160,2175, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 146 LEU HG 147 LYS HN 3.20  (# 0.0000 195:10 2.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=2163,2175, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 97 THR HA 98 PHE HN 3.00  (# 0.9979 198:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1411,1423, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 35 THR HA 35 THR HN 3.20  (# 0.9960 202:10 2.84,)
 &rst
  ixpk= 0, nxpk= 0, iat= 491, 489, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 34 GLU HA 35 THR HN 2.40  (# 0.9994 203:10 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 489, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 40 LEU HA 41 LEU HN 3.30  (# 0.9910 209:10 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 562, 579, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 27 GLU HN 26 LEU HN 3.00  (# 0.0000 215:10 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 360, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 25 LYS HN 26 LEU HN 3.00  (# 0.0000 216:10 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 360, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 24 GLU HN 26 LEU HN 4.50  (# 0.0000 217:10 4.08,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 360, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26 LEU HA 26 LEU HN 3.00  (# 0.0000 218:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 362, 360, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 36 LEU HA 37 HIS HN 2.60  (# 0.0000 228:10 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 522, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 36 LEU HB3 37 HIS HN 3.20  (# 0.9924 232:10 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 522, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 37 HIS HA 37 HIS HN 3.20  (# 0.0000 233:10 2.83,)
 &rst
  ixpk= 0, nxpk= 0, iat= 524, 522, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 82 ALA HN 83 VAL HN 2.40  (# 0.9998 236:10 1.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1187,1197, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 80 LEU HN 114 ALA HN 4.50  (# 0.9024 245:10 3.59,)
 &rst
  ixpk= 0, nxpk= 0, iat=1157,1656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 113 GLY HN 114 ALA HN 2.40  (# 0.0000 247:10 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=1649,1656, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 80 LEU HB3 114 ALA HN 3.00  (# 0.9997 253:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1162,1656, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 80 LEU QD2 114 ALA HN 5.00  (# 0.0000 255:10 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1170,1171,1172,
 &end
#
# 80 LEU QD1 114 ALA HN 5.00  (# 0.9970 256:10 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1166,1167,1168,
 &end
#
# 27 GLU HA 28 GLU HN 4.00  (# 0.9923 261:10 3.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 394, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 28 GLU HB3 28 GLU HN 3.80  (# 0.9858 264:10 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 394, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 27 GLU HN 28 GLU HN 3.00  (# 0.0000 266:10 2.65,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 394, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 22 LEU HN 23 ALA HN 3.20  (# 0.9982 267:10 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 313, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 24 GLU HN 23 ALA HN 3.20  (# 0.0000 268:10 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 313, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 22 LEU HB3 23 ALA HN 3.00  (# 0.9933 271:10 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 313, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 33 THR HN 3 ASP HN 4.50  (# 0.0000 273:10 4.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460,  31, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4 ILE HN 3 ASP HN 2.20  (# 0.0000 276:10 1.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  31, r1= 1.30, r2= 1.80, r3= 2.20, r4= 2.70,  &end
#
# 3 ASP HB2 3 ASP HN 3.00  (# 0.0000 279:10 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=  35,  31, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 3 ASP HB3 3 ASP HN 3.00  (# 0.0000 280:10 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  31, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 70 TYR HN 69 PHE HN 3.00  (# 0.0000 282:10 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995, 975, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 66 LEU HA 69 PHE HN 4.80  (# 0.0000 284:10 3.98,)
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 975, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 69 PHE HA 69 PHE HN 3.00  (# 0.9877 285:10 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 977, 975, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 69 PHE HB3 69 PHE HN 4.00  (# 0.9837 287:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 980, 975, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 68 PRO HB3 69 PHE HN 4.00  (# 0.9308 288:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 975, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 137 GLU HB2 138 TRP HN 3.00  (# 0.0000 292:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=2011,2022, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 121 LEU HG 138 TRP HN 5.50  (# 0.0000 293:10 4.69,)
 &rst
  ixpk= 0, nxpk= 0, iat=1762,2022, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 139 LEU HN 138 TRP HN 3.20  (# 0.0000 295:10 2.84,)
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2022, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 110 LYS HN 109 LEU HN 3.00  (# 0.0000 298:10 2.59,)
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1583, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 108 GLU HN 109 LEU HN 3.00  (# 0.9971 299:10 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1583, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 109 LEU HB3 109 LEU HN 3.80  (# 0.0000 304:10 2.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1588,1583, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 71 GLU HG2 72 ALA HN 5.00  (# 0.0000 310:10 4.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1031, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 110 LYS HN 111 ASN HN 2.60  (# 0.9995 314:10 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1624, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 112 SER HN 111 ASN HN 2.60  (# 0.9936 315:10 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1624, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 27 GLU HA 27 GLU HN 3.00  (# 0.9980 323:10 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 379, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 138 TRP HA 139 LEU HN 3.80  (# 0.9906 332:10 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=2024,2046, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 139 LEU HB3 139 LEU HN 3.80  (# 0.9648 334:10 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=2051,2046, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 140 GLY HN 139 LEU HN 3.00  (# 0.0000 335:10 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=2065,2046, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 138 TRP HB2 139 LEU HN 3.20  (# 0.0000 336:10 2.63,)
 &rst
  ixpk= 0, nxpk= 0, iat=2026,2046, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 128 HIS HA 129 ASP HN 2.60  (# 0.0000 340:10 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1881,1896, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 137 GLU HB2 137 GLU HN 2.80  (# 0.0000 342:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=2011,2007, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 50 TRP HD1 49 ILE HN 4.50  (# 0.0000 346:10 3.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 713, 686, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 49 ILE HA 49 ILE HN 3.00  (# 0.0000 347:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688, 686, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4 ILE HA 49 ILE HN 4.00  (# 0.9937 348:10 2.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45, 686, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 48 GLY HA2 49 ILE HN 3.00  (# 0.9998 349:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 681, 686, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 49 ILE HB 49 ILE HN 3.30  (# 0.9912 351:10 2.87,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 686, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 18 VAL HN 19 ALA HN 2.40  (# 0.9908 356:10 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 252, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 33 THR HN 34 GLU HN 4.80  (# 0.0000 359:10 4.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 474, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 33 THR HA 34 GLU HN 2.60  (# 0.0000 360:10 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 474, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 5 THR HA 34 GLU HN 3.00  (# 0.9755 361:10 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=  64, 474, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 34 GLU HB3 34 GLU HN 3.00  (# 0.9291 363:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 474, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 93 ARG HA 94 GLU HN 3.50  (# 0.9936 365:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1339,1361, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 105 LEU HN 104 LYS HN 3.00  (# 0.0000 369:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat=1524,1502, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 104 LYS HG3 104 LYS HN 3.00  (# 0.0000 375:10 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1510,1502, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 LEU HA 44 LEU HN 3.20  (# 0.9975 379:10 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat= 627, 625, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 42 GLU HA 44 LEU HN 3.50  (# 0.0000 380:10 3.26,)
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 625, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 5 THR HB 44 LEU HN 2.50  (# 0.9996 381:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=  66, 625, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 84 ARG HA 115 LYS HN 2.80  (# 0.0000 388:10 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1215,1666, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 115 LYS HG2 115 LYS HN 3.00  (# 0.9974 391:10 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=1673,1666, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 114 ALA HN 115 LYS HN 5.00  (# 0.9612 393:10 4.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1656,1666, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 30 GLY HN 31 PHE HN 2.20  (# 0.0000 394:10 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 426, r1= 1.30, r2= 1.80, r3= 2.20, r4= 2.70,  &end
#
# 29 ALA HN 31 PHE HN 4.00  (# 0.0000 395:10 3.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 426, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 30 GLY HA2 31 PHE HN 3.50  (# 0.9573 398:10 3.10,)
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 426, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 106 GLU HN 105 LEU HN 3.50  (# 0.9267 402:10 3.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1524, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 104 LYS HN 105 LEU HN 3.00  (# 0.0000 403:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1524, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 105 LEU HB2 105 LEU HN 2.80  (# 0.9953 404:10 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1528,1524, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 107 ALA HN 105 LEU HN 4.20  (# 0.0000 406:10 3.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1524, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 19 ALA HN 18 VAL HN 2.50  (# 0.9729 407:10 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 236, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 17 TYR HN 18 VAL HN 3.00  (# 0.0000 408:10 2.48,)
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 236, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 17 TYR HA 18 VAL HN 4.00  (# 0.0000 409:10 3.48,)
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 236, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 18 VAL HA 18 VAL HN 3.20  (# 0.0000 410:10 2.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 236, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 18 VAL HB 18 VAL HN 2.60  (# 0.9941 411:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 236, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 54 SER HN 88 ILE HN 4.00  (# 0.0000 414:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat= 783,1274, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 89 GLY HN 88 ILE HN 4.50  (# 0.0000 418:10 4.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 87 ALA HA 88 ILE HN 2.40  (# 0.0000 419:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1266,1274, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 53 ILE HA 88 ILE HN 3.50  (# 0.9821 420:10 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat= 766,1274, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 88 ILE HA 88 ILE HN 3.20  (# 0.9967 421:10 2.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1274, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 88 ILE QG2 88 ILE HN 5.00  (# 0.9504 424:10 4.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1280,1281,1282,
 &end
#
# 27 GLU HN 29 ALA HN 4.50  (# 0.9928 427:10 3.78,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 409, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 GLU HA 29 ALA HN 4.00  (# 0.9714 428:10 3.63,)
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 409, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 29 ALA HA 29 ALA HN 3.00  (# 0.0000 429:10 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 409, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 71 GLU HN 70 TYR HN 3.20  (# 0.0000 433:10 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat=1016, 995, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 69 PHE HN 70 TYR HN 3.10  (# 0.0000 434:10 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 995, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 69 PHE HA 70 TYR HN 4.00  (# 0.9872 437:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat= 977, 995, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 38 GLY HN 8 SER HN 3.00  (# 0.9892 440:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 114, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 37 HIS HA 8 SER HN 3.00  (# 0.0000 441:10 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 524, 114, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7 ILE HA 8 SER HN 2.40  (# 0.9987 442:10 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 114, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 61 ASP HA 61 ASP HN 3.00  (# 0.0000 444:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 862, 860, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 61 ASP HB3 61 ASP HN 3.00  (# 0.9946 445:10 2.13,)
 &rst
  ixpk= 0, nxpk= 0, iat= 865, 860, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 112 SER HN 110 LYS HN 4.00  (# 0.9495 446:10 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=1638,1602, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 110 LYS HG2 110 LYS HN 3.50  (# 0.9907 449:10 2.33,)
 &rst
  ixpk= 0, nxpk= 0, iat=1609,1602, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 109 LEU HB3 110 LYS HN 4.00  (# 0.0000 451:10 2.62,)
 &rst
  ixpk= 0, nxpk= 0, iat=1588,1602, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 129 ASP HB2 130 ILE HN 2.80  (# 0.0000 454:10 1.90,)
 &rst
  ixpk= 0, nxpk= 0, iat=1900,1908, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 130 ILE HB 130 ILE HN 2.80  (# 0.0000 455:10 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1912,1908, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 16 GLU HA 17 TYR HN 3.80  (# 0.0000 460:10 3.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 215, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 40 LEU HN 43 ASP HN 5.00  (# 0.0000 461:10 4.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 613, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 42 GLU HA 43 ASP HN 2.80  (# 0.0000 462:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 613, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 40 LEU HB3 43 ASP HN 5.50  (# 0.9756 463:10 4.10,)
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 613, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 43 ASP HA 43 ASP HN 3.00  (# 0.9919 465:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 613, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 LEU HG 43 ASP HN 5.00  (# 0.9209 470:10 4.45,)
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 613, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 44 LEU HB3 43 ASP HN 7.00  (# 0.0000 471:10 4.71,)
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 613, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 106 GLU HN 107 ALA HN 3.00  (# 0.0000 473:10 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1558, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 109 LEU HN 107 ALA HN 4.20  (# 0.0000 474:10 3.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=1583,1558, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 106 GLU HG2 107 ALA HN 5.00  (# 0.0000 476:10 4.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=1550,1558, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 108 GLU HN 106 GLU HN 5.00  (# 0.0000 484:10 4.58,)
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1543, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 107 ALA HN 106 GLU HN 3.00  (# 0.0000 485:10 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=1558,1543, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 103 ASP HA 106 GLU HN 4.00  (# 0.9574 486:10 3.62,)
 &rst
  ixpk= 0, nxpk= 0, iat=1492,1543, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 106 GLU HA 106 GLU HN 3.00  (# 0.9965 489:10 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1543, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 105 LEU HB2 106 GLU HN 3.80  (# 0.9978 491:10 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1528,1543, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 105 LEU HB3 106 GLU HN 3.00  (# 0.0000 492:10 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1529,1543, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 110 LYS HD3 107 ALA HN 5.00  (# 0.9512 494:10 4.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1613,1558, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21 HIS HA 21 HIS HN 3.00  (# 0.0000 499:10 2.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 277, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20 GLU HA 21 HIS HN 4.00  (# 0.9842 500:10 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 277, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 18 VAL HA 21 HIS HN 4.20  (# 0.0000 501:10 3.60,)
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 277, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 18 VAL QG1 21 HIS HN 6.50  (# 0.0000 505:10 5.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 242, 243, 244,
 &end
#
# 144 ASN HA 146 LEU HN 5.00  (# 0.0000 507:10 4.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=2125,2156, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 145 LEU HA 146 LEU HN 4.00  (# 0.0000 509:10 3.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=2139,2156, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 146 LEU HA 146 LEU HN 3.00  (# 0.9922 510:10 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=2158,2156, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 143 VAL HA 146 LEU HN 4.00  (# 0.0000 511:10 3.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,2156, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 146 LEU HB3 146 LEU HN 3.20  (# 0.9880 512:10 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=2161,2156, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 146 LEU HB2 146 LEU HN 3.80  (# 0.0000 513:10 2.10,)
 &rst
  ixpk= 0, nxpk= 0, iat=2160,2156, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 146 LEU HG 146 LEU HN 3.00  (# 0.0000 514:10 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=2163,2156, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 71 GLU HN 73 LEU HN 4.50  (# 0.0000 516:10 3.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1041, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 73 LEU HA 73 LEU HN 3.00  (# 0.0000 519:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1041, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 73 LEU HB3 73 LEU HN 4.00  (# 0.0000 522:10 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,1041, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 23 ALA HN 22 LEU HN 3.20  (# 0.0000 526:10 2.89,)
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 294, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 21 HIS HN 22 LEU HN 3.20  (# 0.0000 527:10 2.85,)
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 294, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 22 LEU HB3 22 LEU HN 4.00  (# 0.9955 529:10 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 294, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 22 LEU HB2 22 LEU HN 3.20  (# 0.9979 530:10 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 294, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 21 HIS HA 22 LEU HN 3.80  (# 0.0000 532:10 3.57,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 294, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 22 LEU HA 22 LEU HN 3.00  (# 0.9793 533:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 296, 294, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21 HIS HB2 22 LEU HN 4.00  (# 0.0000 534:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 294, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 144 ASN HN 145 LEU HN 3.00  (# 0.0000 538:10 2.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2137, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 144 ASN HA 145 LEU HN 4.00  (# 0.0000 539:10 3.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=2125,2137, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 145 LEU HA 145 LEU HN 3.00  (# 0.9980 540:10 2.80,)
 &rst
  ixpk= 0, nxpk= 0, iat=2139,2137, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 146 LEU QD1 145 LEU HN 6.50  (# 0.0000 544:10 3.80,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=2165,2166,2167,
 &end
#
# 94 GLU HN 95 TYR HN 4.00  (# 0.9681 545:10 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1361,1376, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 95 TYR HA 95 TYR HN 3.00  (# 0.0000 547:10 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1378,1376, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 95 TYR HB3 95 TYR HN 3.50  (# 0.0000 548:10 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=1381,1376, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 94 GLU HB2 95 TYR HN 3.00  (# 0.0000 550:10 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1365,1376, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 41 LEU HN 40 LEU HN 3.00  (# 0.9996 551:10 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 560, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 40 LEU HA 40 LEU HN 3.20  (# 0.9379 552:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 562, 560, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 40 LEU HB3 40 LEU HN 3.50  (# 0.9930 555:10 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 560, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 26 LEU HN 25 LYS HN 3.00  (# 0.0000 558:10 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 338, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 24 GLU HN 25 LYS HN 3.20  (# 0.0000 559:10 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 338, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 24 GLU HB3 25 LYS HN 3.20  (# 0.9880 561:10 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 328, 338, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 24 GLU HB2 25 LYS HN 3.80  (# 0.9953 562:10 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 338, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 25 LYS HG2 25 LYS HN 3.20  (# 0.0000 565:10 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 338, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 25 LYS HG3 25 LYS HN 4.00  (# 0.0000 566:10 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 338, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HD2 25 LYS HN 3.50  (# 0.9935 568:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 338, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 66 LEU HA 67 SER HN 2.80  (# 0.0000 569:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 950, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 68 PRO HD2 67 SER HN 3.00  (# 0.9999 572:10 1.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 962, 950, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 68 PRO HD3 67 SER HN 3.00  (# 0.0000 573:10 1.66,)
 &rst
  ixpk= 0, nxpk= 0, iat= 963, 950, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 119 GLU HA 119 GLU HN 3.20  (# 0.0000 575:10 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1726, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 118 GLY HA2 119 GLU HN 4.00  (# 0.0000 577:10 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1721,1726, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 119 GLU HB2 119 GLU HN 4.20  (# 0.0000 579:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1726, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 70 TYR HN 71 GLU HN 3.20  (# 0.9905 581:10 2.79,)
 &rst
  ixpk= 0, nxpk= 0, iat= 995,1016, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 70 TYR QD 71 GLU HN 4.20  (# 0.9991 583:10 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1=1003,1012,
 &end
#
# 70 TYR HB2 71 GLU HN 4.00  (# 0.9906 586:10 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat= 999,1016, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 70 TYR HB3 71 GLU HN 3.50  (# 0.0000 587:10 2.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1000,1016, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 71 GLU HG2 71 GLU HN 3.00  (# 0.0000 588:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1016, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 117 THR HA 118 GLY HN 2.50  (# 0.9995 591:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1707,1719, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 108 GLU HA 108 GLU HN 3.00  (# 0.9948 596:10 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1568, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 108 GLU HB3 108 GLU HN 3.80  (# 0.9931 598:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1573,1568, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 10 SER HB3 10 SER HN 3.50  (# 0.9829 602:10 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 53 ILE HA 54 SER HN 2.40  (# 0.0000 603:10 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 783, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 54 SER HB2 54 SER HN 4.00  (# 0.9457 604:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat= 787, 783, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 85 PHE HA 85 PHE HN 3.20  (# 0.9918 607:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1239,1237, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 85 PHE HB3 85 PHE HN 3.50  (# 0.0000 608:10 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 115 LYS HN 85 PHE HN 3.50  (# 0.9422 610:10 2.83,)
 &rst
  ixpk= 0, nxpk= 0, iat=1666,1237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 84 ARG HA 85 PHE HN 2.60  (# 0.0000 612:10 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1215,1237, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 19 ALA QB 20 GLU HN 3.50  (# 0.9655 618:10 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 256, 257, 258,
 &end
#
# 64 ASP HN 65 ASN HN 3.00  (# 0.0000 623:10 1.74,)
 &rst
  ixpk= 0, nxpk= 0, iat= 905, 917, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 65 ASN HB2 65 ASN HN 4.00  (# 0.0000 624:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 921, 917, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 78 PRO HB2 79 ASP HN 3.20  (# 0.0000 630:10 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=1138,1145, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 78 PRO HB3 79 ASP HN 3.20  (# 0.9992 632:10 1.96,)
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1145, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 46 ALA QB 79 ASP HN 4.50  (# 0.9704 633:10 3.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 662, 663, 664,
 &end
#
# 142 TRP HB2 144 ASN HN 6.20  (# 0.0000 634:10 4.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=2087,2123, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,  &end
#
# 143 VAL HN 144 ASN HN 3.00  (# 0.0000 636:10 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2123, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 143 VAL HA 144 ASN HN 4.00  (# 0.0000 639:10 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,2123, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LYS HN 24 GLU HN 3.20  (# 0.0000 645:10 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 323, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 5 THR HN 4 ILE HN 5.00  (# 0.0000 650:10 4.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  43, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 3 ASP HN 4 ILE HN 2.20  (# 0.9998 651:10 1.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31,  43, r1= 1.30, r2= 1.80, r3= 2.20, r4= 2.70,  &end
#
# 4 ILE HA 4 ILE HN 3.20  (# 0.9445 652:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  45,  43, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 3 ASP HA 4 ILE HN 3.50  (# 0.9911 653:10 3.36,)
 &rst
  ixpk= 0, nxpk= 0, iat=  33,  43, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE HB 4 ILE HN 3.00  (# 0.9859 655:10 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  43, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 33 THR HA 4 ILE HN 2.80  (# 0.0000 659:10 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462,  43, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 3 ASP HB2 4 ILE HN 4.00  (# 0.0000 660:10 3.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=  35,  43, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 55 SER HA 91 GLY HN 4.00  (# 0.0000 664:10 3.24,)
 &rst
  ixpk= 0, nxpk= 0, iat= 796,1319, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 90 ILE HA 91 GLY HN 2.40  (# 0.9987 665:10 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1302,1319, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 91 GLY HA2 91 GLY HN 3.00  (# 0.0000 666:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1321,1319, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 78 PRO HD2 76 GLN HN 5.00  (# 0.9613 670:10 4.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1092, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 78 PRO HD3 76 GLN HN 5.00  (# 0.0000 671:10 4.15,)
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1092, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 75 GLU HG2 76 GLN HN 4.50  (# 0.9957 673:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1084,1092, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 55 SER HA 56 THR HN 2.40  (# 0.0000 676:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 796, 805, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 73 LEU QD1 74 GLN HN 6.00  (# 0.0000 679:10 4.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1050,1051,1052,
 &end
#
# 73 LEU HB3 74 GLN HN 3.00  (# 0.0000 687:10 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,1060, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 141 SER HA 141 SER HN 3.00  (# 0.9927 688:10 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2072, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 110 LYS HN 112 SER HN 4.00  (# 0.9742 689:10 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1638, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 109 LEU HA 112 SER HN 4.00  (# 0.9820 694:10 3.76,)
 &rst
  ixpk= 0, nxpk= 0, iat=1585,1638, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 42 GLU HA 42 GLU HN 3.00  (# 0.0000 701:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 598, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 41 LEU HA 42 GLU HN 3.50  (# 0.9824 702:10 3.18,)
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 42 GLU HB2 42 GLU HN 4.20  (# 0.0000 704:10 3.69,)
 &rst
  ixpk= 0, nxpk= 0, iat= 602, 598, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 91 GLY HA3 92 SER HN 3.50  (# 0.9995 709:10 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1322,1326, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 91 GLY HA2 92 SER HN 3.50  (# 0.9359 710:10 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=1321,1326, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 GLN HN 77 LYS HN 2.40  (# 0.0000 711:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1109, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 75 GLU HN 77 LYS HN 4.00  (# 0.0000 712:10 3.35,)
 &rst
  ixpk= 0, nxpk= 0, iat=1077,1109, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 73 LEU HA 77 LYS HN 4.00  (# 0.0000 715:10 3.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1109, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 83 VAL HN 81 SER HN 4.20  (# 0.9835 720:10 3.79,)
 &rst
  ixpk= 0, nxpk= 0, iat=1197,1176, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 58 GLY HA3 58 GLY HN 3.00  (# 0.0000 728:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 839, 836, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 38 GLY HA2 38 GLY HN 3.00  (# 0.9986 731:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 541, 539, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 38 GLY HA3 38 GLY HN 3.00  (# 0.9985 732:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 542, 539, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 141 SER HA 144 ASN HD21 3.50  (# 0.0000 735:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 121 LEU HN 89 GLY HN 4.00  (# 0.0000 740:10 3.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1755,1293, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 89 GLY HA2 89 GLY HN 2.80  (# 0.0000 741:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1295,1293, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 88 ILE HA 89 GLY HN 2.40  (# 0.9985 742:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1293, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 4 ILE HN 32 THR HN 5.00  (# 0.0000 745:10 4.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43, 446, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 3 ASP HN 32 THR HN 3.80  (# 0.0000 749:10 3.25,)
 &rst
  ixpk= 0, nxpk= 0, iat=  31, 446, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 33 THR HN 32 THR HN 5.00  (# 0.0000 750:10 4.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 460, 446, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 31 PHE HN 32 THR HN 5.00  (# 0.9514 751:10 4.44,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 446, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 32 THR HA 32 THR HN 3.00  (# 0.0000 754:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 446, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 31 PHE HB3 32 THR HN 3.00  (# 0.0000 758:10 2.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 446, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 108 GLU HA 111 ASN HD22 3.80  (# 0.0000 761:10 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1634, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 142 TRP HE3 143 VAL HN 3.20  (# 0.9055 772:10 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=2102,2107, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 144 ASN HN 143 VAL HN 3.20  (# 0.0000 773:10 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=2123,2107, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 142 TRP HA 143 VAL HN 3.80  (# 0.0000 774:10 3.48,)
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2107, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 143 VAL HA 143 VAL HN 3.00  (# 0.0000 775:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,2107, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 142 TRP HB2 143 VAL HN 4.30  (# 0.0000 776:10 2.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2087,2107, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 97 THR HA 97 THR HN 3.20  (# 0.9962 782:10 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=1411,1409, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 97 THR QG2 97 THR HN 4.00  (# 0.0000 783:10 1.99,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1415,1416,1417,
 &end
#
# 12 LEU HA 13 GLY HN 3.00  (# 0.9992 789:10 2.25,)
 &rst
  ixpk= 0, nxpk= 0, iat= 159, 176, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 32 THR HA 33 THR HN 2.60  (# 0.9992 791:10 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 460, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 33 THR HA 33 THR HN 3.20  (# 0.9918 796:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 460, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 50 TRP HE1 47 SER HN 3.50  (# 0.0000 797:10 2.76,)
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 668, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 45 PRO HB3 47 SER HN 5.00  (# 0.9845 802:10 3.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 668, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 120 THR HA 116 GLN HE21 4.00  (# 0.9759 812:10 2.87,)
 &rst
  ixpk= 0, nxpk= 0, iat=1743,1700, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 50 TRP HN 86 GLY HN 4.50  (# 0.0000 816:10 3.89,)
 &rst
  ixpk= 0, nxpk= 0, iat= 705,1257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 85 PHE HA 86 GLY HN 2.60  (# 0.9983 817:10 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=1239,1257, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 112 SER HB2 113 GLY HN 4.50  (# 0.0000 828:10 3.71,)
 &rst
  ixpk= 0, nxpk= 0, iat=1642,1649, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 47 SER HN 48 GLY HN 4.20  (# 0.0000 831:10 3.69,)
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 679, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 83 VAL HB 48 GLY HN 2.50  (# 0.9945 835:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1201, 679, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 83 VAL QG1 48 GLY HN 4.20  (# 0.9975 838:10 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1203,1204,1205,
 &end
#
# 99 CYS HA 100 GLY HN 3.00  (# 0.0000 843:10 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1445,1454, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100 GLY HA3 100 GLY HN 3.00  (# 0.0000 844:10 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1457,1454, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100 GLY HA2 100 GLY HN 3.00  (# 0.0000 845:10 2.29,)
 &rst
  ixpk= 0, nxpk= 0, iat=1456,1454, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 60 GLY HA2 60 GLY HN 3.00  (# 0.9750 847:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 855, 853, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 60 GLY HA3 60 GLY HN 3.00  (# 0.0000 848:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 856, 853, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 139 LEU HN 140 GLY HN 3.10  (# 0.0000 856:10 2.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=2046,2065, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 141 SER HN 140 GLY HN 3.20  (# 0.0000 857:10 2.87,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2065, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 139 LEU HB2 140 GLY HN 3.20  (# 0.0000 860:10 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=2050,2065, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 139 LEU HB3 140 GLY HN 3.20  (# 0.9878 861:10 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=2051,2065, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 88 ILE HA 121 LEU HN 3.20  (# 0.9952 863:10 2.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1755, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 120 THR HN 121 LEU HN 4.80  (# 0.9745 864:10 4.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1755, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 89 GLY HN 121 LEU HN 4.00  (# 0.0000 865:10 3.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1755, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 121 LEU HB3 121 LEU HN 3.00  (# 0.9660 866:10 2.08,)
 &rst
  ixpk= 0, nxpk= 0, iat=1760,1755, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7 ILE HN 6 LEU HN 4.80  (# 0.9212 868:10 4.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  76, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 84 ARG HN 50 TRP HN 4.50  (# 0.9573 873:10 3.90,)
 &rst
  ixpk= 0, nxpk= 0, iat=1213, 705, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 TRP HA 50 TRP HN 3.20  (# 0.0000 874:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 707, 705, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 8 SER HN 36 LEU HN 4.50  (# 0.0000 876:10 3.85,)
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 503, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 113 GLY HA2 80 LEU HN 4.80  (# 0.9890 881:10 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=1651,1157, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 79 ASP HB2 80 LEU HN 5.00  (# 0.0000 882:10 4.33,)
 &rst
  ixpk= 0, nxpk= 0, iat=1149,1157, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 49 ILE HA 84 ARG HN 3.20  (# 0.0000 885:10 2.60,)
 &rst
  ixpk= 0, nxpk= 0, iat= 688,1213, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 51 LEU HB3 52 VAL HN 4.50  (# 0.9885 887:10 3.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 734, 748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 53 ILE HN 52 VAL HN 4.80  (# 0.9725 888:10 4.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 764, 748, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 110 LYS HB3 116 GLN HN 5.00  (# 0.0000 890:10 3.58,)
 &rst
  ixpk= 0, nxpk= 0, iat=1607,1688, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 121 LEU HA 138 TRP HE1 3.50  (# 0.9689 898:10 2.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=1757,2032, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 119 GLU HB3 138 TRP HE1 4.50  (# 0.0000 899:10 2.61,)
 &rst
  ixpk= 0, nxpk= 0, iat=1731,2032, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 119 GLU HG2 138 TRP HE1 2.80  (# 0.0000 900:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1733,2032, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 8 SER HA 53 ILE HN 4.00  (# 0.0000 901:10 3.28,)
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 764, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 59 ALA HA 59 ALA HN 3.20  (# 0.9283 909:10 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 843, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 60 GLY HN 59 ALA HN 2.80  (# 0.9939 910:10 1.88,)
 &rst
  ixpk= 0, nxpk= 0, iat= 853, 843, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 89 GLY HN 122 LYS HN 4.50  (# 0.0000 915:10 3.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5 THR QG2 5 THR HN 3.20  (# 0.9862 922:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=  68,  69,  70,
 &end
#
# 49 ILE HB 5 THR HN 5.00  (# 0.9734 924:10 4.15,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  62, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 4 ILE HN 5 THR HN 5.00  (# 0.9806 926:10 4.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  62, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 51 LEU HN 5 THR HN 4.00  (# 0.0000 927:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat= 729,  62, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 LEU QD1 51 LEU HN 5.00  (# 0.9931 930:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 738, 739, 740,
 &end
#
# 50 TRP HB2 51 LEU HN 4.50  (# 0.0000 933:10 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 VAL HN 51 LEU HN 5.00  (# 0.0000 936:10 4.17,)
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 729, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 120 THR HA 120 THR HN 3.00  (# 0.9985 942:10 2.69,)
 &rst
  ixpk= 0, nxpk= 0, iat=1743,1741, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 46 ALA HA 50 TRP HE1 3.50  (# 0.0000 948:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 660, 715, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 45 PRO HD3 50 TRP HE1 6.00  (# 0.0000 949:10 4.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 646, 715, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 45 PRO HG3 50 TRP HE1 6.50  (# 0.0000 950:10 4.85,)
 &rst
  ixpk= 0, nxpk= 0, iat= 649, 715, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 7 ILE HG12 7 ILE HN 4.00  (# 0.9971 957:10 2.11,)
 &rst
  ixpk= 0, nxpk= 0, iat= 105,  95, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 53 ILE QD1 7 ILE HN 4.00  (# 0.9692 958:10 2.40,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 777, 778, 779,
 &end
#
# 6 LEU HB2 7 ILE HN 4.50  (# 0.9879 960:10 3.31,)
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  95, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6 LEU HN 7 ILE HN 4.80  (# 0.0000 962:10 4.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  95, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 87 ALA HA 87 ALA HN 3.20  (# 0.0000 965:10 2.90,)
 &rst
  ixpk= 0, nxpk= 0, iat=1266,1264, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 116 GLN HE21 87 ALA HN 4.00  (# 0.9913 966:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1700,1264, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 88 ILE HN 87 ALA HN 5.00  (# 0.9099 968:10 4.39,)
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 123 ILE HG12 123 ILE HN 3.80  (# 0.9896 970:10 1.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1796, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 123 ILE HA 123 ILE HN 3.50  (# 0.0000 971:10 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=1798,1796, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 89 GLY HN 123 ILE HN 4.20  (# 0.0000 972:10 3.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1293,1796, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 145 LEU HA 147 LYS HN 4.50  (# 0.0000 975:10 4.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=2139,2175, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 144 ASN HA 147 LYS HN 3.80  (# 0.0000 976:10 3.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=2125,2175, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 145 LEU HN 147 LYS HN 4.00  (# 0.0000 977:10 3.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2175, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 81 SER HN 82 ALA HN 2.80  (# 0.9824 978:10 2.42,)
 &rst
  ixpk= 0, nxpk= 0, iat=1176,1187, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 80 LEU HB3 82 ALA HN 5.00  (# 0.0000 979:10 3.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1162,1187, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 98 PHE HB3 98 PHE HN 3.80  (# 0.0000 981:10 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat=1428,1423, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 98 PHE HB2 98 PHE HN 3.80  (# 0.9950 982:10 2.55,)
 &rst
  ixpk= 0, nxpk= 0, iat=1427,1423, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 41 LEU HA 41 LEU HN 2.80  (# 0.9996 985:10 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 579, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 40 LEU HN 41 LEU HN 2.80  (# 0.0000 989:10 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 579, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 25 LYS HB3 26 LEU HN 3.50  (# 0.9916 992:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 360, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 27 GLU HG2 26 LEU HN 6.20  (# 0.0000 993:10 5.19,)
 &rst
  ixpk= 0, nxpk= 0, iat= 386, 360, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,  &end
#
# 28 GLU HN 26 LEU HN 4.50  (# 0.0000 994:10 4.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 360, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25 LYS HG2 26 LEU HN 5.00  (# 0.0000 996:10 3.84,)
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 360, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 131 PRO HG3 132 GLU HN 3.50  (# 0.9227 998:10 1.79,)
 &rst
  ixpk= 0, nxpk= 0, iat=1932,1941, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 131 PRO HB3 132 GLU HN 4.00  (# 0.0000 999:10 2.71,)
 &rst
  ixpk= 0, nxpk= 0, iat=1935,1941, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 80 LEU HB2 83 VAL HN 5.00  (# 0.0000 1004:10 2.64,)
 &rst
  ixpk= 0, nxpk= 0, iat=1161,1197, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 80 LEU HG 114 ALA HN 4.50  (# 0.9799 1006:10 3.34,)
 &rst
  ixpk= 0, nxpk= 0, iat=1164,1656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 113 GLY HA3 114 ALA HN 3.80  (# 0.0000 1007:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat=1652,1656, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 112 SER HB2 114 ALA HN 5.00  (# 0.9861 1009:10 3.90,)
 &rst
  ixpk= 0, nxpk= 0, iat=1642,1656, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 110 LYS HA 114 ALA HN 4.20  (# 0.9037 1010:10 3.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=1604,1656, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 22 LEU HB2 23 ALA HN 3.10  (# 0.9951 1018:10 2.38,)
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 313, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 68 PRO HB2 69 PHE HN 4.00  (# 0.9641 1025:10 2.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 968, 975, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 68 PRO HD3 69 PHE HN 3.80  (# 0.0000 1026:10 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat= 963, 975, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 71 GLU HN 69 PHE HN 4.50  (# 0.0000 1028:10 3.71,)
 &rst
  ixpk= 0, nxpk= 0, iat=1016, 975, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 108 GLU HA 109 LEU HN 3.80  (# 0.9929 1031:10 3.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1583, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 41 LEU QD2 72 ALA HN 5.50  (# 0.0000 1034:10 3.53,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 592, 593, 594,
 &end
#
# 73 LEU HB3 72 ALA HN 7.00  (# 0.0000 1035:10 4.66,)
 &rst
  ixpk= 0, nxpk= 0, iat=1046,1031, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 68 PRO HA 72 ALA HN 4.00  (# 0.9953 1038:10 3.40,)
 &rst
  ixpk= 0, nxpk= 0, iat= 971,1031, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 109 LEU HB2 111 ASN HN 5.60  (# 0.0000 1044:10 4.83,)
 &rst
  ixpk= 0, nxpk= 0, iat=1587,1624, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 107 ALA HA 111 ASN HN 4.50  (# 0.9834 1045:10 3.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1560,1624, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 111 ASN HD22 111 ASN HN 5.00  (# 0.0000 1048:10 3.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=1634,1624, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 24 GLU HA 27 GLU HN 4.00  (# 0.9926 1054:10 3.55,)
 &rst
  ixpk= 0, nxpk= 0, iat= 325, 379, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 139 LEU HB2 139 LEU HN 3.20  (# 0.9997 1057:10 2.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=2050,2046, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 139 LEU QD1 139 LEU HN 4.20  (# 0.0000 1058:10 1.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=2055,2056,2057,
 &end
#
# 139 LEU QD2 139 LEU HN 4.20  (# 0.9557 1059:10 1.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=2059,2060,2061,
 &end
#
# 121 LEU HG 139 LEU HN 5.00  (# 0.9424 1061:10 4.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=1762,2046, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 4 ILE HG12 49 ILE HN 4.50  (# 0.9585 1068:10 2.86,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 686, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5 THR HN 49 ILE HN 4.50  (# 0.0000 1071:10 4.05,)
 &rst
  ixpk= 0, nxpk= 0, iat=  62, 686, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 34 GLU HG2 34 GLU HN 4.50  (# 0.0000 1074:10 3.48,)
 &rst
  ixpk= 0, nxpk= 0, iat= 481, 474, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18 VAL QG1 19 ALA HN 4.50  (# 0.9881 1080:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 242, 243, 244,
 &end
#
# 19 ALA HA 19 ALA HN 3.00  (# 0.9903 1081:10 2.80,)
 &rst
  ixpk= 0, nxpk= 0, iat= 254, 252, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 94 GLU HA 94 GLU HN 3.00  (# 0.0000 1084:10 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1361, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 95 TYR HN 94 GLU HN 3.00  (# 0.0000 1085:10 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat=1376,1361, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 36 LEU QD1 44 LEU HN 6.50  (# 0.0000 1087:10 4.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 512, 513, 514,
 &end
#
# 43 ASP HA 44 LEU HN 3.80  (# 0.9901 1092:10 3.44,)
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 625, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 104 LYS HA 104 LYS HN 3.00  (# 0.9958 1097:10 2.72,)
 &rst
  ixpk= 0, nxpk= 0, iat=1504,1502, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 17 TYR HB3 18 VAL HN 3.50  (# 0.0000 1103:10 2.57,)
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 236, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 ILE QD1 31 PHE HN 6.20  (# 0.0000 1105:10 5.14,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,
 igr1=  56,  57,  58,
 &end
#
# 30 GLY HA3 31 PHE HN 3.50  (# 0.9867 1109:10 3.10,)
 &rst
  ixpk= 0, nxpk= 0, iat= 422, 426, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 THR HN 31 PHE HN 5.00  (# 0.0000 1110:10 4.44,)
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 426, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 115 LYS HG3 115 LYS HN 3.00  (# 0.0000 1114:10 2.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=1674,1666, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 85 PHE HN 115 LYS HN 3.80  (# 0.9026 1116:10 2.83,)
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1666, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 105 LEU HA 105 LEU HN 3.00  (# 0.9423 1117:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat=1526,1524, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 105 LEU HB3 105 LEU HN 3.00  (# 0.0000 1119:10 2.20,)
 &rst
  ixpk= 0, nxpk= 0, iat=1529,1524, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 104 LYS HB2 105 LEU HN 3.50  (# 0.9990 1120:10 2.47,)
 &rst
  ixpk= 0, nxpk= 0, iat=1506,1524, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 88 ILE HG12 88 ILE HN 3.80  (# 0.9700 1123:10 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1274, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 70 TYR HB3 70 TYR HN 3.00  (# 0.0000 1135:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=1000, 995, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 69 PHE HB2 70 TYR HN 3.00  (# 0.9995 1136:10 1.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 979, 995, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 70 TYR HA 70 TYR HN 3.00  (# 0.9806 1137:10 2.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 997, 995, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 36 LEU HB3 8 SER HN 5.20  (# 0.9319 1140:10 3.68,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 114, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 36 LEU HN 8 SER HN 4.20  (# 0.9498 1142:10 3.85,)
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 114, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 60 GLY HA3 61 ASP HN 3.00  (# 0.0000 1144:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 856, 860, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 60 GLY HA2 61 ASP HN 3.00  (# 0.9519 1145:10 2.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 855, 860, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 111 ASN HN 110 LYS HN 2.60  (# 0.0000 1147:10 2.21,)
 &rst
  ixpk= 0, nxpk= 0, iat=1624,1602, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 107 ALA HA 110 LYS HN 4.00  (# 0.9859 1151:10 3.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=1560,1602, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 17 TYR HB3 17 TYR HN 3.00  (# 0.9994 1165:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 215, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 105 LEU QD1 107 ALA HN 6.30  (# 0.0000 1166:10 4.70,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1533,1534,1535,
 &end
#
# 105 LEU HB3 107 ALA HN 5.20  (# 0.9640 1167:10 4.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=1529,1558, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 106 GLU HA 107 ALA HN 3.80  (# 0.9789 1170:10 3.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1558, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 105 LEU QD2 106 GLU HN 4.50  (# 0.0000 1174:10 2.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1537,1538,1539,
 &end
#
# 106 GLU HG2 106 GLU HN 3.50  (# 0.0000 1177:10 2.41,)
 &rst
  ixpk= 0, nxpk= 0, iat=1550,1543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 LEU QD2 73 LEU HN 5.00  (# 0.9800 1181:10 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 592, 593, 594,
 &end
#
# 74 GLN HN 73 LEU HN 3.00  (# 0.0000 1184:10 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=1060,1041, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21 HIS HB3 22 LEU HN 3.20  (# 0.0000 1186:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 294, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 145 LEU HB3 145 LEU HN 3.80  (# 0.9904 1188:10 2.06,)
 &rst
  ixpk= 0, nxpk= 0, iat=2142,2137, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 143 VAL HA 145 LEU HN 4.50  (# 0.0000 1192:10 3.85,)
 &rst
  ixpk= 0, nxpk= 0, iat=2109,2137, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 142 TRP HA 145 LEU HN 4.00  (# 0.0000 1193:10 3.28,)
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2137, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 143 VAL HN 145 LEU HN 4.00  (# 0.0000 1195:10 3.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=2107,2137, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 19 ALA HA 22 LEU HN 4.00  (# 0.9725 1196:10 3.73,)
 &rst
  ixpk= 0, nxpk= 0, iat= 254, 294, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 36 LEU QD1 40 LEU HN 6.20  (# 0.0000 1200:10 3.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,
 igr1= 512, 513, 514,
 &end
#
# 36 LEU HB3 40 LEU HN 5.50  (# 0.0000 1202:10 4.47,)
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 560, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 25 LYS HA 25 LYS HN 3.00  (# 0.9970 1208:10 2.75,)
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 338, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27 GLU HN 25 LYS HN 4.80  (# 0.0000 1209:10 4.02,)
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 338, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 68 PRO HG3 67 SER HN 4.60  (# 0.9862 1213:10 3.61,)
 &rst
  ixpk= 0, nxpk= 0, iat= 966, 950, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 69 PHE HN 67 SER HN 3.80  (# 0.0000 1216:10 2.82,)
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 950, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 142 TRP HD1 119 GLU HN 5.50  (# 0.0000 1219:10 4.68,)
 &rst
  ixpk= 0, nxpk= 0, iat=2091,1726, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 72 ALA QB 71 GLU HN 6.00  (# 0.0000 1223:10 4.78,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1035,1036,1037,
 &end
#
# 71 GLU HG3 71 GLU HN 3.00  (# 0.9996 1224:10 2.17,)
 &rst
  ixpk= 0, nxpk= 0, iat=1024,1016, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 117 THR HB 118 GLY HN 4.50  (# 0.0000 1229:10 3.65,)
 &rst
  ixpk= 0, nxpk= 0, iat=1709,1719, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 142 TRP HD1 118 GLY HN 5.00  (# 0.0000 1232:10 3.95,)
 &rst
  ixpk= 0, nxpk= 0, iat=2091,1719, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 110 LYS HN 108 GLU HN 4.50  (# 0.0000 1239:10 4.02,)
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1568, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 106 GLU HN 108 GLU HN 5.00  (# 0.0000 1240:10 4.58,)
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1568, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 10 SER HA 10 SER HN 3.00  (# 0.0000 1241:10 2.28,)
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 132, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 90 ILE HG12 54 SER HN 3.50  (# 0.9862 1245:10 2.18,)
 &rst
  ixpk= 0, nxpk= 0, iat=1310, 783, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 53 ILE HB 54 SER HN 4.50  (# 0.0000 1246:10 4.14,)
 &rst
  ixpk= 0, nxpk= 0, iat= 768, 783, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 54 SER HA 54 SER HN 3.20  (# 0.0000 1248:10 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat= 785, 783, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 88 ILE HN 54 SER HN 4.00  (# 0.9669 1249:10 3.56,)
 &rst
  ixpk= 0, nxpk= 0, iat=1274, 783, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 53 ILE HN 54 SER HN 4.50  (# 0.0000 1250:10 4.05,)
 &rst
  ixpk= 0, nxpk= 0, iat= 764, 783, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 114 ALA QB 85 PHE HN 4.50  (# 0.0000 1253:10 2.52,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1660,1661,1662,
 &end
#
# 115 LYS HG2 85 PHE HN 5.00  (# 0.9281 1254:10 3.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=1673,1237, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 20 GLU HA 20 GLU HN 3.00  (# 0.9955 1256:10 2.74,)
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 262, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 35 THR QG2 20 GLU HN 4.50  (# 0.9652 1257:10 3.01,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 495, 496, 497,
 &end
#
# 16 GLU HB3 20 GLU HN 4.50  (# 0.9382 1260:10 2.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 205, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 75 GLU HA 75 GLU HN 3.20  (# 0.9621 1261:10 2.88,)
 &rst
  ixpk= 0, nxpk= 0, iat=1079,1077, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 72 ALA HA 75 GLU HN 3.50  (# 0.9925 1262:10 3.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1077, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 66 LEU HN 65 ASN HN 4.00  (# 0.9902 1265:10 2.64,)
 &rst
  ixpk= 0, nxpk= 0, iat= 931, 917, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 65 ASN HA 65 ASN HN 3.00  (# 0.0000 1266:10 2.27,)
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 917, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 64 ASP HA 65 ASN HN 3.70  (# 0.9953 1267:10 2.68,)
 &rst
  ixpk= 0, nxpk= 0, iat= 907, 917, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 143 VAL HB 144 ASN HN 2.80  (# 0.0000 1272:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2123, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 141 SER HA 144 ASN HN 4.00  (# 0.0000 1273:10 3.37,)
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2123, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 35 THR QG2 24 GLU HN 6.20  (# 0.9732 1276:10 4.11,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,
 igr1= 495, 496, 497,
 &end
#
# 25 LYS HB2 24 GLU HN 6.00  (# 0.0000 1277:10 4.90,)
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 323, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 22 LEU HB3 24 GLU HN 5.50  (# 0.0000 1278:10 4.93,)
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 21 HIS HA 24 GLU HN 4.00  (# 0.0000 1281:10 3.58,)
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 323, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 23 ALA HN 24 GLU HN 3.00  (# 0.0000 1283:10 2.77,)
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 323, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4 ILE HG12 4 ILE HN 4.00  (# 0.9791 1284:10 3.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  43, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 33 THR HB 4 ILE HN 4.50  (# 0.0000 1285:10 4.17,)
 &rst
  ixpk= 0, nxpk= 0, iat= 464,  43, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 34 GLU HN 4 ILE HN 4.20  (# 0.9871 1287:10 3.70,)
 &rst
  ixpk= 0, nxpk= 0, iat= 474,  43, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 91 GLY HA3 91 GLY HN 3.00  (# 0.9992 1289:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1322,1319, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 90 ILE HB 91 GLY HN 4.50  (# 0.0000 1291:10 2.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=1304,1319, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LYS HN 76 GLN HN 2.40  (# 0.0000 1292:10 2.07,)
 &rst
  ixpk= 0, nxpk= 0, iat=1109,1092, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 77 LYS HG3 76 GLN HN 4.50  (# 0.0000 1296:10 3.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1117,1092, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 56 THR QG2 56 THR HN 4.00  (# 0.0000 1297:10 2.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 811, 812, 813,
 &end
#
# 56 THR HA 56 THR HN 3.20  (# 0.0000 1298:10 2.91,)
 &rst
  ixpk= 0, nxpk= 0, iat= 807, 805, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 73 LEU HA 74 GLN HN 3.80  (# 0.0000 1304:10 3.54,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1060, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 44 LEU HN 42 GLU HN 5.50  (# 0.0000 1314:10 5.00,)
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 598, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 40 LEU HN 42 GLU HN 3.50  (# 0.0000 1315:10 3.09,)
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 92 SER HB2 92 SER HN 3.50  (# 0.0000 1316:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1330,1326, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 58 GLY HA2 58 GLY HN 3.00  (# 0.0000 1324:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 836, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 141 SER HA 144 ASN HD22 3.50  (# 0.0000 1333:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 89 GLY HA3 89 GLY HN 3.00  (# 0.9995 1343:10 2.30,)
 &rst
  ixpk= 0, nxpk= 0, iat=1296,1293, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 122 LYS HA 89 GLY HN 3.00  (# 0.9929 1344:10 2.19,)
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1293, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 123 ILE HN 89 GLY HN 4.00  (# 0.9670 1345:10 3.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1796,1293, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 131 PRO HG2 124 ASN HD21 4.00  (# 0.0000 1348:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=1931,1824, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 4 ILE QD1 32 THR HN 6.20  (# 0.0000 1350:10 4.98,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,
 igr1=  56,  57,  58,
 &end
#
# 108 GLU HA 111 ASN HD21 3.00  (# 0.0000 1354:10 1.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=1570,1633, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 141 SER HN 143 VAL HN 4.50  (# 0.0000 1363:10 3.91,)
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2107, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 145 LEU HN 143 VAL HN 4.50  (# 0.9941 1364:10 3.67,)
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2107, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 ASP HA 97 THR HN 3.00  (# 0.0000 1367:10 2.22,)
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1409, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 96 ASP HN 97 THR HN 3.50  (# 0.0000 1370:10 1.85,)
 &rst
  ixpk= 0, nxpk= 0, iat=1397,1409, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 13 GLY HA2 13 GLY HN 3.00  (# 0.0000 1372:10 2.35,)
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 176, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12 LEU HB2 13 GLY HN 4.50  (# 0.0000 1373:10 3.00,)
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 176, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 32 THR HN 33 THR HN 5.00  (# 0.0000 1379:10 4.53,)
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 460, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 56 THR HA 65 ASN HD22 3.80  (# 0.9705 1385:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 807, 927, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 120 THR HA 116 GLN HE22 4.00  (# 0.9173 1386:10 2.87,)
 &rst
  ixpk= 0, nxpk= 0, iat=1743,1701, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 120 THR HN 116 GLN HE22 4.00  (# 0.9838 1392:10 3.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1701, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 120 THR HN 116 GLN HE21 5.00  (# 0.9838 1393:10 3.38,)
 &rst
  ixpk= 0, nxpk= 0, iat=1741,1700, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 60 GLY HA2 65 ASN HD21 4.00  (# 0.9534 1395:10 1.95,)
 &rst
  ixpk= 0, nxpk= 0, iat= 855, 926, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 52 VAL HN 86 GLY HN 4.00  (# 0.0000 1396:10 3.26,)
 &rst
  ixpk= 0, nxpk= 0, iat= 748,1257, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 86 GLY HA2 86 GLY HN 3.00  (# 0.9976 1398:10 2.49,)
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1257, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 111 ASN HB2 113 GLY HN 6.00  (# 0.9262 1401:10 5.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=1628,1649, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 80 LEU QD1 113 GLY HN 6.50  (# 0.9839 1404:10 3.57,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1166,1167,1168,
 &end
#
# 80 LEU HB3 113 GLY HN 5.50  (# 0.9820 1405:10 3.50,)
 &rst
  ixpk= 0, nxpk= 0, iat=1162,1649, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 59 ALA QB 60 GLY HN 4.50  (# 0.0000 1413:10 2.03,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 847, 848, 849,
 &end
#
# 31 PHE HN 30 GLY HN 2.20  (# 0.0000 1415:10 1.89,)
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 419, r1= 1.30, r2= 1.80, r3= 2.20, r4= 2.70,  &end
#
# 142 TRP HN 140 GLY HN 5.00  (# 0.0000 1419:10 4.27,)
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2065, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 137 GLU HA 140 GLY HN 4.00  (# 0.9707 1420:10 3.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=2009,2065, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 139 LEU QD1 140 GLY HN 5.50  (# 0.0000 1423:10 3.66,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2055,2056,2057,
 &end
#
# 33 THR HA 3 ASP HN 3.80  (# 0.0000 1425:10 3.03,)
 &rst
  ixpk= 0, nxpk= 0, iat= 462,  31, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 4 ILE HB 3 ASP HN 4.50  (# 0.0000 1428:10 4.09,)
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  31, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5 THR HB 6 LEU HN 4.50  (# 0.9842 1429:10 3.92,)
 &rst
  ixpk= 0, nxpk= 0, iat=  66,  76, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8 SER HA 8 SER HN 3.20  (# 0.0000 1430:10 2.94,)
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 114, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 26 LEU QD1 26 LEU HN 4.00  (# 0.9900 1432:10 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 369, 370, 371,
 &end
#
# 34 GLU HG3 34 GLU HN 4.50  (# 0.9657 1434:10 3.48,)
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 474, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 49 ILE HB 50 TRP HN 4.20  (# 0.0000 1436:10 3.36,)
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 705, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 5 THR QG2 51 LEU HN 3.80  (# 0.9868 1438:10 2.26,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=  68,  69,  70,
 &end
#
# 51 LEU HB2 52 VAL HN 4.20  (# 0.0000 1440:10 3.30,)
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 748, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 90 ILE QG2 56 THR HN 4.80  (# 0.9904 1443:10 1.94,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=1306,1307,1308,
 &end
#
# 90 ILE HB 56 THR HN 5.50  (# 0.0000 1444:10 3.81,)
 &rst
  ixpk= 0, nxpk= 0, iat=1304, 805, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 91 GLY HA2 57 HIS HN 4.50  (# 0.9167 1447:10 2.00,)
 &rst
  ixpk= 0, nxpk= 0, iat=1321, 819, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 56 THR QG2 57 HIS HN 5.00  (# 0.0000 1449:10 2.23,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 811, 812, 813,
 &end
#
# 68 PRO HD2 69 PHE HN 3.50  (# 0.9980 1452:10 2.67,)
 &rst
  ixpk= 0, nxpk= 0, iat= 962, 975, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 LEU HA 76 GLN HN 4.00  (# 0.0000 1455:10 3.69,)
 &rst
  ixpk= 0, nxpk= 0, iat=1043,1092, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 77 LYS HD2 77 LYS HN 5.50  (# 0.0000 1458:10 4.12,)
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1109, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 84 ARG HD2 84 ARG HN 5.00  (# 0.9483 1459:10 3.13,)
 &rst
  ixpk= 0, nxpk= 0, iat=1223,1213, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 92 SER HB3 92 SER HN 3.50  (# 0.9871 1460:10 2.16,)
 &rst
  ixpk= 0, nxpk= 0, iat=1331,1326, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 97 THR HB 97 THR HN 4.00  (# 0.0000 1461:10 3.43,)
 &rst
  ixpk= 0, nxpk= 0, iat=1413,1409, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 105 LEU QD2 105 LEU HN 5.50  (# 0.0000 1462:10 4.04,)
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1524, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1537,1538,1539,
 &end
#
#  120 THR  HA          121 LEU  HN          2.80    (#      1:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1, nxpk= 10, iat=1743,1755, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#  121 LEU  MDY         121 LEU  HN          5.50    (#      2:10  Unique         3.26, 5.07 A)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#    0 AMB  10-2:3      121 LEU  HN          2.80    (#      3:10  Single Ambig)
 &rst
  ixpk= 3, nxpk= 10, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1759,1760,1747,1748,1749,
 &end
#
#    0 AMB  10-2:4      121 LEU  HN          5.50    (#      4:10  Single Ambig)
 &rst
  ixpk= 4, nxpk= 10, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1284,1285,1313,1314,1315,
 &end
#
#    0 AMB  10-2:6        6 LEU  HN          4.50    (#      6:10  Single Ambig)
 &rst
  ixpk= 6, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 503,  62,
 &end
#
#   34 GLU  HN            6 LEU  HN          4.50    (#      7:10  Unique         3.58, 3.61 A)
 &rst
  ixpk= 7, nxpk= 10, iat= 474,  76, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 LEU  HA            6 LEU  HN          4.50    (#      8:10  Unique         2.95, 2.95 A)
 &rst
  ixpk= 8, nxpk= 10, iat=  78,  76, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 THR  HA            6 LEU  HN          2.80    (#      9:10  Unique         2.20, 2.21 A)
 &rst
  ixpk= 9, nxpk= 10, iat=  64,  76, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LEU  HB+           6 LEU  HN          3.50    (#     10:10  Unique         2.37, 2.93 A)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  80,  81,
 &end
#
#    0 AMB  10-2:11       6 LEU  HN          3.50    (#     11:10  Single Ambig)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  80,  81, 510,
 &end
#
#    6 LEU  MDY           6 LEU  HN          2.80    (#     12:10  Unique         2.94, 4.67 A)
 &rst
  ixpk= 12, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=  85,  86,  87,  89,  90,  91,
 &end
#
#   36 LEU  MDX           6 LEU  HN          4.50    (#     13:10  Unique         2.24, 3.85 A)
 &rst
  ixpk= 13, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#   51 LEU  HN           50 TRP  HN          4.50    (#     14:10  Unique         4.24, 4.28 A)
 &rst
  ixpk= 14, nxpk= 10, iat= 729, 705, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:15      50 TRP  HN          3.50    (#     15:10  Single Ambig)
 &rst
  ixpk= 15, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 713,1239,
 &end
#
#   49 ILE  HA           50 TRP  HN          2.80    (#     16:10  Unique         2.14, 2.14 A)
 &rst
  ixpk= 16, nxpk= 10, iat= 688, 705, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:17      50 TRP  HN          5.50    (#     17:10  Single Ambig)
 &rst
  ixpk= 17, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1241,1242,1259,1260,
 &end
#
#   50 TRP  HB+          50 TRP  HN          3.50    (#     18:10  Unique         2.27, 2.97 A)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 709, 710,
 &end
#
#   50 TRP  HB-          50 TRP  HN          4.50    (#     19:10  Unique         2.27, 2.97 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 709, 710,
 &end
#
#   85 PHE  HB-          50 TRP  HN          7.00    (#     20:10  Unique         4.87, 5.70 A)
 &rst
  ixpk= 20, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1241,1242,
 &end
#
#    0 AMB  10-2:21      50 TRP  HN          5.50    (#     21:10  Single Ambig)
 &rst
  ixpk= 21, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1201,1217,1218, 696, 697,
 &end
#
#   49 ILE  MG2          50 TRP  HN          3.50    (#     22:10  Unique         2.64, 3.71 A)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 692, 693, 694,
 &end
#
#    0 AMB  10-2:23      50 TRP  HN          4.50    (#     23:10  Single Ambig)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 699, 700, 701,  68,  69,  70, 696, 697,
 &end
#
#    7 ILE  HA           36 LEU  HN          7.00    (#     24:10  Unique         4.43, 4.56 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  97, 503, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:25      36 LEU  HN          5.50    (#     25:10  Single Ambig)
 &rst
  ixpk= 25, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,
 &end
#
#   35 THR  HN           36 LEU  HN          5.50    (#     26:10  Unique         4.57, 4.57 A)
 &rst
  ixpk= 26, nxpk= 10, iat= 489, 503, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 THR  HA           36 LEU  HN          2.80    (#     27:10  Unique         2.17, 2.17 A)
 &rst
  ixpk= 27, nxpk= 10, iat= 491, 503, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   36 LEU  HA           36 LEU  HN          3.50    (#     28:10  Unique         2.90, 2.90 A)
 &rst
  ixpk= 28, nxpk= 10, iat= 505, 503, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    6 LEU  HB+          36 LEU  HN          3.50    (#     29:10  Unique         2.57, 2.96 A)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  80,  81,
 &end
#
#   36 LEU  HB+          36 LEU  HN          3.50    (#     30:10  Unique         3.35, 3.65 A)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 507, 508,
 &end
#
#    0 AMB  10-2:31      36 LEU  HN          3.50    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 510,  80,  81,
 &end
#
#   36 LEU  HB-          36 LEU  HN          4.50    (#     32:10  Unique         3.35, 3.65 A)
 &rst
  ixpk= 32, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 507, 508,
 &end
#
#   36 LEU  MDY          36 LEU  HN          4.50    (#     33:10  Unique         3.71, 4.52 A)
 &rst
  ixpk= 33, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#   81 SER  HN           80 LEU  HN          3.50    (#     34:10  Unique         2.75, 3.11 A)
 &rst
  ixpk= 34, nxpk= 10, iat=1176,1157, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 ASP  HA           80 LEU  HN          2.80    (#     35:10  Unique         2.17, 2.18 A)
 &rst
  ixpk= 35, nxpk= 10, iat=1147,1157, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   80 LEU  HA           80 LEU  HN          3.50    (#     36:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 36, nxpk= 10, iat=1159,1157, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  112 SER  HB+          80 LEU  HN          4.50    (#     37:10  Unique         3.72, 4.62 A)
 &rst
  ixpk= 37, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1642,1643,
 &end
#
#    0 AMB  10-2:38      80 LEU  HN          4.50    (#     38:10  Single Ambig)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1642,1643,1180,1181,
 &end
#
#   80 LEU  HG           80 LEU  HN          4.50    (#     39:10  Unique         4.03, 4.14 A)
 &rst
  ixpk= 39, nxpk= 10, iat=1164,1157, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  HB-          80 LEU  HN          3.50    (#     40:10  Unique         2.47, 3.09 A)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1161,1162,
 &end
#
#    0 AMB  10-2:41      80 LEU  HN          3.50    (#     41:10  Single Ambig)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
      1171,1172,
 &end
#
#   79 ASP  HB-          80 LEU  HN          5.50    (#     42:10  Unique         4.28, 4.44 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1149,1150,
 &end
#
#    0 AMB  10-2:43      84 ARG  HN          4.50    (#     43:10  Single Ambig)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 679,1197, 686,
 &end
#
#   85 PHE  HN           84 ARG  HN          5.50    (#     44:10  Unique         4.53, 4.55 A)
 &rst
  ixpk= 44, nxpk= 10, iat=1237,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 ARG  HA           84 ARG  HN          4.50    (#     45:10  Unique         2.91, 2.92 A)
 &rst
  ixpk= 45, nxpk= 10, iat=1215,1213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:46      84 ARG  HN          2.80    (#     46:10  Single Ambig)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1220,1221,1220,1221,
 &end
#
#   49 ILE  MD1          84 ARG  HN          5.50    (#     47:10  Unique         2.94, 4.33 A)
 &rst
  ixpk= 47, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 699, 700, 701,
 &end
#
#   83 VAL  MGX          84 ARG  HN          4.50    (#     48:10  Unique         1.86, 3.82 A)
 &rst
  ixpk= 48, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   83 VAL  HA           84 ARG  HN          2.80    (#     49:10  Unique         2.22, 2.24 A)
 &rst
  ixpk= 49, nxpk= 10, iat=1199,1213, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   84 ARG  HB+          84 ARG  HN          4.50    (#     50:10  Unique         2.42, 3.18 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1217,1218,
 &end
#
#   86 GLY  HN           52 VAL  HN          3.50    (#     51:10  Unique         3.36, 3.50 A)
 &rst
  ixpk= 51, nxpk= 10, iat=1257, 748, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 LEU  HA           52 VAL  HN          2.80    (#     52:10  Unique         2.14, 2.14 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 731, 748, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   52 VAL  HB           52 VAL  HN          3.50    (#     53:10  Unique         3.07, 3.19 A)
 &rst
  ixpk= 53, nxpk= 10, iat= 752, 748, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 VAL  MGX          52 VAL  HN          2.80    (#     54:10  Unique         2.29, 3.76 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#   52 VAL  MGY          52 VAL  HN          4.50    (#     55:10  Unique         2.29, 3.76 A)
 &rst
  ixpk= 55, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#   87 ALA  HA           52 VAL  HN          4.50    (#     56:10  Unique         3.21, 3.49 A)
 &rst
  ixpk= 56, nxpk= 10, iat=1266, 748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 VAL  HA           52 VAL  HN          4.50    (#     57:10  Unique         2.95, 2.95 A)
 &rst
  ixpk= 57, nxpk= 10, iat= 750, 748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:58      52 VAL  HN          4.50    (#     58:10  Single Ambig)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 774, 775,  99,1268,1269,1270,
 &end
#
#    0 AMB  10-2:59      52 VAL  HN          5.50    (#     59:10  Single Ambig)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1=1284,1285, 738, 739, 740, 742, 743, 744, 777, 778,
       779,
 &end
#
#    0 AMB  10-2:60      52 VAL  HN          3.50    (#     60:10  Single Ambig)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 738, 739, 740, 742, 743, 744, 105, 106,
 &end
#
#    0 AMB  10-2:61     116 GLN  HN          5.50    (#     61:10  Single Ambig)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1666,1602,
 &end
#
#  115 LYS  HA          116 GLN  HN          2.80    (#     64:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 64, nxpk= 10, iat=1668,1688, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:65     116 GLN  HN          3.50    (#     65:10  Single Ambig)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1690,1241,1242,
 &end
#
#    0 AMB  10-2:66     116 GLN  HN          4.50    (#     66:10  Single Ambig)
 &rst
  ixpk= 66, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1615,1616,1615,1616,
 &end
#
#    0 AMB  10-2:67     116 GLN  HN          5.50    (#     67:10  Single Ambig)
 &rst
  ixpk= 67, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1695,1696,1344,1345,
 &end
#
#    0 AMB  10-2:68     116 GLN  HN          2.80    (#     68:10  Single Ambig)
 &rst
  ixpk= 68, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1692,1693,1609,1610,1670,1671,
 &end
#
#  116 GLN  HB-         116 GLN  HN          2.80    (#     69:10  Unique         2.35, 2.53 A)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1692,1693,
 &end
#
#    0 AMB  10-2:71     138 TRP  HE1         4.50    (#     71:10  Single Ambig)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1747,1748,1749,1759,1760,
 &end
#
#   53 ILE  HA           53 ILE  HN          5.50    (#     73:10  Unique         2.94, 2.95 A)
 &rst
  ixpk= 73, nxpk= 10, iat= 766, 764, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 VAL  MGX          53 ILE  HN          4.50    (#     74:10  Unique         2.05, 3.93 A)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#   52 VAL  HA           53 ILE  HN          2.80    (#     75:10  Unique         2.20, 2.22 A)
 &rst
  ixpk= 75, nxpk= 10, iat= 750, 764, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   53 ILE  HB           53 ILE  HN          3.50    (#     76:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 76, nxpk= 10, iat= 768, 764, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:77      53 ILE  HN          3.50    (#     77:10  Single Ambig)
 &rst
  ixpk= 77, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  99, 774, 775,
 &end
#
#  141 SER  HN          142 TRP  HN          3.50    (#     78:10  Unique         2.92, 2.95 A)
 &rst
  ixpk= 78, nxpk= 10, iat=2072,2083, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  141 SER  HB-         142 TRP  HN          3.50    (#     79:10  Unique         2.21, 2.96 A)
 &rst
  ixpk= 79, nxpk= 10, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2076,2077,
 &end
#
#  142 TRP  HA          142 TRP  HN          3.50    (#     80:10  Unique         2.73, 2.75 A)
 &rst
  ixpk= 80, nxpk= 10, iat=2085,2083, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  142 TRP  HB+         142 TRP  HN          3.50    (#     81:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2087,2088,
 &end
#
#  142 TRP  HB-         142 TRP  HN          2.80    (#     82:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 82, nxpk= 10, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2087,2088,
 &end
#
#  141 SER  HA          142 TRP  HN          5.50    (#     83:10  Unique         3.56, 3.57 A)
 &rst
  ixpk= 83, nxpk= 10, iat=2074,2083, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 GLY  HA-          59 ALA  HN          3.50    (#     85:10  Unique         2.28, 3.04 A)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 838, 839,
 &end
#
#   59 ALA  MB           59 ALA  HN          2.80    (#     86:10  Unique         2.22, 3.35 A)
 &rst
  ixpk= 86, nxpk= 10, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 847, 848, 849,
 &end
#
#    0 AMB  10-2:87     117 THR  HN          5.50    (#     87:10  Single Ambig)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1700,1701,1350,
 &end
#
#   86 GLY  HA+         117 THR  HN          7.00    (#     89:10  Unique         3.22, 4.01 A)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1259,1260,
 &end
#
#  117 THR  HA          117 THR  HN          3.50    (#     90:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 90, nxpk= 10, iat=1707,1705, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  117 THR  HB          117 THR  HN          2.80    (#     91:10  Unique         2.39, 2.51 A)
 &rst
  ixpk= 91, nxpk= 10, iat=1709,1705, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  116 GLN  HA          117 THR  HN          2.80    (#     92:10  Unique         2.14, 2.14 A)
 &rst
  ixpk= 92, nxpk= 10, iat=1690,1705, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  116 GLN  HG+         117 THR  HN          3.50    (#     93:10  Unique         2.84, 3.39 A)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1695,1696,
 &end
#
#    0 AMB  10-2:94     117 THR  HN          4.50    (#     94:10  Single Ambig)
 &rst
  ixpk= 94, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1217,1218,1692,1693,
 &end
#
#  116 GLN  HG-         117 THR  HN          3.50    (#     95:10  Unique         2.84, 3.39 A)
 &rst
  ixpk= 95, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1695,1696,
 &end
#
#  116 GLN  HB-         117 THR  HN          4.50    (#     96:10  Unique         4.19, 4.31 A)
 &rst
  ixpk= 96, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1692,1693,
 &end
#
#  117 THR  MG2         117 THR  HN          4.50    (#     97:10  Unique         4.25, 4.56 A)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1711,1712,1713,
 &end
#
#  123 ILE  HN          122 LYS  HN          5.50    (#     98:10  Unique         4.31, 4.48 A)
 &rst
  ixpk= 98, nxpk= 10, iat=1796,1774, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 LYS  HA          122 LYS  HN          3.50    (#     99:10  Unique         2.79, 2.86 A)
 &rst
  ixpk= 99, nxpk= 10, iat=1776,1774, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  121 LEU  HA          122 LYS  HN          2.80    (#    100:10  Unique         2.21, 2.32 A)
 &rst
  ixpk= 100, nxpk= 10, iat=1757,1774, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  122 LYS  HB+         122 LYS  HN          3.50    (#    101:10  Unique         2.58, 3.18 A)
 &rst
  ixpk= 101, nxpk= 10, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1778,1779,
 &end
#
#    0 AMB  10-2:102    122 LYS  HN          4.50    (#    102:10  Single Ambig)
 &rst
  ixpk= 102, nxpk= 10, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1764,1765,1766,1768,1769,1770,1802,1803,1804,
 &end
#
#    0 AMB  10-2:103    122 LYS  HN          5.50    (#    103:10  Single Ambig)
 &rst
  ixpk= 103, nxpk= 10, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1284,1285,1809,1810,1811,
 &end
#
#  117 THR  HN           84 ARG  HE          4.50    (#    104:10  Unique         3.68, 4.22 A)
 &rst
  ixpk= 104, nxpk= 10, iat=1705,1226, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:105     84 ARG  HE          4.50    (#    105:10  Single Ambig)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2096,2093,
 &end
#
#  142 TRP  HD1          84 ARG  HE          5.50    (#    106:10  Unique         4.68, 5.39 A)
 &rst
  ixpk= 106, nxpk= 10, iat=2091,1226, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 GLY  HA+          84 ARG  HE          5.50    (#    107:10  Unique         3.89, 4.68 A)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1259,1260,
 &end
#
#  117 THR  HB           84 ARG  HE          2.80    (#    108:10  Unique         1.98, 2.51 A)
 &rst
  ixpk= 108, nxpk= 10, iat=1709,1226, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   86 GLY  HA-          84 ARG  HE          5.50    (#    109:10  Unique         3.89, 4.68 A)
 &rst
  ixpk= 109, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1259,1260,
 &end
#
#    0 AMB  10-2:110     84 ARG  HE          3.50    (#    110:10  Single Ambig)
 &rst
  ixpk= 110, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1711,1712,1713, 699, 700, 701,
 &end
#
#   50 TRP  HA            5 THR  HN          3.50    (#    111:10  Unique         3.27, 3.35 A)
 &rst
  ixpk= 111, nxpk= 10, iat= 707,  62, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:112      5 THR  HN          2.80    (#    112:10  Single Ambig)
 &rst
  ixpk= 112, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  45,  64,
 &end
#
#    5 THR  HB            5 THR  HN          2.80    (#    113:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 113, nxpk= 10, iat=  66,  62, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:114      5 THR  HN          5.50    (#    114:10  Single Ambig)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=  53,  54,  25,  26,  27,  80,  81,
 &end
#
#    4 ILE  MG2           5 THR  HN          2.80    (#    115:10  Unique         2.32, 3.10 A)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  49,  50,  51,
 &end
#
#   50 TRP  HN           51 LEU  HN          4.50    (#    116:10  Unique         4.24, 4.28 A)
 &rst
  ixpk= 116, nxpk= 10, iat= 705, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 THR  HN           51 LEU  HN          4.50    (#    117:10  Unique         3.55, 3.63 A)
 &rst
  ixpk= 117, nxpk= 10, iat=  62, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 TRP  HA           51 LEU  HN          2.80    (#    118:10  Unique         2.15, 2.15 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 707, 729, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LEU  HA           51 LEU  HN          4.50    (#    119:10  Unique         3.53, 3.60 A)
 &rst
  ixpk= 119, nxpk= 10, iat=  78, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 LEU  HA           51 LEU  HN          4.50    (#    120:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 120, nxpk= 10, iat= 731, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 TRP  HB-          51 LEU  HN          4.50    (#    121:10  Unique         3.68, 4.09 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 709, 710,
 &end
#
#   51 LEU  HB+          51 LEU  HN          3.50    (#    122:10  Unique         2.47, 3.09 A)
 &rst
  ixpk= 122, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 733, 734,
 &end
#
#    0 AMB  10-2:123     51 LEU  HN          3.50    (#    123:10  Single Ambig)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  49,  50,  51,  85,  86,  87,  89,  90,  91, 692,
       693, 694,
 &end
#
#    0 AMB  10-2:124     51 LEU  HN          5.50    (#    124:10  Single Ambig)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 713,1239,
 &end
#
#   51 LEU  HB-          51 LEU  HN          3.50    (#    125:10  Unique         2.47, 3.09 A)
 &rst
  ixpk= 125, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 733, 734,
 &end
#
#    0 AMB  10-2:126     51 LEU  HN          5.50    (#    126:10  Single Ambig)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 108, 109, 110,1203,1204,1205,1207,1208,1209,
 &end
#
#   47 SER  HN           46 ALA  HN          3.50    (#    128:10  Unique         3.33, 3.35 A)
 &rst
  ixpk= 128, nxpk= 10, iat= 668, 658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 PRO  HA           46 ALA  HN          2.80    (#    131:10  Unique         2.66, 2.70 A)
 &rst
  ixpk= 131, nxpk= 10, iat= 654, 658, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   46 ALA  HA           46 ALA  HN          3.50    (#    132:10  Unique         2.89, 2.90 A)
 &rst
  ixpk= 132, nxpk= 10, iat= 660, 658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 PRO  HB+          46 ALA  HN          3.50    (#    133:10  Unique         1.93, 2.56 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 651, 652,
 &end
#
#   45 PRO  HB-          46 ALA  HN          3.50    (#    134:10  Unique         1.93, 2.56 A)
 &rst
  ixpk= 134, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 651, 652,
 &end
#
#   46 ALA  MB           46 ALA  HN          2.80    (#    135:10  Unique         2.23, 2.94 A)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 662, 663, 664,
 &end
#
#   83 VAL  MGX          46 ALA  HN          5.50    (#    136:10  Unique         4.70, 6.64 A)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  10-2:137     51 LEU  HN          5.50    (#    137:10  Single Ambig)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 738, 739, 740, 742, 743, 744, 105, 106,
 &end
#
#  123 ILE  HA          124 ASN  HN          3.50    (#    138:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 138, nxpk= 10, iat=1798,1815, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 LEU  HB-          46 ALA  HN          7.00    (#    139:10  Unique         6.03, 6.41 A)
 &rst
  ixpk= 139, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 629, 630,
 &end
#
#  119 GLU  HN          120 THR  HN          5.50    (#    140:10  Unique         4.37, 4.42 A)
 &rst
  ixpk= 140, nxpk= 10, iat=1726,1741, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  116 GLN  HE2-        120 THR  HN          3.50    (#    141:10  Unique         3.36, 3.55 A)
 &rst
  ixpk= 141, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1700,1701,
 &end
#
#  119 GLU  HA          120 THR  HN          3.50    (#    143:10  Unique         2.33, 2.41 A)
 &rst
  ixpk= 143, nxpk= 10, iat=1728,1741, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  120 THR  HB          120 THR  HN          2.80    (#    144:10  Unique         2.27, 2.51 A)
 &rst
  ixpk= 144, nxpk= 10, iat=1745,1741, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:145    120 THR  HN          4.50    (#    145:10  Single Ambig)
 &rst
  ixpk= 145, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1733,1734,1695,1696,
 &end
#
#  119 GLU  HB+         120 THR  HN          3.50    (#    146:10  Unique         2.29, 2.95 A)
 &rst
  ixpk= 146, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1730,1731,
 &end
#
#  119 GLU  HB-         120 THR  HN          4.50    (#    147:10  Unique         2.29, 2.95 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1730,1731,
 &end
#
#  120 THR  MG2         120 THR  HN          4.50    (#    148:10  Unique         1.96, 3.59 A)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1747,1748,1749,
 &end
#
#   47 SER  HN           50 TRP  HE1         5.50    (#    149:10  Unique         2.97, 3.18 A)
 &rst
  ixpk= 149, nxpk= 10, iat= 668, 715, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 TRP  HD1          50 TRP  HE1         2.80    (#    151:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 151, nxpk= 10, iat= 713, 715, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:152     50 TRP  HE1         5.50    (#    152:10  Single Ambig)
 &rst
  ixpk= 152, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  66, 681, 682,
 &end
#
#   45 PRO  HD+          50 TRP  HE1         5.50    (#    153:10  Unique         4.72, 5.37 A)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 645, 646,
 &end
#
#    0 AMB  10-2:154     50 TRP  HE1         5.50    (#    154:10  Single Ambig)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630,1201,
 &end
#
#   44 LEU  HB-          50 TRP  HE1         5.50    (#    155:10  Unique         3.07, 3.50 A)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 629, 630,
 &end
#
#   83 VAL  MGX          50 TRP  HE1         3.50    (#    156:10  Unique         2.89, 4.12 A)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    8 SER  HN            7 ILE  HN          5.50    (#    158:10  Unique         4.18, 4.21 A)
 &rst
  ixpk= 158, nxpk= 10, iat= 114,  95, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    6 LEU  HA            7 ILE  HN          2.80    (#    159:10  Unique         2.14, 2.14 A)
 &rst
  ixpk= 159, nxpk= 10, iat=  78,  95, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   52 VAL  HA            7 ILE  HN          4.50    (#    160:10  Unique         2.52, 2.65 A)
 &rst
  ixpk= 160, nxpk= 10, iat= 750,  95, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ILE  HA            7 ILE  HN          5.50    (#    161:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 161, nxpk= 10, iat=  97,  95, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 LEU  HB+           7 ILE  HN          5.50    (#    162:10  Unique         3.69, 4.17 A)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#    0 AMB  10-2:163      7 ILE  HN          5.50    (#    163:10  Single Ambig)
 &rst
  ixpk= 163, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  83, 317, 318, 319,
 &end
#
#    7 ILE  HB            7 ILE  HN          2.80    (#    164:10  Unique         2.82, 2.87 A)
 &rst
  ixpk= 164, nxpk= 10, iat=  99,  95, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    7 ILE  HG1+          7 ILE  HN          4.50    (#    165:10  Unique         1.99, 2.63 A)
 &rst
  ixpk= 165, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 105, 106,
 &end
#
#    6 LEU  MDX           7 ILE  HN          5.50    (#    166:10  Unique         2.85, 4.54 A)
 &rst
  ixpk= 166, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  85,  86,  87,  89,  90,  91,
 &end
#
#    7 ILE  MD1           7 ILE  HN          5.50    (#    167:10  Unique         4.06, 4.47 A)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 108, 109, 110,
 &end
#
#   86 GLY  HA+          87 ALA  HN          2.80    (#    168:10  Unique         2.14, 2.73 A)
 &rst
  ixpk= 168, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1259,1260,
 &end
#
#  120 THR  HA           87 ALA  HN          5.50    (#    169:10  Unique         3.47, 3.76 A)
 &rst
  ixpk= 169, nxpk= 10, iat=1743,1264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 GLY  HA-          87 ALA  HN          3.50    (#    170:10  Unique         2.14, 2.73 A)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1259,1260,
 &end
#
#   87 ALA  MB           87 ALA  HN          2.80    (#    171:10  Unique         2.19, 2.95 A)
 &rst
  ixpk= 171, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1268,1269,1270,
 &end
#
#    0 AMB  10-2:172     87 ALA  HN          5.50    (#    172:10  Single Ambig)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1759,1760,1747,1748,1749,1310,1311,
 &end
#
#  116 GLN  HE2-         87 ALA  HN          4.50    (#    173:10  Unique         2.58, 3.44 A)
 &rst
  ixpk= 173, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1700,1701,
 &end
#
#    0 AMB  10-2:174     87 ALA  HN          5.50    (#    174:10  Single Ambig)
 &rst
  ixpk= 174, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 738, 739, 740, 742, 743, 744,1287,1288,1289,
 &end
#
#  122 LYS  HA          123 ILE  HN          2.80    (#    175:10  Unique         2.15, 2.17 A)
 &rst
  ixpk= 175, nxpk= 10, iat=1776,1796, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  131 PRO  HG-         123 ILE  HN          3.50    (#    176:10  Unique         1.95, 3.95 A)
 &rst
  ixpk= 176, nxpk= 10, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1931,1932,
 &end
#
#  122 LYS  HB+         123 ILE  HN          5.50    (#    177:10  Unique         3.09, 3.63 A)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1778,1779,
 &end
#
#  123 ILE  HG1-        123 ILE  HN          4.50    (#    178:10  Unique         2.03, 2.96 A)
 &rst
  ixpk= 178, nxpk= 10, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1806,1807,
 &end
#
#  123 ILE  MD1         123 ILE  HN          4.50    (#    179:10  Unique         1.89, 3.56 A)
 &rst
  ixpk= 179, nxpk= 10, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1809,1810,1811,
 &end
#
#   83 VAL  HN           82 ALA  HN          2.80    (#    180:10  Unique         1.86, 1.96 A)
 &rst
  ixpk= 180, nxpk= 10, iat=1197,1187, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:181      0 AMB  10-1:181    5.50    (#    181:10  Double Ambig)
 &rst
  ixpk= 181, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 821,1147,
 igr2=1423,1187,
 &end
#
#    0 AMB  10-2:182     82 ALA  HN          2.80    (#    182:10  Single Ambig)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1189,1159,
 &end
#
#    0 AMB  10-2:183     82 ALA  HN          3.50    (#    183:10  Single Ambig)
 &rst
  ixpk= 183, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1178, 670,
 &end
#
#    0 AMB  10-2:184     82 ALA  HN          4.50    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1180,1181,1180,1181,
 &end
#
#   83 VAL  HB           82 ALA  HN          5.50    (#    185:10  Unique         4.50, 4.62 A)
 &rst
  ixpk= 185, nxpk= 10, iat=1201,1187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ALA  MB           82 ALA  HN          2.80    (#    186:10  Unique         2.35, 3.12 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1191,1192,1193,
 &end
#
#   80 LEU  HB+          82 ALA  HN          5.50    (#    187:10  Unique         3.94, 4.61 A)
 &rst
  ixpk= 187, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1161,1162,
 &end
#
#  147 LYS  HA          147 LYS  HN          2.80    (#    188:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 188, nxpk= 10, iat=2177,2175, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  146 LEU  HA          147 LYS  HN          4.50    (#    189:10  Unique         3.47, 3.49 A)
 &rst
  ixpk= 189, nxpk= 10, iat=2158,2175, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  147 LYS  HB-         147 LYS  HN          3.50    (#    190:10  Unique         2.07, 2.71 A)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2179,2180,
 &end
#
#  147 LYS  HB+         147 LYS  HN          2.80    (#    191:10  Unique         2.07, 2.71 A)
 &rst
  ixpk= 191, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2179,2180,
 &end
#
#  147 LYS  HG-         147 LYS  HN          3.50    (#    192:10  Unique         3.50, 4.00 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2182,2183,
 &end
#
#  147 LYS  HG+         147 LYS  HN          4.50    (#    193:10  Unique         3.50, 4.00 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2182,2183,
 &end
#
#  146 LEU  HB+         147 LYS  HN          4.50    (#    194:10  Unique         3.66, 3.94 A)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2160,2161,
 &end
#
#  146 LEU  HG          147 LYS  HN          4.50    (#    195:10  Unique         2.07, 2.13 A)
 &rst
  ixpk= 195, nxpk= 10, iat=2163,2175, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:196    147 LYS  HN          5.50    (#    196:10  Single Ambig)
 &rst
  ixpk= 196, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2146,2147,2148,2150,2151,2152,2144,1711,1712,1713,
      
 &end
#
#   83 VAL  MGX          82 ALA  HN          4.50    (#    197:10  Unique         3.03, 5.32 A)
 &rst
  ixpk= 197, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   97 THR  HA           98 PHE  HN          4.50    (#    198:10  Unique         2.15, 2.45 A)
 &rst
  ixpk= 198, nxpk= 10, iat=1411,1423, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:200      0 AMB  10-1:200    5.50    (#    200:10  Double Ambig)
 &rst
  ixpk= 200, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 474, 394,
 igr2= 489, 360,
 &end
#
#   36 LEU  HN           35 THR  HN          4.50    (#    201:10  Unique         4.57, 4.57 A)
 &rst
  ixpk= 201, nxpk= 10, iat= 503, 489, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 THR  HA           35 THR  HN          3.50    (#    202:10  Unique         2.83, 2.83 A)
 &rst
  ixpk= 202, nxpk= 10, iat= 491, 489, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 GLU  HA           35 THR  HN          2.80    (#    203:10  Unique         2.15, 2.15 A)
 &rst
  ixpk= 203, nxpk= 10, iat= 476, 489, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   35 THR  HB           35 THR  HN          2.80    (#    204:10  Unique         2.67, 2.81 A)
 &rst
  ixpk= 204, nxpk= 10, iat= 493, 489, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   34 GLU  HG+          35 THR  HN          4.50    (#    205:10  Unique         3.36, 4.19 A)
 &rst
  ixpk= 205, nxpk= 10, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 481, 482,
 &end
#
#    0 AMB  10-2:206      0 AMB  10-1:206    4.50    (#    206:10  Double Ambig)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 345, 346,  80,  81, 510,
 igr2= 360, 489,
 &end
#
#    0 AMB  10-2:207     35 THR  HN          4.50    (#    207:10  Single Ambig)
 &rst
  ixpk= 207, nxpk= 10, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 512, 513, 514, 516, 517, 518, 495, 496, 497,
 &end
#
#   40 LEU  HA           41 LEU  HN          3.50    (#    209:10  Unique         3.17, 3.19 A)
 &rst
  ixpk= 209, nxpk= 10, iat= 562, 579, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 LEU  HB+          41 LEU  HN          3.50    (#    210:10  Unique         3.15, 3.57 A)
 &rst
  ixpk= 210, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 583, 584,
 &end
#
#    0 AMB  10-2:211     41 LEU  HN          4.50    (#    211:10  Single Ambig)
 &rst
  ixpk= 211, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 564, 565, 586,
 &end
#
#    0 AMB  10-2:212     41 LEU  HN          4.50    (#    212:10  Single Ambig)
 &rst
  ixpk= 212, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 569, 570, 571, 573, 574, 575, 569, 570, 571, 573,
       574, 575, 166, 167, 168, 170, 171, 172,
 &end
#
#    0 AMB  10-2:213     41 LEU  HN          3.50    (#    213:10  Single Ambig)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 583, 584, 564, 565,
 &end
#
#   27 GLU  HN           26 LEU  HN          3.50    (#    215:10  Unique         2.80, 2.83 A)
 &rst
  ixpk= 215, nxpk= 10, iat= 379, 360, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 LYS  HN           26 LEU  HN          3.50    (#    216:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 216, nxpk= 10, iat= 338, 360, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 GLU  HN           26 LEU  HN          5.50    (#    217:10  Unique         4.29, 4.34 A)
 &rst
  ixpk= 217, nxpk= 10, iat= 323, 360, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 LEU  HA           26 LEU  HN          3.50    (#    218:10  Unique         2.74, 2.75 A)
 &rst
  ixpk= 218, nxpk= 10, iat= 362, 360, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:219     26 LEU  HN          3.50    (#    219:10  Single Ambig)
 &rst
  ixpk= 219, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 296, 315,
 &end
#
#   26 LEU  HB+          26 LEU  HN          2.80    (#    220:10  Unique         2.21, 2.87 A)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 364, 365,
 &end
#
#    0 AMB  10-2:221     26 LEU  HN          4.50    (#    221:10  Single Ambig)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 367,2053,
 &end
#
#    0 AMB  10-2:222     26 LEU  HN          4.50    (#    222:10  Single Ambig)
 &rst
  ixpk= 222, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 298, 299, 466, 467, 468,
 &end
#
#   26 LEU  MDY          26 LEU  HN          3.50    (#    223:10  Unique         1.94, 3.86 A)
 &rst
  ixpk= 223, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 369, 370, 371, 373, 374, 375,
 &end
#
#   36 LEU  HA           37 HIS  HN          2.80    (#    228:10  Unique         2.24, 2.28 A)
 &rst
  ixpk= 228, nxpk= 10, iat= 505, 522, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  131 PRO  HA          132 GLU  HN          3.50    (#    229:10  Unique         3.51, 3.56 A)
 &rst
  ixpk= 229, nxpk= 10, iat=1937,1941, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 HIS  HB-          37 HIS  HN          3.50    (#    230:10  Unique         2.35, 3.26 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 526, 527,
 &end
#
#  129 ASP  HB+         132 GLU  HN          5.50    (#    231:10  Unique         4.31, 4.92 A)
 &rst
  ixpk= 231, nxpk= 10, iat=  -1,1941, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1900,1901,
 &end
#
#   36 LEU  HB-          37 HIS  HN          4.50    (#    232:10  Unique         3.01, 3.15 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 507, 508,
 &end
#
#   37 HIS  HA           37 HIS  HN          5.50    (#    233:10  Unique         2.92, 2.92 A)
 &rst
  ixpk= 233, nxpk= 10, iat= 524, 522, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   37 HIS  HB+          37 HIS  HN          3.50    (#    234:10  Unique         2.35, 3.26 A)
 &rst
  ixpk= 234, nxpk= 10, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 526, 527,
 &end
#
#   82 ALA  HN           83 VAL  HN          2.80    (#    236:10  Unique         1.86, 1.96 A)
 &rst
  ixpk= 236, nxpk= 10, iat=1187,1197, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:237     83 VAL  HN          4.50    (#    237:10  Single Ambig)
 &rst
  ixpk= 237, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1176,1213,
 &end
#
#    0 AMB  10-2:238     83 VAL  HN          3.50    (#    238:10  Single Ambig)
 &rst
  ixpk= 238, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1159,1189,1658,
 &end
#
#    0 AMB  10-2:239     83 VAL  HN          2.80    (#    239:10  Single Ambig)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1199, 670,
 &end
#
#   83 VAL  HB           83 VAL  HN          3.50    (#    240:10  Unique         2.81, 3.11 A)
 &rst
  ixpk= 240, nxpk= 10, iat=1201,1197, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ALA  MB           83 VAL  HN          3.50    (#    241:10  Unique         2.91, 3.84 A)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1191,1192,1193,
 &end
#
#  114 ALA  MB           83 VAL  HN          4.50    (#    242:10  Unique         4.00, 5.24 A)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1660,1661,1662,
 &end
#
#   80 LEU  MDX          83 VAL  HN          5.50    (#    243:10  Unique         3.71, 5.94 A)
 &rst
  ixpk= 243, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   83 VAL  MGX          83 VAL  HN          2.80    (#    244:10  Unique         1.91, 3.77 A)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   80 LEU  HN          114 ALA  HN          5.50    (#    245:10  Unique         3.53, 3.71 A)
 &rst
  ixpk= 245, nxpk= 10, iat=1157,1656, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:246    114 ALA  HN          4.50    (#    246:10  Single Ambig)
 &rst
  ixpk= 246, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1666,1176,1602,
 &end
#
#  113 GLY  HN          114 ALA  HN          2.80    (#    247:10  Unique         2.26, 2.38 A)
 &rst
  ixpk= 247, nxpk= 10, iat=1649,1656, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  114 ALA  HA          114 ALA  HN          2.80    (#    249:10  Unique         2.84, 2.86 A)
 &rst
  ixpk= 249, nxpk= 10, iat=1658,1656, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  113 GLY  HA+         114 ALA  HN          3.50    (#    250:10  Unique         2.86, 3.21 A)
 &rst
  ixpk= 250, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1651,1652,
 &end
#
#    0 AMB  10-2:251    114 ALA  HN          5.50    (#    251:10  Single Ambig)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1606,1607,1606,1607,
 &end
#
#    0 AMB  10-2:252    114 ALA  HN          7.00    (#    252:10  Single Ambig)
 &rst
  ixpk= 252, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
 igr1=1670,1671,1217,1218,1138,1139,1201,
 &end
#
#   80 LEU  HB-         114 ALA  HN          3.50    (#    253:10  Unique         1.87, 2.53 A)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1161,1162,
 &end
#
#  114 ALA  MB          114 ALA  HN          2.80    (#    254:10  Unique         2.20, 2.90 A)
 &rst
  ixpk= 254, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1660,1661,1662,
 &end
#
#   80 LEU  MDY         114 ALA  HN          5.50    (#    255:10  Unique         3.11, 4.92 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   80 LEU  MDX         114 ALA  HN          5.50    (#    256:10  Unique         3.11, 4.92 A)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   29 ALA  HN           28 GLU  HN          2.80    (#    260:10  Unique         2.47, 2.57 A)
 &rst
  ixpk= 260, nxpk= 10, iat= 409, 394, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   27 GLU  HA           28 GLU  HN          5.50    (#    261:10  Unique         3.49, 3.53 A)
 &rst
  ixpk= 261, nxpk= 10, iat= 381, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:262     28 GLU  HN          2.80    (#    262:10  Single Ambig)
 &rst
  ixpk= 262, nxpk= 10, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 396, 340,
 &end
#
#   28 GLU  HG+          28 GLU  HN          4.50    (#    263:10  Unique         2.27, 3.31 A)
 &rst
  ixpk= 263, nxpk= 10, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 401, 402,
 &end
#
#   28 GLU  HB-          28 GLU  HN          3.50    (#    264:10  Unique         2.21, 2.94 A)
 &rst
  ixpk= 264, nxpk= 10, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 398, 399,
 &end
#
#    0 AMB  10-2:265     28 GLU  HN          2.80    (#    265:10  Single Ambig)
 &rst
  ixpk= 265, nxpk= 10, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 398, 399, 383, 384, 383, 384,
 &end
#
#   27 GLU  HN           28 GLU  HN          3.50    (#    266:10  Unique         2.45, 2.62 A)
 &rst
  ixpk= 266, nxpk= 10, iat= 379, 394, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 LEU  HN           23 ALA  HN          3.50    (#    267:10  Unique         2.96, 2.98 A)
 &rst
  ixpk= 267, nxpk= 10, iat= 294, 313, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 GLU  HN           23 ALA  HN          4.50    (#    268:10  Unique         2.86, 2.88 A)
 &rst
  ixpk= 268, nxpk= 10, iat= 323, 313, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:269     23 ALA  HN          3.50    (#    269:10  Single Ambig)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 315, 296,
 &end
#
#    0 AMB  10-2:270     23 ALA  HN          5.50    (#    270:10  Single Ambig)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 301, 266, 267,
 &end
#
#   22 LEU  HB-          23 ALA  HN          3.50    (#    271:10  Unique         2.42, 2.69 A)
 &rst
  ixpk= 271, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 298, 299,
 &end
#
#   23 ALA  MB           23 ALA  HN          2.80    (#    272:10  Unique         2.14, 2.88 A)
 &rst
  ixpk= 272, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 317, 318, 319,
 &end
#
#   33 THR  HN            3 ASP  HN          5.50    (#    273:10  Unique         4.20, 4.25 A)
 &rst
  ixpk= 273, nxpk= 10, iat= 460,  31, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    2 ALA  HA            3 ASP  HN          2.80    (#    274:10  Unique         2.52, 2.62 A)
 &rst
  ixpk= 274, nxpk= 10, iat=  23,  31, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   32 THR  HN            3 ASP  HN          3.50    (#    275:10  Unique         3.18, 3.39 A)
 &rst
  ixpk= 275, nxpk= 10, iat= 446,  31, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 ILE  HN            3 ASP  HN          3.50    (#    276:10  Unique         1.93, 2.01 A)
 &rst
  ixpk= 276, nxpk= 10, iat=  43,  31, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:278      3 ASP  HN          2.80    (#    278:10  Single Ambig)
 &rst
  ixpk= 278, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 450,  33,
 &end
#
#    3 ASP  HB+           3 ASP  HN          3.50    (#    279:10  Unique         2.44, 2.75 A)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  35,  36,
 &end
#
#    3 ASP  HB-           3 ASP  HN          3.50    (#    280:10  Unique         2.44, 2.75 A)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  35,  36,
 &end
#
#    2 ALA  MB            3 ASP  HN          2.80    (#    281:10  Unique         2.17, 2.94 A)
 &rst
  ixpk= 281, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  25,  26,  27,
 &end
#
#   70 TYR  HN           69 PHE  HN          3.50    (#    282:10  Unique         2.93, 3.02 A)
 &rst
  ixpk= 282, nxpk= 10, iat= 995, 975, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HA           69 PHE  HN          5.50    (#    284:10  Unique         3.77, 4.36 A)
 &rst
  ixpk= 284, nxpk= 10, iat= 933, 975, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 PHE  HA           69 PHE  HN          3.50    (#    285:10  Unique         2.76, 2.78 A)
 &rst
  ixpk= 285, nxpk= 10, iat= 977, 975, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 PHE  HB+          69 PHE  HN          2.80    (#    286:10  Unique         2.10, 2.60 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 979, 980,
 &end
#
#   69 PHE  HB-          69 PHE  HN          3.50    (#    287:10  Unique         2.10, 2.60 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 979, 980,
 &end
#
#   68 PRO  HB-          69 PHE  HN          4.50    (#    288:10  Unique         3.02, 3.57 A)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 968, 969,
 &end
#
#  138 TRP  HA          138 TRP  HN          2.80    (#    290:10  Unique         2.74, 2.74 A)
 &rst
  ixpk= 290, nxpk= 10, iat=2024,2022, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  138 TRP  HB+         138 TRP  HN          2.80    (#    291:10  Unique         2.08, 2.73 A)
 &rst
  ixpk= 291, nxpk= 10, iat=  -1,2022, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2026,2027,
 &end
#
#  137 GLU  HB+         138 TRP  HN          3.50    (#    292:10  Unique         2.63, 2.93 A)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1,2022, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2011,2012,
 &end
#
#  121 LEU  HG          138 TRP  HN          7.00    (#    293:10  Unique         4.84, 5.00 A)
 &rst
  ixpk= 293, nxpk= 10, iat=1762,2022, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  139 LEU  HN          138 TRP  HN          3.50    (#    295:10  Unique         2.93, 2.96 A)
 &rst
  ixpk= 295, nxpk= 10, iat=2046,2022, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 LYS  HN          109 LEU  HN          3.50    (#    298:10  Unique         2.71, 2.78 A)
 &rst
  ixpk= 298, nxpk= 10, iat=1602,1583, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  108 GLU  HN          109 LEU  HN          3.50    (#    299:10  Unique         2.52, 2.57 A)
 &rst
  ixpk= 299, nxpk= 10, iat=1568,1583, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:300    109 LEU  HN          3.50    (#    300:10  Single Ambig)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1585,1545,
 &end
#
#  108 GLU  HB+         109 LEU  HN          3.50    (#    301:10  Unique         2.71, 3.15 A)
 &rst
  ixpk= 301, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1572,1573,
 &end
#
#  109 LEU  HG          109 LEU  HN          2.80    (#    302:10  Unique         2.37, 2.41 A)
 &rst
  ixpk= 302, nxpk= 10, iat=1590,1583, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  109 LEU  HB+         109 LEU  HN          2.80    (#    303:10  Unique         2.39, 3.01 A)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1587,1588,
 &end
#
#  109 LEU  HB-         109 LEU  HN          3.50    (#    304:10  Unique         2.39, 3.01 A)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1587,1588,
 &end
#
#   71 GLU  HN           72 ALA  HN          2.80    (#    306:10  Unique         2.87, 2.90 A)
 &rst
  ixpk= 306, nxpk= 10, iat=1016,1031, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:307     72 ALA  HN          4.50    (#    307:10  Single Ambig)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 995,1077,
 &end
#
#    0 AMB  10-2:308     72 ALA  HN          2.80    (#    308:10  Single Ambig)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1033, 977,
 &end
#
#    0 AMB  10-2:309     72 ALA  HN          4.50    (#    309:10  Single Ambig)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1018, 997,
 &end
#
#   71 GLU  HG+          72 ALA  HN          5.50    (#    310:10  Unique         4.59, 4.71 A)
 &rst
  ixpk= 310, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1023,1024,
 &end
#
#   71 GLU  HB+          72 ALA  HN          2.80    (#    311:10  Unique         2.45, 2.81 A)
 &rst
  ixpk= 311, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1020,1021,
 &end
#
#   72 ALA  MB           72 ALA  HN          2.80    (#    312:10  Unique         2.17, 2.88 A)
 &rst
  ixpk= 312, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1035,1036,1037,
 &end
#
#    0 AMB  10-2:313     72 ALA  HN          5.50    (#    313:10  Single Ambig)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1048, 583, 584,
 &end
#
#  110 LYS  HN          111 ASN  HN          2.80    (#    314:10  Unique         2.36, 2.43 A)
 &rst
  ixpk= 314, nxpk= 10, iat=1602,1624, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  112 SER  HN          111 ASN  HN          2.80    (#    315:10  Unique         2.54, 2.59 A)
 &rst
  ixpk= 315, nxpk= 10, iat=1638,1624, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  111 ASN  HB-         111 ASN  HN          2.80    (#    316:10  Unique         2.09, 2.62 A)
 &rst
  ixpk= 316, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1628,1629,
 &end
#
#    0 AMB  10-2:317    111 ASN  HN          3.50    (#    317:10  Single Ambig)
 &rst
  ixpk= 317, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1606,1607,1606,1607,
 &end
#
#    0 AMB  10-2:318    111 ASN  HN          2.80    (#    318:10  Single Ambig)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1626,1604,
 &end
#
#  108 GLU  HA          111 ASN  HN          3.50    (#    319:10  Unique         3.20, 3.24 A)
 &rst
  ixpk= 319, nxpk= 10, iat=1570,1624, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 LEU  HN           27 GLU  HN          2.80    (#    320:10  Unique         2.80, 2.83 A)
 &rst
  ixpk= 320, nxpk= 10, iat= 360, 379, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   28 GLU  HN           27 GLU  HN          2.80    (#    321:10  Unique         2.45, 2.62 A)
 &rst
  ixpk= 321, nxpk= 10, iat= 394, 379, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:322     27 GLU  HN          4.50    (#    322:10  Single Ambig)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 409, 338,
 &end
#
#   27 GLU  HA           27 GLU  HN          3.50    (#    323:10  Unique         2.81, 2.83 A)
 &rst
  ixpk= 323, nxpk= 10, iat= 381, 379, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:324     27 GLU  HN          2.80    (#    324:10  Single Ambig)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 386, 387, 386, 387,
 &end
#
#    0 AMB  10-2:325     27 GLU  HN          2.80    (#    325:10  Single Ambig)
 &rst
  ixpk= 325, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 383, 384, 383, 384,
 &end
#
#   33 THR  MG2          27 GLU  HN          3.50    (#    326:10  Unique         3.12, 4.15 A)
 &rst
  ixpk= 326, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 466, 467, 468,
 &end
#
#    0 AMB  10-2:327     27 GLU  HN          4.50    (#    327:10  Single Ambig)
 &rst
  ixpk= 327, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 369, 370, 371, 373, 374, 375,  85,  86,  87,  89,
        90,  91,
 &end
#
#  138 TRP  HN          139 LEU  HN          3.50    (#    331:10  Unique         2.93, 2.96 A)
 &rst
  ixpk= 331, nxpk= 10, iat=2022,2046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  138 TRP  HA          139 LEU  HN          4.50    (#    332:10  Unique         3.56, 3.56 A)
 &rst
  ixpk= 332, nxpk= 10, iat=2024,2046, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:333    139 LEU  HN          2.80    (#    333:10  Single Ambig)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2048,1994,
 &end
#
#  139 LEU  HB-         139 LEU  HN          3.50    (#    334:10  Unique         2.05, 2.70 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2050,2051,
 &end
#
#  140 GLY  HN          139 LEU  HN          3.50    (#    335:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 335, nxpk= 10, iat=2065,2046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  138 TRP  HB+         139 LEU  HN          3.50    (#    336:10  Unique         2.10, 2.83 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2026,2027,
 &end
#
#  130 ILE  HN          129 ASP  HN          4.50    (#    338:10  Unique         2.28, 2.83 A)
 &rst
  ixpk= 338, nxpk= 10, iat=1908,1896, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  128 HIS  HA          129 ASP  HN          2.80    (#    340:10  Unique         2.16, 2.33 A)
 &rst
  ixpk= 340, nxpk= 10, iat=1881,1896, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  129 ASP  HB+         129 ASP  HN          3.50    (#    341:10  Unique         2.09, 3.25 A)
 &rst
  ixpk= 341, nxpk= 10, iat=  -1,1896, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1900,1901,
 &end
#
#  137 GLU  HB+         137 GLU  HN          3.50    (#    342:10  Unique         2.07, 2.70 A)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1,2007, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2011,2012,
 &end
#
#    6 LEU  MDY          34 GLU  HN          3.50    (#    344:10  Unique         2.95, 5.38 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  85,  86,  87,  89,  90,  91,
 &end
#
#   50 TRP  HN           49 ILE  HN          4.50    (#    345:10  Unique         4.06, 4.19 A)
 &rst
  ixpk= 345, nxpk= 10, iat= 705, 686, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 TRP  HD1          49 ILE  HN          5.50    (#    346:10  Unique         3.33, 3.45 A)
 &rst
  ixpk= 346, nxpk= 10, iat= 713, 686, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ILE  HA           49 ILE  HN          3.50    (#    347:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 347, nxpk= 10, iat= 688, 686, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 ILE  HA           49 ILE  HN          4.50    (#    348:10  Unique         3.06, 3.19 A)
 &rst
  ixpk= 348, nxpk= 10, iat=  45, 686, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 GLY  HA+          49 ILE  HN          3.50    (#    349:10  Unique         2.14, 2.66 A)
 &rst
  ixpk= 349, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 681, 682,
 &end
#
#   48 GLY  HA-          49 ILE  HN          2.80    (#    350:10  Unique         2.14, 2.66 A)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 681, 682,
 &end
#
#   49 ILE  HB           49 ILE  HN          3.50    (#    351:10  Unique         2.87, 2.96 A)
 &rst
  ixpk= 351, nxpk= 10, iat= 690, 686, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:352     49 ILE  HN          4.50    (#    352:10  Single Ambig)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  49,  50,  51, 692, 693, 694,
 &end
#
#    0 AMB  10-2:353     49 ILE  HN          2.80    (#    353:10  Single Ambig)
 &rst
  ixpk= 353, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 696, 697, 699, 700, 701,
 &end
#
#    0 AMB  10-2:354     19 ALA  HN          4.50    (#    354:10  Single Ambig)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 240, 266, 267,
 &end
#
#   19 ALA  MB           19 ALA  HN          2.80    (#    355:10  Unique         2.09, 2.88 A)
 &rst
  ixpk= 355, nxpk= 10, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 256, 257, 258,
 &end
#
#   18 VAL  HN           19 ALA  HN          3.50    (#    356:10  Unique         2.18, 2.21 A)
 &rst
  ixpk= 356, nxpk= 10, iat= 236, 252, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:357     19 ALA  HN          4.50    (#    357:10  Single Ambig)
 &rst
  ixpk= 357, nxpk= 10, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1= 770, 771, 772, 777, 778, 779, 495, 496, 497, 774,
       775,1809,1810,1811,
 &end
#
#    6 LEU  HN           34 GLU  HN          3.50    (#    358:10  Unique         3.58, 3.61 A)
 &rst
  ixpk= 358, nxpk= 10, iat=  76, 474, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 THR  HN           34 GLU  HN          5.50    (#    359:10  Unique         4.40, 4.42 A)
 &rst
  ixpk= 359, nxpk= 10, iat= 460, 474, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 THR  HA           34 GLU  HN          2.80    (#    360:10  Unique         2.28, 2.29 A)
 &rst
  ixpk= 360, nxpk= 10, iat= 462, 474, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    5 THR  HA           34 GLU  HN          3.50    (#    361:10  Unique         3.00, 3.05 A)
 &rst
  ixpk= 361, nxpk= 10, iat=  64, 474, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 THR  HB           34 GLU  HN          2.80    (#    362:10  Unique         2.74, 2.77 A)
 &rst
  ixpk= 362, nxpk= 10, iat= 464, 474, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:363     34 GLU  HN          3.50    (#    363:10  Single Ambig)
 &rst
  ixpk= 363, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 478, 479,  80,  81,
 &end
#
#    0 AMB  10-2:364     34 GLU  HN          3.50    (#    364:10  Single Ambig)
 &rst
  ixpk= 364, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=  25,  26,  27,  80,  81,
 &end
#
#   93 ARG  HA           94 GLU  HN          5.50    (#    365:10  Unique         2.45, 3.32 A)
 &rst
  ixpk= 365, nxpk= 10, iat=1339,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLU  HB+          94 GLU  HN          3.50    (#    366:10  Unique         2.40, 3.30 A)
 &rst
  ixpk= 366, nxpk= 10, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1365,1366,
 &end
#
#  105 LEU  HN          104 LYS  HN          3.50    (#    369:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 369, nxpk= 10, iat=1524,1502, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:371    104 LYS  HN          5.50    (#    371:10  Single Ambig)
 &rst
  ixpk= 371, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1492, 907,
 &end
#
#    0 AMB  10-2:372    104 LYS  HN          4.50    (#    372:10  Single Ambig)
 &rst
  ixpk= 372, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 909, 910,1494,1495,
 &end
#
#  104 LYS  HB+         104 LYS  HN          2.80    (#    373:10  Unique         2.36, 3.05 A)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1506,1507,
 &end
#
#  104 LYS  HG+         104 LYS  HN          2.80    (#    374:10  Unique         2.43, 2.69 A)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1509,1510,
 &end
#
#  104 LYS  HG-         104 LYS  HN          3.50    (#    375:10  Unique         2.43, 2.69 A)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1509,1510,
 &end
#
#    5 THR  HN           44 LEU  HN          5.50    (#    376:10  Unique         4.98, 5.11 A)
 &rst
  ixpk= 376, nxpk= 10, iat=  62, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 ASP  HN           44 LEU  HN          2.80    (#    377:10  Unique         2.63, 2.65 A)
 &rst
  ixpk= 377, nxpk= 10, iat= 613, 625, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   44 LEU  HA           44 LEU  HN          3.50    (#    379:10  Unique         2.93, 2.93 A)
 &rst
  ixpk= 379, nxpk= 10, iat= 627, 625, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 GLU  HA           44 LEU  HN          4.50    (#    380:10  Unique         3.30, 3.31 A)
 &rst
  ixpk= 380, nxpk= 10, iat= 600, 625, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 THR  HB           44 LEU  HN          5.50    (#    381:10  Unique         2.31, 2.36 A)
 &rst
  ixpk= 381, nxpk= 10, iat=  66, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 ASP  HB+          44 LEU  HN          3.50    (#    382:10  Unique         3.29, 3.37 A)
 &rst
  ixpk= 382, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 617, 618,
 &end
#
#   44 LEU  HB+          44 LEU  HN          2.80    (#    383:10  Unique         2.40, 3.04 A)
 &rst
  ixpk= 383, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 629, 630,
 &end
#
#   44 LEU  HG           44 LEU  HN          2.80    (#    384:10  Unique         2.87, 2.90 A)
 &rst
  ixpk= 384, nxpk= 10, iat= 632, 625, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   44 LEU  MDX          44 LEU  HN          4.50    (#    385:10  Unique         3.61, 4.70 A)
 &rst
  ixpk= 385, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#   84 ARG  HA          115 LYS  HN          3.50    (#    388:10  Unique         1.94, 2.24 A)
 &rst
  ixpk= 388, nxpk= 10, iat=1215,1666, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ALA  HA          115 LYS  HN          2.80    (#    389:10  Unique         2.22, 2.31 A)
 &rst
  ixpk= 389, nxpk= 10, iat=1658,1666, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:390    115 LYS  HN          3.50    (#    390:10  Single Ambig)
 &rst
  ixpk= 390, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1670,1671,1217,1218,
 &end
#
#  115 LYS  HG+         115 LYS  HN          3.50    (#    391:10  Unique         1.98, 2.47 A)
 &rst
  ixpk= 391, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1673,1674,
 &end
#
#  114 ALA  MB          115 LYS  HN          2.80    (#    392:10  Unique         2.58, 3.46 A)
 &rst
  ixpk= 392, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1660,1661,1662,
 &end
#
#  114 ALA  HN          115 LYS  HN          5.50    (#    393:10  Unique         4.59, 4.62 A)
 &rst
  ixpk= 393, nxpk= 10, iat=1656,1666, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 GLY  HN           31 PHE  HN          2.80    (#    394:10  Unique         1.91, 1.96 A)
 &rst
  ixpk= 394, nxpk= 10, iat= 419, 426, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   29 ALA  HN           31 PHE  HN          4.50    (#    395:10  Unique         3.79, 3.88 A)
 &rst
  ixpk= 395, nxpk= 10, iat= 409, 426, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:397     31 PHE  HN          2.80    (#    397:10  Single Ambig)
 &rst
  ixpk= 397, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 428, 381,
 &end
#
#   30 GLY  HA+          31 PHE  HN          4.50    (#    398:10  Unique         3.11, 3.27 A)
 &rst
  ixpk= 398, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 421, 422,
 &end
#
#   31 PHE  HB+          31 PHE  HN          3.50    (#    399:10  Unique         3.45, 3.51 A)
 &rst
  ixpk= 399, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 430, 431,
 &end
#
#   31 PHE  HB-          31 PHE  HN          3.50    (#    400:10  Unique         3.45, 3.51 A)
 &rst
  ixpk= 400, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 430, 431,
 &end
#
#   29 ALA  MB           31 PHE  HN          4.50    (#    401:10  Unique         3.05, 4.07 A)
 &rst
  ixpk= 401, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 413, 414, 415,
 &end
#
#  106 GLU  HN          105 LEU  HN          4.50    (#    402:10  Unique         3.10, 3.12 A)
 &rst
  ixpk= 402, nxpk= 10, iat=1543,1524, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  104 LYS  HN          105 LEU  HN          4.50    (#    403:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 403, nxpk= 10, iat=1502,1524, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 LEU  HB+         105 LEU  HN          3.50    (#    404:10  Unique         2.15, 2.54 A)
 &rst
  ixpk= 404, nxpk= 10, iat=  -1,1524, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1528,1529,
 &end
#
#  105 LEU  HG          105 LEU  HN          4.50    (#    405:10  Unique         4.48, 4.51 A)
 &rst
  ixpk= 405, nxpk= 10, iat=1531,1524, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  107 ALA  HN          105 LEU  HN          5.50    (#    406:10  Unique         3.91, 3.94 A)
 &rst
  ixpk= 406, nxpk= 10, iat=1558,1524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 ALA  HN           18 VAL  HN          3.50    (#    407:10  Unique         2.18, 2.21 A)
 &rst
  ixpk= 407, nxpk= 10, iat= 252, 236, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 TYR  HN           18 VAL  HN          3.50    (#    408:10  Unique         2.81, 2.94 A)
 &rst
  ixpk= 408, nxpk= 10, iat= 215, 236, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 TYR  HA           18 VAL  HN          5.50    (#    409:10  Unique         3.51, 3.56 A)
 &rst
  ixpk= 409, nxpk= 10, iat= 217, 236, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 VAL  HA           18 VAL  HN          4.50    (#    410:10  Unique         2.91, 2.92 A)
 &rst
  ixpk= 410, nxpk= 10, iat= 238, 236, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 VAL  HB           18 VAL  HN          2.80    (#    411:10  Unique         2.55, 2.63 A)
 &rst
  ixpk= 411, nxpk= 10, iat= 240, 236, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   18 VAL  MGX          18 VAL  HN          2.80    (#    412:10  Unique         2.16, 3.86 A)
 &rst
  ixpk= 412, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#   18 VAL  MGY          18 VAL  HN          4.50    (#    413:10  Unique         2.16, 3.86 A)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#   54 SER  HN           88 ILE  HN          4.50    (#    414:10  Unique         3.44, 3.68 A)
 &rst
  ixpk= 414, nxpk= 10, iat= 783,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 VAL  HB           88 ILE  HN          7.00    (#    415:10  Unique         5.60, 5.87 A)
 &rst
  ixpk= 415, nxpk= 10, iat= 752,1274, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  121 LEU  MDY          88 ILE  HN          5.50    (#    416:10  Unique         5.99, 7.29 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#   90 ILE  HG1+         88 ILE  HN          3.50    (#    417:10  Unique         2.13, 2.94 A)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1310,1311,
 &end
#
#   89 GLY  HN           88 ILE  HN          5.50    (#    418:10  Unique         3.95, 4.13 A)
 &rst
  ixpk= 418, nxpk= 10, iat=1293,1274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ALA  HA           88 ILE  HN          2.80    (#    419:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 419, nxpk= 10, iat=1266,1274, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   53 ILE  HA           88 ILE  HN          4.50    (#    420:10  Unique         2.56, 2.79 A)
 &rst
  ixpk= 420, nxpk= 10, iat= 766,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   88 ILE  HA           88 ILE  HN          4.50    (#    421:10  Unique         2.94, 2.95 A)
 &rst
  ixpk= 421, nxpk= 10, iat=1276,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:422     88 ILE  HN          2.80    (#    422:10  Single Ambig)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1310,1311,1278,1268,1269,1270,
 &end
#
#    0 AMB  10-2:423     88 ILE  HN          4.50    (#    423:10  Single Ambig)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285, 774, 775,
 &end
#
#   88 ILE  MG2          88 ILE  HN          5.50    (#    424:10  Unique         4.41, 4.69 A)
 &rst
  ixpk= 424, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1280,1281,1282,
 &end
#
#   27 GLU  HN           29 ALA  HN          5.50    (#    427:10  Unique         3.82, 3.86 A)
 &rst
  ixpk= 427, nxpk= 10, iat= 379, 409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 GLU  HA           29 ALA  HN          5.50    (#    428:10  Unique         3.64, 3.69 A)
 &rst
  ixpk= 428, nxpk= 10, iat= 381, 409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 ALA  HA           29 ALA  HN          3.50    (#    429:10  Unique         2.79, 2.81 A)
 &rst
  ixpk= 429, nxpk= 10, iat= 411, 409, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:430     29 ALA  HN          3.50    (#    430:10  Single Ambig)
 &rst
  ixpk= 430, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 396, 340,
 &end
#
#   28 GLU  HB+          29 ALA  HN          4.50    (#    431:10  Unique         3.22, 3.68 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 398, 399,
 &end
#
#   29 ALA  MB           29 ALA  HN          2.80    (#    432:10  Unique         2.22, 2.88 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 413, 414, 415,
 &end
#
#   71 GLU  HN           70 TYR  HN          3.50    (#    433:10  Unique         2.80, 2.84 A)
 &rst
  ixpk= 433, nxpk= 10, iat=1016, 995, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 PHE  HN           70 TYR  HN          3.50    (#    434:10  Unique         2.93, 3.02 A)
 &rst
  ixpk= 434, nxpk= 10, iat= 975, 995, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 TYR  HD           70 TYR  HN          4.50    (#    435:10  Unique         3.48, 4.37 A)
 &rst
  ixpk= 435, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1003,1012,
 &end
#
#   69 PHE  HA           70 TYR  HN          5.50    (#    437:10  Unique         3.57, 3.57 A)
 &rst
  ixpk= 437, nxpk= 10, iat= 977, 995, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:438     70 TYR  HN          2.80    (#    438:10  Single Ambig)
 &rst
  ixpk= 438, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 979, 980, 999,1000,
 &end
#
#    0 AMB  10-2:439     70 TYR  HN          7.00    (#    439:10  Single Ambig)
 &rst
  ixpk= 439, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 940, 941, 942, 944, 945, 946, 588, 589, 590, 592,
       593, 594,
 &end
#
#   38 GLY  HN            8 SER  HN          4.50    (#    440:10  Unique         2.29, 2.58 A)
 &rst
  ixpk= 440, nxpk= 10, iat= 539, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 HIS  HA            8 SER  HN          3.50    (#    441:10  Unique         2.77, 2.99 A)
 &rst
  ixpk= 441, nxpk= 10, iat= 524, 114, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 ILE  HA            8 SER  HN          2.80    (#    442:10  Unique         2.16, 2.16 A)
 &rst
  ixpk= 442, nxpk= 10, iat=  97, 114, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:443      8 SER  HN          2.80    (#    443:10  Single Ambig)
 &rst
  ixpk= 443, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 118, 119, 118, 119,
 &end
#
#   61 ASP  HA           61 ASP  HN          3.50    (#    444:10  Unique         2.73, 2.89 A)
 &rst
  ixpk= 444, nxpk= 10, iat= 862, 860, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 ASP  HB-          61 ASP  HN          3.50    (#    445:10  Unique         2.09, 2.89 A)
 &rst
  ixpk= 445, nxpk= 10, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 864, 865,
 &end
#
#  112 SER  HN          110 LYS  HN          5.50    (#    446:10  Unique         3.74, 3.80 A)
 &rst
  ixpk= 446, nxpk= 10, iat=1638,1602, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:448    110 LYS  HN          4.50    (#    448:10  Single Ambig)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1585,1545,
 &end
#
#  110 LYS  HG+         110 LYS  HN          4.50    (#    449:10  Unique         2.07, 2.85 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1609,1610,
 &end
#
#    0 AMB  10-2:450    110 LYS  HN          2.80    (#    450:10  Single Ambig)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1606,1607,1606,1607,
 &end
#
#  109 LEU  HB-         110 LYS  HN          4.50    (#    451:10  Unique         2.51, 3.05 A)
 &rst
  ixpk= 451, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1587,1588,
 &end
#
#  129 ASP  HN          130 ILE  HN          4.50    (#    452:10  Unique         2.28, 2.83 A)
 &rst
  ixpk= 452, nxpk= 10, iat=1896,1908, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:453    130 ILE  HN          2.80    (#    453:10  Single Ambig)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1910,1898,
 &end
#
#  129 ASP  HB+         130 ILE  HN          3.50    (#    454:10  Unique         1.94, 2.41 A)
 &rst
  ixpk= 454, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1900,1901,
 &end
#
#  130 ILE  HB          130 ILE  HN          3.50    (#    455:10  Unique         2.22, 2.66 A)
 &rst
  ixpk= 455, nxpk= 10, iat=1912,1908, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  130 ILE  HG1+        130 ILE  HN          4.50    (#    457:10  Unique         3.74, 4.23 A)
 &rst
  ixpk= 457, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1918,1919,
 &end
#
#  130 ILE  MG2         130 ILE  HN          4.50    (#    458:10  Unique         3.99, 4.50 A)
 &rst
  ixpk= 458, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1914,1915,1916,
 &end
#
#   16 GLU  HA           17 TYR  HN          5.50    (#    460:10  Unique         3.29, 3.32 A)
 &rst
  ixpk= 460, nxpk= 10, iat= 202, 215, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 LEU  HN           43 ASP  HN          5.50    (#    461:10  Unique         4.73, 4.82 A)
 &rst
  ixpk= 461, nxpk= 10, iat= 560, 613, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 GLU  HA           43 ASP  HN          4.50    (#    462:10  Unique         2.23, 2.25 A)
 &rst
  ixpk= 462, nxpk= 10, iat= 600, 613, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 LEU  HB-          43 ASP  HN          5.50    (#    463:10  Unique         4.44, 5.01 A)
 &rst
  ixpk= 463, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 564, 565,
 &end
#
#   44 LEU  HN           43 ASP  HN          2.80    (#    464:10  Unique         2.63, 2.65 A)
 &rst
  ixpk= 464, nxpk= 10, iat= 625, 613, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   43 ASP  HA           43 ASP  HN          3.50    (#    465:10  Unique         2.78, 2.80 A)
 &rst
  ixpk= 465, nxpk= 10, iat= 615, 613, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 ASP  HB+          43 ASP  HN          2.80    (#    466:10  Unique         2.07, 2.68 A)
 &rst
  ixpk= 466, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 617, 618,
 &end
#
#    0 AMB  10-2:467     43 ASP  HN          4.50    (#    467:10  Single Ambig)
 &rst
  ixpk= 467, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 605, 606, 605, 606,
 &end
#
#   42 GLU  HB+          43 ASP  HN          4.50    (#    468:10  Unique         3.98, 4.24 A)
 &rst
  ixpk= 468, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 602, 603,
 &end
#
#   40 LEU  HB+          43 ASP  HN          4.50    (#    469:10  Unique         4.44, 5.01 A)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 564, 565,
 &end
#
#   44 LEU  HG           43 ASP  HN          5.50    (#    470:10  Unique         4.60, 4.65 A)
 &rst
  ixpk= 470, nxpk= 10, iat= 632, 613, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 LEU  HB-          43 ASP  HN          7.00    (#    471:10  Unique         4.80, 5.56 A)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 629, 630,
 &end
#
#    0 AMB  10-2:472     43 ASP  HN          5.50    (#    472:10  Single Ambig)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 569, 570, 571, 573, 574, 575,  85,  86,  87,  89,
        90,  91,  85,  86,  87,  89,  90,  91,
 &end
#
#  106 GLU  HN          107 ALA  HN          3.50    (#    473:10  Unique         2.73, 2.75 A)
 &rst
  ixpk= 473, nxpk= 10, iat=1543,1558, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  109 LEU  HN          107 ALA  HN          5.50    (#    474:10  Unique         3.97, 4.04 A)
 &rst
  ixpk= 474, nxpk= 10, iat=1583,1558, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:475    107 ALA  HN          2.80    (#    475:10  Single Ambig)
 &rst
  ixpk= 475, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1560,1504,
 &end
#
#  106 GLU  HG+         107 ALA  HN          5.50    (#    476:10  Unique         4.22, 4.77 A)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1550,1551,
 &end
#
#  106 GLU  HB+         107 ALA  HN          2.80    (#    477:10  Unique         2.78, 3.28 A)
 &rst
  ixpk= 477, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1547,1548,
 &end
#
#    0 AMB  10-2:478    107 ALA  HN          7.00    (#    478:10  Single Ambig)
 &rst
  ixpk= 478, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1609,1610,1531,
 &end
#
#  107 ALA  MB          107 ALA  HN          2.80    (#    479:10  Unique         2.07, 2.87 A)
 &rst
  ixpk= 479, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1562,1563,1564,
 &end
#
#    0 AMB  10-2:480    107 ALA  HN          5.50    (#    480:10  Single Ambig)
 &rst
  ixpk= 480, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1587,1588,1509,1510,
 &end
#
#    0 AMB  10-2:481    106 GLU  HN          5.50    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1531,1609,1610,
 &end
#
#    0 AMB  10-2:482    106 GLU  HN          4.50    (#    482:10  Single Ambig)
 &rst
  ixpk= 482, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1=1587,1588,1268,1269,1270,1509,1510,
 &end
#
#  105 LEU  HN          106 GLU  HN          3.50    (#    483:10  Unique         3.10, 3.12 A)
 &rst
  ixpk= 483, nxpk= 10, iat=1524,1543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  108 GLU  HN          106 GLU  HN          5.50    (#    484:10  Unique         4.61, 4.65 A)
 &rst
  ixpk= 484, nxpk= 10, iat=1568,1543, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  107 ALA  HN          106 GLU  HN          3.50    (#    485:10  Unique         2.73, 2.75 A)
 &rst
  ixpk= 485, nxpk= 10, iat=1558,1543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  103 ASP  HA          106 GLU  HN          5.50    (#    486:10  Unique         3.54, 3.64 A)
 &rst
  ixpk= 486, nxpk= 10, iat=1492,1543, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 THR  HB          106 GLU  HN          7.00    (#    487:10  Unique         5.54, 5.61 A)
 &rst
  ixpk= 487, nxpk= 10, iat= 809,1543, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:488    106 GLU  HN          5.50    (#    488:10  Single Ambig)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1330,1331,1526,
 &end
#
#  106 GLU  HA          106 GLU  HN          3.50    (#    489:10  Unique         2.76, 2.77 A)
 &rst
  ixpk= 489, nxpk= 10, iat=1545,1543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:490    106 GLU  HN          2.80    (#    490:10  Single Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1550,1551,1547,1548,
 &end
#
#  105 LEU  HB+         106 GLU  HN          3.50    (#    491:10  Unique         1.91, 2.62 A)
 &rst
  ixpk= 491, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1528,1529,
 &end
#
#  105 LEU  HB-         106 GLU  HN          4.50    (#    492:10  Unique         1.91, 2.62 A)
 &rst
  ixpk= 492, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1528,1529,
 &end
#
#    0 AMB  10-2:494    107 ALA  HN          5.50    (#    494:10  Single Ambig)
 &rst
  ixpk= 494, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1612,1613,1341,1342,
 &end
#
#   22 LEU  HN           21 HIS  HN          2.80    (#    497:10  Unique         2.85, 2.86 A)
 &rst
  ixpk= 497, nxpk= 10, iat= 294, 277, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:498     21 HIS  HN          3.50    (#    498:10  Single Ambig)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 262, 252,
 &end
#
#   21 HIS  HA           21 HIS  HN          3.50    (#    499:10  Unique         2.78, 2.78 A)
 &rst
  ixpk= 499, nxpk= 10, iat= 279, 277, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 GLU  HA           21 HIS  HN          5.50    (#    500:10  Unique         3.54, 3.56 A)
 &rst
  ixpk= 500, nxpk= 10, iat= 264, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 VAL  HA           21 HIS  HN          5.50    (#    501:10  Unique         3.61, 3.69 A)
 &rst
  ixpk= 501, nxpk= 10, iat= 238, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 HIS  HB+          21 HIS  HN          2.80    (#    502:10  Unique         2.41, 2.53 A)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 281, 282,
 &end
#
#   21 HIS  HB-          21 HIS  HN          2.80    (#    503:10  Unique         2.41, 2.53 A)
 &rst
  ixpk= 503, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 281, 282,
 &end
#
#   20 GLU  HB-          21 HIS  HN          2.80    (#    504:10  Unique         2.23, 2.88 A)
 &rst
  ixpk= 504, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 266, 267,
 &end
#
#   18 VAL  MGX          21 HIS  HN          7.00    (#    505:10  Unique         4.80, 6.20 A)
 &rst
  ixpk= 505, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#  144 ASN  HA          146 LEU  HN          5.50    (#    507:10  Unique         4.37, 4.72 A)
 &rst
  ixpk= 507, nxpk= 10, iat=2125,2156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  145 LEU  HN          146 LEU  HN          2.80    (#    508:10  Unique         2.58, 2.63 A)
 &rst
  ixpk= 508, nxpk= 10, iat=2137,2156, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  145 LEU  HA          146 LEU  HN          5.50    (#    509:10  Unique         3.54, 3.56 A)
 &rst
  ixpk= 509, nxpk= 10, iat=2139,2156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 LEU  HA          146 LEU  HN          3.50    (#    510:10  Unique         2.81, 2.83 A)
 &rst
  ixpk= 510, nxpk= 10, iat=2158,2156, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  143 VAL  HA          146 LEU  HN          4.50    (#    511:10  Unique         3.58, 3.68 A)
 &rst
  ixpk= 511, nxpk= 10, iat=2109,2156, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  146 LEU  HB-         146 LEU  HN          3.50    (#    512:10  Unique         2.22, 2.93 A)
 &rst
  ixpk= 512, nxpk= 10, iat=  -1,2156, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2160,2161,
 &end
#
#  146 LEU  HB+         146 LEU  HN          3.50    (#    513:10  Unique         2.22, 2.93 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1,2156, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2160,2161,
 &end
#
#  146 LEU  HG          146 LEU  HN          3.50    (#    514:10  Unique         2.72, 2.81 A)
 &rst
  ixpk= 514, nxpk= 10, iat=2163,2156, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  146 LEU  MDX         146 LEU  HN          4.50    (#    515:10  Unique         1.95, 4.42 A)
 &rst
  ixpk= 515, nxpk= 10, iat=  -1,2156, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   71 GLU  HN           73 LEU  HN          5.50    (#    516:10  Unique         4.09, 4.13 A)
 &rst
  ixpk= 516, nxpk= 10, iat=1016,1041, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:517     73 LEU  HN          4.50    (#    517:10  Single Ambig)
 &rst
  ixpk= 517, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1033, 977,
 &end
#
#    0 AMB  10-2:518     73 LEU  HN          3.50    (#    518:10  Single Ambig)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 997,1018,
 &end
#
#   73 LEU  HA           73 LEU  HN          3.50    (#    519:10  Unique         2.75, 2.75 A)
 &rst
  ixpk= 519, nxpk= 10, iat=1043,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 ALA  MB           73 LEU  HN          2.80    (#    520:10  Unique         2.58, 3.41 A)
 &rst
  ixpk= 520, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1035,1036,1037,
 &end
#
#   73 LEU  HG           73 LEU  HN          2.80    (#    521:10  Unique         2.51, 2.58 A)
 &rst
  ixpk= 521, nxpk= 10, iat=1048,1041, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   73 LEU  HB-          73 LEU  HN          3.50    (#    522:10  Unique         2.29, 2.94 A)
 &rst
  ixpk= 522, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1045,1046,
 &end
#
#   41 LEU  MDX          73 LEU  HN          4.50    (#    523:10  Unique         3.30, 4.60 A)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#   73 LEU  MDX          73 LEU  HN          4.50    (#    524:10  Unique         3.86, 4.51 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#   73 LEU  MDY          73 LEU  HN          4.50    (#    525:10  Unique         3.86, 4.51 A)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#   23 ALA  HN           22 LEU  HN          3.50    (#    526:10  Unique         2.96, 2.98 A)
 &rst
  ixpk= 526, nxpk= 10, iat= 313, 294, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 HIS  HN           22 LEU  HN          3.50    (#    527:10  Unique         2.85, 2.86 A)
 &rst
  ixpk= 527, nxpk= 10, iat= 277, 294, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 LEU  HG           22 LEU  HN          2.80    (#    528:10  Unique         2.73, 2.80 A)
 &rst
  ixpk= 528, nxpk= 10, iat= 301, 294, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   22 LEU  HB-          22 LEU  HN          3.50    (#    529:10  Unique         2.22, 2.88 A)
 &rst
  ixpk= 529, nxpk= 10, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 298, 299,
 &end
#
#   22 LEU  HB+          22 LEU  HN          4.50    (#    530:10  Unique         2.22, 2.88 A)
 &rst
  ixpk= 530, nxpk= 10, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 298, 299,
 &end
#
#    0 AMB  10-2:531     22 LEU  HN          4.50    (#    531:10  Single Ambig)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 303, 304, 305, 307, 308, 309, 369, 370, 371, 373,
       374, 375,
 &end
#
#   21 HIS  HA           22 LEU  HN          5.50    (#    532:10  Unique         3.56, 3.56 A)
 &rst
  ixpk= 532, nxpk= 10, iat= 279, 294, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 LEU  HA           22 LEU  HN          4.50    (#    533:10  Unique         2.75, 2.76 A)
 &rst
  ixpk= 533, nxpk= 10, iat= 296, 294, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 HIS  HB+          22 LEU  HN          4.50    (#    534:10  Unique         2.21, 3.07 A)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 281, 282,
 &end
#
#   18 VAL  MGY          22 LEU  HN          4.50    (#    535:10  Unique         3.25, 5.04 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#  146 LEU  HN          145 LEU  HN          2.80    (#    537:10  Unique         2.58, 2.63 A)
 &rst
  ixpk= 537, nxpk= 10, iat=2156,2137, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  144 ASN  HN          145 LEU  HN          3.50    (#    538:10  Unique         2.61, 2.64 A)
 &rst
  ixpk= 538, nxpk= 10, iat=2123,2137, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  144 ASN  HA          145 LEU  HN          4.50    (#    539:10  Unique         3.42, 3.43 A)
 &rst
  ixpk= 539, nxpk= 10, iat=2125,2137, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  145 LEU  HA          145 LEU  HN          3.50    (#    540:10  Unique         2.81, 2.86 A)
 &rst
  ixpk= 540, nxpk= 10, iat=2139,2137, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  147 LYS  HB+         145 LEU  HN          4.50    (#    541:10  Unique         4.49, 5.23 A)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2179,2180,
 &end
#
#  145 LEU  HB+         145 LEU  HN          2.80    (#    542:10  Unique         2.04, 2.69 A)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2141,2142,
 &end
#
#  145 LEU  MDX         145 LEU  HN          2.80    (#    543:10  Unique         2.68, 4.45 A)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2146,2147,2148,2150,2151,2152,
 &end
#
#  146 LEU  MDX         145 LEU  HN          7.00    (#    544:10  Unique         3.86, 6.34 A)
 &rst
  ixpk= 544, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   94 GLU  HN           95 TYR  HN          4.50    (#    545:10  Unique         1.90, 2.38 A)
 &rst
  ixpk= 545, nxpk= 10, iat=1361,1376, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   95 TYR  HA           95 TYR  HN          4.50    (#    547:10  Unique         2.79, 2.89 A)
 &rst
  ixpk= 547, nxpk= 10, iat=1378,1376, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   95 TYR  HB-          95 TYR  HN          5.50    (#    548:10  Unique         2.08, 2.72 A)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1,1376, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1380,1381,
 &end
#
#   95 TYR  HB+          95 TYR  HN          3.50    (#    549:10  Unique         2.08, 2.72 A)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1,1376, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1380,1381,
 &end
#
#   94 GLU  HB+          95 TYR  HN          3.50    (#    550:10  Unique         1.94, 3.00 A)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1,1376, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1365,1366,
 &end
#
#   41 LEU  HN           40 LEU  HN          4.50    (#    551:10  Unique         1.99, 2.03 A)
 &rst
  ixpk= 551, nxpk= 10, iat= 579, 560, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 LEU  HA           40 LEU  HN          3.50    (#    552:10  Unique         2.94, 2.95 A)
 &rst
  ixpk= 552, nxpk= 10, iat= 562, 560, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 PRO  HA           40 LEU  HN          3.50    (#    553:10  Unique         3.57, 3.57 A)
 &rst
  ixpk= 553, nxpk= 10, iat= 556, 560, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:554     40 LEU  HN          4.50    (#    554:10  Single Ambig)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 567, 583, 584,
 &end
#
#   40 LEU  HB-          40 LEU  HN          4.50    (#    555:10  Unique         2.45, 3.08 A)
 &rst
  ixpk= 555, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 564, 565,
 &end
#
#   40 LEU  HB+          40 LEU  HN          2.80    (#    556:10  Unique         2.45, 3.08 A)
 &rst
  ixpk= 556, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 564, 565,
 &end
#
#   40 LEU  MDX          40 LEU  HN          4.50    (#    557:10  Unique         4.55, 5.11 A)
 &rst
  ixpk= 557, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 569, 570, 571, 573, 574, 575,
 &end
#
#   26 LEU  HN           25 LYS  HN          3.50    (#    558:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 558, nxpk= 10, iat= 360, 338, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 GLU  HN           25 LYS  HN          3.50    (#    559:10  Unique         2.99, 3.02 A)
 &rst
  ixpk= 559, nxpk= 10, iat= 323, 338, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:560     25 LYS  HN          4.50    (#    560:10  Single Ambig)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 296, 315,
 &end
#
#   24 GLU  HB-          25 LYS  HN          3.50    (#    561:10  Unique         2.01, 2.82 A)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 327, 328,
 &end
#
#   24 GLU  HB+          25 LYS  HN          4.50    (#    562:10  Unique         2.01, 2.82 A)
 &rst
  ixpk= 562, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 327, 328,
 &end
#
#   25 LYS  HB+          25 LYS  HN          2.80    (#    563:10  Unique         2.70, 3.15 A)
 &rst
  ixpk= 563, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 342, 343,
 &end
#
#   25 LYS  HB-          25 LYS  HN          3.50    (#    564:10  Unique         2.70, 3.15 A)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 342, 343,
 &end
#
#   25 LYS  HG+          25 LYS  HN          3.50    (#    565:10  Unique         1.99, 2.77 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 345, 346,
 &end
#
#   25 LYS  HG-          25 LYS  HN          3.50    (#    566:10  Unique         1.99, 2.77 A)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 345, 346,
 &end
#
#    0 AMB  10-2:567     25 LYS  HN          7.00    (#    567:10  Single Ambig)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 369, 370, 371, 373, 374, 375, 303, 304, 305, 307,
       308, 309,
 &end
#
#   25 LYS  HD+          25 LYS  HN          4.50    (#    568:10  Unique         2.37, 3.04 A)
 &rst
  ixpk= 568, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 348, 349,
 &end
#
#   66 LEU  HA           67 SER  HN          5.50    (#    569:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 569, nxpk= 10, iat= 933, 950, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 THR  HA           67 SER  HN          2.80    (#    570:10  Unique         2.70, 2.84 A)
 &rst
  ixpk= 570, nxpk= 10, iat= 145, 950, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:571     67 SER  HN          2.80    (#    571:10  Single Ambig)
 &rst
  ixpk= 571, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 954, 955, 954, 955,
 &end
#
#   68 PRO  HD+          67 SER  HN          3.50    (#    572:10  Unique         1.73, 2.40 A)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 962, 963,
 &end
#
#   68 PRO  HD-          67 SER  HN          3.50    (#    573:10  Unique         1.73, 2.40 A)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 962, 963,
 &end
#
#   66 LEU  MDY          67 SER  HN          4.50    (#    574:10  Unique         2.72, 5.17 A)
 &rst
  ixpk= 574, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 940, 941, 942, 944, 945, 946,
 &end
#
#  119 GLU  HA          119 GLU  HN          3.50    (#    575:10  Unique         2.28, 2.85 A)
 &rst
  ixpk= 575, nxpk= 10, iat=1728,1726, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  118 GLY  HA-         119 GLU  HN          3.50    (#    576:10  Unique         2.14, 2.75 A)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1721,1722,
 &end
#
#  118 GLY  HA+         119 GLU  HN          3.50    (#    577:10  Unique         2.14, 2.75 A)
 &rst
  ixpk= 577, nxpk= 10, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1721,1722,
 &end
#
#  119 GLU  HG+         119 GLU  HN          2.80    (#    578:10  Unique         2.08, 3.06 A)
 &rst
  ixpk= 578, nxpk= 10, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1733,1734,
 &end
#
#  119 GLU  HB+         119 GLU  HN          4.50    (#    579:10  Unique         3.51, 3.69 A)
 &rst
  ixpk= 579, nxpk= 10, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1730,1731,
 &end
#
#  119 GLU  HB-         119 GLU  HN          4.50    (#    580:10  Unique         3.51, 3.69 A)
 &rst
  ixpk= 580, nxpk= 10, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1730,1731,
 &end
#
#   70 TYR  HN           71 GLU  HN          3.50    (#    581:10  Unique         2.80, 2.84 A)
 &rst
  ixpk= 581, nxpk= 10, iat= 995,1016, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:582     71 GLU  HN          3.50    (#    582:10  Single Ambig)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1031,1041,
 &end
#
#   70 TYR  HD           71 GLU  HN          4.50    (#    583:10  Unique         2.43, 3.59 A)
 &rst
  ixpk= 583, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1003,1012,
 &end
#
#   68 PRO  HA           71 GLU  HN          4.50    (#    584:10  Unique         3.72, 3.86 A)
 &rst
  ixpk= 584, nxpk= 10, iat= 971,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:585     71 GLU  HN          3.50    (#    585:10  Single Ambig)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1018, 997,
 &end
#
#   70 TYR  HB+          71 GLU  HN          4.50    (#    586:10  Unique         2.57, 3.53 A)
 &rst
  ixpk= 586, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 999,1000,
 &end
#
#   70 TYR  HB-          71 GLU  HN          4.50    (#    587:10  Unique         2.57, 3.53 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 999,1000,
 &end
#
#   71 GLU  HG+          71 GLU  HN          3.50    (#    588:10  Unique         2.95, 3.12 A)
 &rst
  ixpk= 588, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1023,1024,
 &end
#
#   71 GLU  HB+          71 GLU  HN          2.80    (#    589:10  Unique         2.24, 2.90 A)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1020,1021,
 &end
#
#  119 GLU  HN          118 GLY  HN          4.50    (#    590:10  Unique         2.34, 4.28 A)
 &rst
  ixpk= 590, nxpk= 10, iat=1726,1719, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 THR  HA          118 GLY  HN          2.80    (#    591:10  Unique         2.15, 2.18 A)
 &rst
  ixpk= 591, nxpk= 10, iat=1707,1719, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  117 THR  MG2         118 GLY  HN          2.80    (#    592:10  Unique         2.13, 3.39 A)
 &rst
  ixpk= 592, nxpk= 10, iat=  -1,1719, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1711,1712,1713,
 &end
#
#  109 LEU  HN          108 GLU  HN          2.80    (#    593:10  Unique         2.52, 2.57 A)
 &rst
  ixpk= 593, nxpk= 10, iat=1583,1568, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  107 ALA  HN          108 GLU  HN          2.80    (#    594:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 594, nxpk= 10, iat=1558,1568, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 GLN  HE2+        108 GLU  HN          5.50    (#    595:10  Unique         5.52, 5.94 A)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1072,1073,
 &end
#
#  108 GLU  HA          108 GLU  HN          3.50    (#    596:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 596, nxpk= 10, iat=1570,1568, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  108 GLU  HG+         108 GLU  HN          3.50    (#    597:10  Unique         2.56, 3.30 A)
 &rst
  ixpk= 597, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1575,1576,
 &end
#
#  108 GLU  HB-         108 GLU  HN          3.50    (#    598:10  Unique         2.26, 2.93 A)
 &rst
  ixpk= 598, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1572,1573,
 &end
#
#    0 AMB  10-2:599    108 GLU  HN          7.00    (#    599:10  Single Ambig)
 &rst
  ixpk= 599, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
 igr1=1609,1610,1045,1046,1119,1120,1531,
 &end
#
#  107 ALA  MB          108 GLU  HN          2.80    (#    600:10  Unique         2.65, 3.21 A)
 &rst
  ixpk= 600, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1562,1563,1564,
 &end
#
#   10 SER  HB-          10 SER  HN          4.50    (#    602:10  Unique         2.69, 3.25 A)
 &rst
  ixpk= 602, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 136, 137,
 &end
#
#   53 ILE  HA           54 SER  HN          2.80    (#    603:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 603, nxpk= 10, iat= 766, 783, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   54 SER  HB+          54 SER  HN          4.50    (#    604:10  Unique         2.82, 3.58 A)
 &rst
  ixpk= 604, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 788,
 &end
#
#   90 ILE  HG1+         54 SER  HN          3.50    (#    605:10  Unique         1.91, 2.72 A)
 &rst
  ixpk= 605, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1310,1311,
 &end
#
#    0 AMB  10-2:606     54 SER  HN          3.50    (#    606:10  Single Ambig)
 &rst
  ixpk= 606, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1313,1314,1315, 770, 771, 772,
 &end
#
#   85 PHE  HA           85 PHE  HN          3.50    (#    607:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 607, nxpk= 10, iat=1239,1237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   85 PHE  HB-          85 PHE  HN          4.50    (#    608:10  Unique         2.33, 2.91 A)
 &rst
  ixpk= 608, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1241,1242,
 &end
#
#  117 THR  HN           85 PHE  HN          3.50    (#    609:10  Unique         3.55, 3.58 A)
 &rst
  ixpk= 609, nxpk= 10, iat=1705,1237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  115 LYS  HN           85 PHE  HN          4.50    (#    610:10  Unique         2.78, 3.11 A)
 &rst
  ixpk= 610, nxpk= 10, iat=1666,1237, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 ARG  HA           85 PHE  HN          2.80    (#    612:10  Unique         2.33, 2.43 A)
 &rst
  ixpk= 612, nxpk= 10, iat=1215,1237, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:613     85 PHE  HN          3.50    (#    613:10  Single Ambig)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1241,1242,1690,
 &end
#
#   84 ARG  HB+          85 PHE  HN          2.80    (#    614:10  Unique         2.35, 3.15 A)
 &rst
  ixpk= 614, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1217,1218,
 &end
#
#    0 AMB  10-2:615     85 PHE  HN          4.50    (#    615:10  Single Ambig)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1217,1218,1220,1221,
 &end
#
#   20 GLU  HG+          20 GLU  HN          4.50    (#    617:10  Unique         3.84, 4.17 A)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 269, 270,
 &end
#
#   19 ALA  MB           20 GLU  HN          4.50    (#    618:10  Unique         2.01, 3.07 A)
 &rst
  ixpk= 618, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 256, 257, 258,
 &end
#
#    0 AMB  10-2:619     75 GLU  HN          7.00    (#    619:10  Single Ambig)
 &rst
  ixpk= 619, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1041,1031,
 &end
#
#    0 AMB  10-2:620     75 GLU  HN          4.50    (#    620:10  Single Ambig)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1062,1018,
 &end
#
#   75 GLU  HG-          75 GLU  HN          4.50    (#    621:10  Unique         4.40, 4.47 A)
 &rst
  ixpk= 621, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1084,1085,
 &end
#
#    0 AMB  10-2:622      0 AMB  10-1:622    2.80    (#    622:10  Double Ambig)
 &rst
  ixpk= 622, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 266, 267, 266, 267,1081,1082,1081,1082,
 igr2= 262,1077,
 &end
#
#   64 ASP  HN           65 ASN  HN          5.50    (#    623:10  Unique         1.82, 2.60 A)
 &rst
  ixpk= 623, nxpk= 10, iat= 905, 917, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 ASN  HB+          65 ASN  HN          4.50    (#    624:10  Unique         3.11, 3.36 A)
 &rst
  ixpk= 624, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 921, 922,
 &end
#
#   64 ASP  HB+          65 ASN  HN          4.50    (#    625:10  Unique         1.90, 2.96 A)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 909, 910,
 &end
#
#   78 PRO  HA           79 ASP  HN          2.80    (#    627:10  Unique         2.56, 2.61 A)
 &rst
  ixpk= 627, nxpk= 10, iat=1141,1145, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   79 ASP  HB+          79 ASP  HN          2.80    (#    628:10  Unique         2.64, 2.76 A)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1149,1150,
 &end
#
#   79 ASP  HB-          79 ASP  HN          2.80    (#    629:10  Unique         2.64, 2.76 A)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1149,1150,
 &end
#
#   78 PRO  HB+          79 ASP  HN          3.50    (#    630:10  Unique         2.06, 2.68 A)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1138,1139,
 &end
#
#   78 PRO  HG+          79 ASP  HN          4.50    (#    631:10  Unique         3.95, 4.37 A)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1135,1136,
 &end
#
#   78 PRO  HB-          79 ASP  HN          3.50    (#    632:10  Unique         2.06, 2.68 A)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1138,1139,
 &end
#
#   46 ALA  MB           79 ASP  HN          5.50    (#    633:10  Unique         3.88, 4.49 A)
 &rst
  ixpk= 633, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 662, 663, 664,
 &end
#
#  142 TRP  HB+         144 ASN  HN          7.00    (#    634:10  Unique         5.14, 5.71 A)
 &rst
  ixpk= 634, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2087,2088,
 &end
#
#  143 VAL  HN          144 ASN  HN          3.50    (#    636:10  Unique         2.73, 2.91 A)
 &rst
  ixpk= 636, nxpk= 10, iat=2107,2123, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  145 LEU  HN          144 ASN  HN          2.80    (#    637:10  Unique         2.61, 2.64 A)
 &rst
  ixpk= 637, nxpk= 10, iat=2137,2123, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:638    144 ASN  HN          4.50    (#    638:10  Single Ambig)
 &rst
  ixpk= 638, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=2156,2175, 438, 436, 440,
 &end
#
#  143 VAL  HA          144 ASN  HN          4.50    (#    639:10  Unique         3.57, 3.57 A)
 &rst
  ixpk= 639, nxpk= 10, iat=2109,2123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:640    144 ASN  HN          2.80    (#    640:10  Single Ambig)
 &rst
  ixpk= 640, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2127,2128,2127,2128,
 &end
#
#    0 AMB  10-2:641    144 ASN  HN          4.50    (#    641:10  Single Ambig)
 &rst
  ixpk= 641, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2185,2186,2160,2161,
 &end
#
#  144 ASN  HA          144 ASN  HN          2.80    (#    642:10  Unique         2.79, 2.81 A)
 &rst
  ixpk= 642, nxpk= 10, iat=2125,2123, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:643    144 ASN  HN          3.50    (#    643:10  Single Ambig)
 &rst
  ixpk= 643, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#  145 LEU  MDX         144 ASN  HN          4.50    (#    644:10  Unique         4.40, 6.42 A)
 &rst
  ixpk= 644, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2146,2147,2148,2150,2151,2152,
 &end
#
#   25 LYS  HN           24 GLU  HN          3.50    (#    645:10  Unique         2.99, 3.02 A)
 &rst
  ixpk= 645, nxpk= 10, iat= 338, 323, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 GLU  HA           24 GLU  HN          2.80    (#    646:10  Unique         2.77, 2.78 A)
 &rst
  ixpk= 646, nxpk= 10, iat= 325, 323, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   24 GLU  HB-          24 GLU  HN          2.80    (#    647:10  Unique         2.27, 2.53 A)
 &rst
  ixpk= 647, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 327, 328,
 &end
#
#   23 ALA  MB           24 GLU  HN          2.80    (#    648:10  Unique         2.50, 3.35 A)
 &rst
  ixpk= 648, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 317, 318, 319,
 &end
#
#    0 AMB  10-2:649     24 GLU  HN          5.50    (#    649:10  Single Ambig)
 &rst
  ixpk= 649, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 369, 370, 371, 373, 374, 375,  85,  86,  87,  89,
        90,  91,  85,  86,  87,  89,  90,  91,
 &end
#
#    5 THR  HN            4 ILE  HN          5.50    (#    650:10  Unique         4.33, 4.41 A)
 &rst
  ixpk= 650, nxpk= 10, iat=  62,  43, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    3 ASP  HN            4 ILE  HN          2.80    (#    651:10  Unique         1.93, 2.01 A)
 &rst
  ixpk= 651, nxpk= 10, iat=  31,  43, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    4 ILE  HA            4 ILE  HN          3.50    (#    652:10  Unique         2.95, 2.95 A)
 &rst
  ixpk= 652, nxpk= 10, iat=  45,  43, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 ASP  HA            4 ILE  HN          4.50    (#    653:10  Unique         3.40, 3.42 A)
 &rst
  ixpk= 653, nxpk= 10, iat=  33,  43, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 ASP  HB-           4 ILE  HN          3.50    (#    654:10  Unique         3.20, 3.52 A)
 &rst
  ixpk= 654, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  35,  36,
 &end
#
#    4 ILE  HB            4 ILE  HN          3.50    (#    655:10  Unique         2.64, 2.65 A)
 &rst
  ixpk= 655, nxpk= 10, iat=  47,  43, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:656      4 ILE  HN          4.50    (#    656:10  Single Ambig)
 &rst
  ixpk= 656, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=  49,  50,  51,  85,  86,  87,  89,  90,  91,
 &end
#
#    0 AMB  10-2:657      4 ILE  HN          5.50    (#    657:10  Single Ambig)
 &rst
  ixpk= 657, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  56,  57,  58, 738, 739, 740, 742, 743, 744,
 &end
#
#   33 THR  HA            4 ILE  HN          3.50    (#    659:10  Unique         2.40, 2.44 A)
 &rst
  ixpk= 659, nxpk= 10, iat= 462,  43, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 ASP  HB+           4 ILE  HN          4.50    (#    660:10  Unique         3.20, 3.52 A)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  35,  36,
 &end
#
#    0 AMB  10-2:661      4 ILE  HN          2.80    (#    661:10  Single Ambig)
 &rst
  ixpk= 661, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=  25,  26,  27,  53,  54,
 &end
#
#   55 SER  HA           91 GLY  HN          5.50    (#    664:10  Unique         3.04, 3.41 A)
 &rst
  ixpk= 664, nxpk= 10, iat= 796,1319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   90 ILE  HA           91 GLY  HN          2.80    (#    665:10  Unique         2.15, 2.22 A)
 &rst
  ixpk= 665, nxpk= 10, iat=1302,1319, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   91 GLY  HA+          91 GLY  HN          3.50    (#    666:10  Unique         2.30, 2.65 A)
 &rst
  ixpk= 666, nxpk= 10, iat=  -1,1319, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1321,1322,
 &end
#
#    0 AMB  10-2:667     91 GLY  HN          5.50    (#    667:10  Single Ambig)
 &rst
  ixpk= 667, nxpk= 10, iat=  -1,1319, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1310,1311,1268,1269,1270,
 &end
#
#   90 ILE  MG2          91 GLY  HN          3.50    (#    668:10  Unique         1.95, 3.25 A)
 &rst
  ixpk= 668, nxpk= 10, iat=  -1,1319, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1306,1307,1308,
 &end
#
#   75 GLU  HN           76 GLN  HN          2.80    (#    669:10  Unique         2.40, 2.41 A)
 &rst
  ixpk= 669, nxpk= 10, iat=1077,1092, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   78 PRO  HD+          76 GLN  HN          5.50    (#    670:10  Unique         4.20, 4.65 A)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1132,1133,
 &end
#
#   78 PRO  HD-          76 GLN  HN          5.50    (#    671:10  Unique         4.20, 4.65 A)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1132,1133,
 &end
#
#    0 AMB  10-2:672     76 GLN  HN          2.80    (#    672:10  Single Ambig)
 &rst
  ixpk= 672, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1099,1100,1099,1100,
 &end
#
#   75 GLU  HG+          76 GLN  HN          5.50    (#    673:10  Unique         3.59, 4.05 A)
 &rst
  ixpk= 673, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1084,1085,
 &end
#
#    0 AMB  10-2:674     76 GLN  HN          2.80    (#    674:10  Single Ambig)
 &rst
  ixpk= 674, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1081,1082,1096,1097,
 &end
#
#    0 AMB  10-2:675     76 GLN  HN          2.80    (#    675:10  Single Ambig)
 &rst
  ixpk= 675, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1081,1082,1096,1097,
 &end
#
#   55 SER  HA           56 THR  HN          3.50    (#    676:10  Unique         2.14, 2.14 A)
 &rst
  ixpk= 676, nxpk= 10, iat= 796, 805, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:677     56 THR  HN          4.50    (#    677:10  Single Ambig)
 &rst
  ixpk= 677, nxpk= 10, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1321,1322, 809,
 &end
#
#   92 SER  HB-          56 THR  HN          5.50    (#    678:10  Unique         4.36, 5.65 A)
 &rst
  ixpk= 678, nxpk= 10, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1330,1331,
 &end
#
#   73 LEU  MDX          74 GLN  HN          7.00    (#    679:10  Unique         4.63, 5.43 A)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#   75 GLU  HN           74 GLN  HN          2.80    (#    680:10  Unique         2.54, 2.55 A)
 &rst
  ixpk= 680, nxpk= 10, iat=1077,1060, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:681      0 AMB  10-1:681    2.80    (#    681:10  Double Ambig)
 &rst
  ixpk= 681, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2065,1041,
 igr2=2072,1060,
 &end
#
#    0 AMB  10-2:682      0 AMB  10-1:682    5.50    (#    682:10  Double Ambig)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2024,1033,
 igr2=2072,1060,
 &end
#
#    0 AMB  10-2:683      0 AMB  10-1:683    2.80    (#    683:10  Double Ambig)
 &rst
  ixpk= 683, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=2076,2077,2067,2068,1062,
 igr2=2072,1060,
 &end
#
#    0 AMB  10-2:684     74 GLN  HN          2.80    (#    684:10  Single Ambig)
 &rst
  ixpk= 684, nxpk= 10, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1067,1068,1064,1065,
 &end
#
#   74 GLN  HG+          74 GLN  HN          2.80    (#    685:10  Unique         2.19, 2.34 A)
 &rst
  ixpk= 685, nxpk= 10, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1067,1068,
 &end
#
#   73 LEU  HG           74 GLN  HN          4.50    (#    686:10  Unique         4.50, 4.55 A)
 &rst
  ixpk= 686, nxpk= 10, iat=1048,1060, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 LEU  HB-          74 GLN  HN          3.50    (#    687:10  Unique         2.35, 2.70 A)
 &rst
  ixpk= 687, nxpk= 10, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1045,1046,
 &end
#
#  141 SER  HA          141 SER  HN          3.50    (#    688:10  Unique         2.75, 2.75 A)
 &rst
  ixpk= 688, nxpk= 10, iat=2074,2072, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 LYS  HN          112 SER  HN          5.50    (#    689:10  Unique         3.74, 3.80 A)
 &rst
  ixpk= 689, nxpk= 10, iat=1602,1638, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ASN  HN          112 SER  HN          2.80    (#    690:10  Unique         2.54, 2.59 A)
 &rst
  ixpk= 690, nxpk= 10, iat=1624,1638, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  113 GLY  HN          112 SER  HN          2.80    (#    691:10  Unique         2.61, 2.61 A)
 &rst
  ixpk= 691, nxpk= 10, iat=1649,1638, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  112 SER  HA          112 SER  HN          2.80    (#    692:10  Unique         2.81, 2.81 A)
 &rst
  ixpk= 692, nxpk= 10, iat=1640,1638, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  112 SER  HB-         112 SER  HN          2.80    (#    693:10  Unique         2.32, 2.99 A)
 &rst
  ixpk= 693, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1642,1643,
 &end
#
#  109 LEU  HA          112 SER  HN          4.50    (#    694:10  Unique         3.78, 3.85 A)
 &rst
  ixpk= 694, nxpk= 10, iat=1585,1638, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  113 GLY  HA-         112 SER  HN          5.50    (#    695:10  Unique         5.03, 5.15 A)
 &rst
  ixpk= 695, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1651,1652,
 &end
#
#    0 AMB  10-2:696    112 SER  HN          3.50    (#    696:10  Single Ambig)
 &rst
  ixpk= 696, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1628,1629,1628,1629,
 &end
#
#    0 AMB  10-2:697    112 SER  HN          4.50    (#    697:10  Single Ambig)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1606,1607,1606,1607,1572,1573,
 &end
#
#   80 LEU  MDY         112 SER  HN          4.50    (#    698:10  Unique         4.69, 6.91 A)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   43 ASP  HN           42 GLU  HN          3.50    (#    699:10  Unique         3.11, 3.18 A)
 &rst
  ixpk= 699, nxpk= 10, iat= 613, 598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:700     42 GLU  HN          4.50    (#    700:10  Single Ambig)
 &rst
  ixpk= 700, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 615, 562,
 &end
#
#   42 GLU  HA           42 GLU  HN          3.50    (#    701:10  Unique         2.75, 2.75 A)
 &rst
  ixpk= 701, nxpk= 10, iat= 600, 598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 LEU  HA           42 GLU  HN          5.50    (#    702:10  Unique         3.22, 3.24 A)
 &rst
  ixpk= 702, nxpk= 10, iat= 581, 598, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:703     42 GLU  HN          2.80    (#    703:10  Single Ambig)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 605, 606, 605, 606,
 &end
#
#   42 GLU  HB+          42 GLU  HN          4.50    (#    704:10  Unique         3.73, 3.90 A)
 &rst
  ixpk= 704, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 602, 603,
 &end
#
#    0 AMB  10-2:705     42 GLU  HN          4.50    (#    705:10  Single Ambig)
 &rst
  ixpk= 705, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 583, 584, 567,
 &end
#
#   40 LEU  HB-          42 GLU  HN          4.50    (#    706:10  Unique         2.96, 3.16 A)
 &rst
  ixpk= 706, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 564, 565,
 &end
#
#    0 AMB  10-2:707     42 GLU  HN          3.50    (#    707:10  Single Ambig)
 &rst
  ixpk= 707, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 564, 565, 583, 584,
 &end
#
#   40 LEU  MDX          42 GLU  HN          4.50    (#    708:10  Unique         4.88, 5.92 A)
 &rst
  ixpk= 708, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 569, 570, 571, 573, 574, 575,
 &end
#
#   91 GLY  HA-          92 SER  HN          5.50    (#    709:10  Unique         2.39, 3.03 A)
 &rst
  ixpk= 709, nxpk= 10, iat=  -1,1326, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1321,1322,
 &end
#
#   91 GLY  HA+          92 SER  HN          5.50    (#    710:10  Unique         2.39, 3.03 A)
 &rst
  ixpk= 710, nxpk= 10, iat=  -1,1326, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1321,1322,
 &end
#
#   76 GLN  HN           77 LYS  HN          2.80    (#    711:10  Unique         2.30, 2.31 A)
 &rst
  ixpk= 711, nxpk= 10, iat=1092,1109, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 GLU  HN           77 LYS  HN          5.50    (#    712:10  Unique         3.70, 3.74 A)
 &rst
  ixpk= 712, nxpk= 10, iat=1077,1109, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 LYS  HA           77 LYS  HN          2.80    (#    713:10  Unique         2.29, 2.30 A)
 &rst
  ixpk= 713, nxpk= 10, iat=1111,1109, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   78 PRO  HD+          77 LYS  HN          3.50    (#    714:10  Unique         2.65, 2.87 A)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1132,1133,
 &end
#
#   73 LEU  HA           77 LYS  HN          5.50    (#    715:10  Unique         3.24, 3.37 A)
 &rst
  ixpk= 715, nxpk= 10, iat=1043,1109, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 PRO  HD-          77 LYS  HN          3.50    (#    716:10  Unique         2.65, 2.87 A)
 &rst
  ixpk= 716, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1132,1133,
 &end
#
#    0 AMB  10-2:717     77 LYS  HN          4.50    (#    717:10  Single Ambig)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1096,1097,1135,1136,
 &end
#
#   77 LYS  HB+          77 LYS  HN          3.50    (#    718:10  Unique         3.19, 3.60 A)
 &rst
  ixpk= 718, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1113,1114,
 &end
#
#   77 LYS  HG-          77 LYS  HN          3.50    (#    719:10  Unique         3.03, 3.23 A)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1116,1117,
 &end
#
#   83 VAL  HN           81 SER  HN          5.50    (#    720:10  Unique         3.88, 4.00 A)
 &rst
  ixpk= 720, nxpk= 10, iat=1197,1176, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 SER  HA           81 SER  HN          2.80    (#    722:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 722, nxpk= 10, iat=1178,1176, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   80 LEU  HB-          81 SER  HN          4.50    (#    723:10  Unique         4.04, 4.32 A)
 &rst
  ixpk= 723, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1161,1162,
 &end
#
#    0 AMB  10-2:724     81 SER  HN          2.80    (#    724:10  Single Ambig)
 &rst
  ixpk= 724, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1187,1157,
 &end
#
#   80 LEU  HA           81 SER  HN          3.50    (#    725:10  Unique         2.53, 2.74 A)
 &rst
  ixpk= 725, nxpk= 10, iat=1159,1176, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:726     81 SER  HN          2.80    (#    726:10  Single Ambig)
 &rst
  ixpk= 726, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1180,1181,1180,1181,
 &end
#
#   58 GLY  HA-          58 GLY  HN          4.50    (#    728:10  Unique         2.31, 2.70 A)
 &rst
  ixpk= 728, nxpk= 10, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 838, 839,
 &end
#
#   37 HIS  HA           38 GLY  HN          2.80    (#    730:10  Unique         2.78, 2.90 A)
 &rst
  ixpk= 730, nxpk= 10, iat= 524, 539, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   38 GLY  HA+          38 GLY  HN          3.50    (#    731:10  Unique         2.30, 2.60 A)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 541, 542,
 &end
#
#   38 GLY  HA-          38 GLY  HN          3.50    (#    732:10  Unique         2.30, 2.60 A)
 &rst
  ixpk= 732, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 541, 542,
 &end
#
#  141 SER  HA          144 ASN  HD2+        5.50    (#    735:10  Unique         2.20, 2.95 A)
 &rst
  ixpk= 735, nxpk= 10, iat=2074,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2132,2133,
 &end
#
#    0 AMB  10-2:736      0 AMB  10-1:736    2.80    (#    736:10  Double Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=2127,2128,2127,2128,
 igr2=2132,2133,2132,2133,
 &end
#
#  143 VAL  MGX         144 ASN  HD2+        5.50    (#    737:10  Unique         4.63, 6.65 A)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2113,2114,2115,2117,2118,2119,
 igr2=2132,2133,
 &end
#
#    0 AMB  10-2:739    144 ASN  HD2-        3.50    (#    739:10  Single Ambig)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2127,2128,2127,2128,
 igr2=2132,2133,
 &end
#
#  121 LEU  HN           89 GLY  HN          4.50    (#    740:10  Unique         2.82, 3.26 A)
 &rst
  ixpk= 740, nxpk= 10, iat=1755,1293, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 GLY  HA+          89 GLY  HN          3.50    (#    741:10  Unique         2.30, 2.58 A)
 &rst
  ixpk= 741, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1295,1296,
 &end
#
#   88 ILE  HA           89 GLY  HN          2.80    (#    742:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 742, nxpk= 10, iat=1276,1293, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   88 ILE  MG2          89 GLY  HN          3.50    (#    744:10  Unique         2.55, 3.95 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1280,1281,1282,
 &end
#
#    4 ILE  HN           32 THR  HN          7.00    (#    745:10  Unique         4.33, 4.37 A)
 &rst
  ixpk= 745, nxpk= 10, iat=  43, 446, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  131 PRO  HG+         124 ASN  HD2-        3.50    (#    748:10  Unique         1.93, 3.05 A)
 &rst
  ixpk= 748, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1931,1932,
 igr2=1824,1825,
 &end
#
#    3 ASP  HN           32 THR  HN          4.50    (#    749:10  Unique         3.18, 3.39 A)
 &rst
  ixpk= 749, nxpk= 10, iat=  31, 446, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 THR  HN           32 THR  HN          5.50    (#    750:10  Unique         4.53, 4.54 A)
 &rst
  ixpk= 750, nxpk= 10, iat= 460, 446, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 PHE  HN           32 THR  HN          5.50    (#    751:10  Unique         4.45, 4.45 A)
 &rst
  ixpk= 751, nxpk= 10, iat= 426, 446, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 PHE  HA           32 THR  HN          2.80    (#    753:10  Unique         2.53, 2.53 A)
 &rst
  ixpk= 753, nxpk= 10, iat= 428, 446, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   32 THR  HA           32 THR  HN          3.50    (#    754:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 754, nxpk= 10, iat= 448, 446, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:755     32 THR  HN          4.50    (#    755:10  Single Ambig)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 450,  33,
 &end
#
#    3 ASP  HB+          32 THR  HN          2.80    (#    756:10  Unique         2.75, 2.92 A)
 &rst
  ixpk= 756, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  35,  36,
 &end
#
#    0 AMB  10-2:757     32 THR  HN          2.80    (#    757:10  Single Ambig)
 &rst
  ixpk= 757, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 430, 431,  35,  36,
 &end
#
#   31 PHE  HB-          32 THR  HN          4.50    (#    758:10  Unique         2.26, 2.70 A)
 &rst
  ixpk= 758, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 430, 431,
 &end
#
#   32 THR  MG2          32 THR  HN          3.50    (#    759:10  Unique         3.07, 3.81 A)
 &rst
  ixpk= 759, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 452, 453, 454,
 &end
#
#  108 GLU  HA          111 ASN  HD2-        3.50    (#    761:10  Unique         1.94, 2.73 A)
 &rst
  ixpk= 761, nxpk= 10, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1633,1634,
 &end
#
#  111 ASN  HB-         111 ASN  HD2-        3.50    (#    762:10  Unique         2.19, 3.29 A)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1628,1629,
 igr2=1633,1634,
 &end
#
#    0 AMB  10-2:764      0 AMB  10-1:764    3.50    (#    764:10  Double Ambig)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1628,1629,1628,1629,
 igr2=1633,1634,1633,1634,
 &end
#
#    0 AMB  10-2:765      0 AMB  10-1:765    7.00    (#    765:10  Double Ambig)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1=1572,1573,1575,1576,
 igr2=1633,1634,1633,1634,
 &end
#
#  107 ALA  MB          111 ASN  HD2+        5.50    (#    766:10  Unique         5.50, 7.12 A)
 &rst
  ixpk= 766, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1562,1563,1564,
 igr2=1633,1634,
 &end
#
#    0 AMB  10-2:767      0 AMB  10-1:767    3.50    (#    767:10  Double Ambig)
 &rst
  ixpk= 767, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1099,1100,1099,1100,
 igr2=1104,1105,1104,1105,
 &end
#
#    0 AMB  10-2:768      0 AMB  10-1:768    5.50    (#    768:10  Double Ambig)
 &rst
  ixpk= 768, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 605, 606,1084,1085,
 igr2=1104,1105,1104,1105,
 &end
#
#   41 LEU  HB+          76 GLN  HE2+        5.50    (#    769:10  Unique         3.09, 3.66 A)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 583, 584,
 igr2=1104,1105,
 &end
#
#   72 ALA  MB           76 GLN  HE2+        3.50    (#    770:10  Unique         1.94, 3.18 A)
 &rst
  ixpk= 770, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1035,1036,1037,
 igr2=1104,1105,
 &end
#
#   41 LEU  MDX          76 GLN  HE2+        4.50    (#    771:10  Unique         2.12, 3.85 A)
 &rst
  ixpk= 771, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 588, 589, 590, 592, 593, 594,
 igr2=1104,1105,
 &end
#
#    0 AMB  10-2:772    143 VAL  HN          4.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2102,2100,
 &end
#
#  144 ASN  HN          143 VAL  HN          3.50    (#    773:10  Unique         2.73, 2.91 A)
 &rst
  ixpk= 773, nxpk= 10, iat=2123,2107, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  142 TRP  HA          143 VAL  HN          5.50    (#    774:10  Unique         3.54, 3.56 A)
 &rst
  ixpk= 774, nxpk= 10, iat=2085,2107, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  143 VAL  HA          143 VAL  HN          3.50    (#    775:10  Unique         2.75, 2.78 A)
 &rst
  ixpk= 775, nxpk= 10, iat=2109,2107, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  142 TRP  HB+         143 VAL  HN          4.50    (#    776:10  Unique         2.37, 3.18 A)
 &rst
  ixpk= 776, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2087,2088,
 &end
#
#  143 VAL  HB          143 VAL  HN          2.80    (#    777:10  Unique         2.30, 2.36 A)
 &rst
  ixpk= 777, nxpk= 10, iat=2111,2107, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:778    143 VAL  HN          5.50    (#    778:10  Single Ambig)
 &rst
  ixpk= 778, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2050,2051,2053,
 &end
#
#  142 TRP  HB-         143 VAL  HN          3.50    (#    779:10  Unique         2.37, 3.18 A)
 &rst
  ixpk= 779, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2087,2088,
 &end
#
#    0 AMB  10-2:780    143 VAL  HN          2.80    (#    780:10  Single Ambig)
 &rst
  ixpk= 780, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#    0 AMB  10-2:781    143 VAL  HN          5.50    (#    781:10  Single Ambig)
 &rst
  ixpk= 781, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1=2146,2147,2148,2150,2151,2152,1764,1765,1766,1768,
      1769,1770, 369, 370, 371, 373, 374, 375,1711,1712,
      1713,
 &end
#
#   97 THR  HA           97 THR  HN          5.50    (#    782:10  Unique         2.29, 2.83 A)
 &rst
  ixpk= 782, nxpk= 10, iat=1411,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 THR  MG2          97 THR  HN          5.50    (#    783:10  Unique         2.06, 3.44 A)
 &rst
  ixpk= 783, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1415,1416,1417,
 &end
#
#    0 AMB  10-2:785      0 AMB  10-1:785    4.50    (#    785:10  Double Ambig)
 &rst
  ixpk= 785, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1067,1068,1064,1065,
 igr2=1072,1073,1072,1073,
 &end
#
#    0 AMB  10-2:787     74 GLN  HE2-        4.50    (#    787:10  Single Ambig)
 &rst
  ixpk= 787, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1067,1068,1064,1065,
 igr2=1072,1073,
 &end
#
#    0 AMB  10-2:788     74 GLN  HE2-        3.50    (#    788:10  Single Ambig)
 &rst
  ixpk= 788, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1067,1068,1064,1065,
 igr2=1072,1073,
 &end
#
#   12 LEU  HA           13 GLY  HN          4.50    (#    789:10  Unique         2.28, 2.59 A)
 &rst
  ixpk= 789, nxpk= 10, iat= 159, 176, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 THR  HA           33 THR  HN          2.80    (#    791:10  Unique         2.24, 2.25 A)
 &rst
  ixpk= 791, nxpk= 10, iat= 448, 460, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   32 THR  HB           33 THR  HN          2.80    (#    792:10  Unique         2.81, 2.83 A)
 &rst
  ixpk= 792, nxpk= 10, iat= 450, 460, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:793     33 THR  HN          4.50    (#    793:10  Single Ambig)
 &rst
  ixpk= 793, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 386, 387, 386, 387,
 &end
#
#   32 THR  MG2          33 THR  HN          3.50    (#    794:10  Unique         3.72, 4.43 A)
 &rst
  ixpk= 794, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 452, 453, 454,
 &end
#
#   33 THR  MG2          33 THR  HN          2.80    (#    795:10  Unique         3.01, 3.54 A)
 &rst
  ixpk= 795, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 466, 467, 468,
 &end
#
#   33 THR  HA           33 THR  HN          3.50    (#    796:10  Unique         2.93, 2.93 A)
 &rst
  ixpk= 796, nxpk= 10, iat= 462, 460, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 TRP  HE1          47 SER  HN          4.50    (#    797:10  Unique         2.97, 3.18 A)
 &rst
  ixpk= 797, nxpk= 10, iat= 715, 668, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ALA  HN           47 SER  HN          3.50    (#    798:10  Unique         3.33, 3.35 A)
 &rst
  ixpk= 798, nxpk= 10, iat= 658, 668, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   46 ALA  HA           47 SER  HN          2.80    (#    799:10  Unique         2.67, 2.69 A)
 &rst
  ixpk= 799, nxpk= 10, iat= 660, 668, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   47 SER  HA           47 SER  HN          2.80    (#    800:10  Unique         2.87, 2.88 A)
 &rst
  ixpk= 800, nxpk= 10, iat= 670, 668, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:801     47 SER  HN          3.50    (#    801:10  Single Ambig)
 &rst
  ixpk= 801, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 672, 673, 672, 673,
 &end
#
#   45 PRO  HB-          47 SER  HN          5.50    (#    802:10  Unique         3.51, 4.24 A)
 &rst
  ixpk= 802, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 651, 652,
 &end
#
#    0 AMB  10-2:803     47 SER  HN          4.50    (#    803:10  Single Ambig)
 &rst
  ixpk= 803, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 662, 663, 664,1164,
 &end
#
#   83 VAL  MGX          47 SER  HN          3.50    (#    804:10  Unique         3.34, 4.49 A)
 &rst
  ixpk= 804, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  10-2:807    116 GLN  HE2-        3.50    (#    807:10  Single Ambig)
 &rst
  ixpk= 807, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1344,1345,1695,1696,
 igr2=1700,1701,
 &end
#
#  116 GLN  HG-         116 GLN  HE2-        4.50    (#    808:10  Unique         2.25, 3.09 A)
 &rst
  ixpk= 808, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1695,1696,
 igr2=1700,1701,
 &end
#
#  119 GLU  HA          116 GLN  HE2+        4.50    (#    811:10  Unique         3.41, 4.15 A)
 &rst
  ixpk= 811, nxpk= 10, iat=1728,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1700,1701,
 &end
#
#  120 THR  HA          116 GLN  HE2+        5.50    (#    812:10  Unique         2.18, 3.13 A)
 &rst
  ixpk= 812, nxpk= 10, iat=1743,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1700,1701,
 &end
#
#   87 ALA  MB          116 GLN  HE2+        3.50    (#    813:10  Unique         1.95, 3.34 A)
 &rst
  ixpk= 813, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1268,1269,1270,
 igr2=1700,1701,
 &end
#
#   65 ASN  HB+          65 ASN  HD2+        3.50    (#    815:10  Unique         2.43, 3.49 A)
 &rst
  ixpk= 815, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 921, 922,
 igr2= 926, 927,
 &end
#
#   50 TRP  HN           86 GLY  HN          5.50    (#    816:10  Unique         4.19, 4.41 A)
 &rst
  ixpk= 816, nxpk= 10, iat= 705,1257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   85 PHE  HA           86 GLY  HN          2.80    (#    817:10  Unique         2.19, 2.27 A)
 &rst
  ixpk= 817, nxpk= 10, iat=1239,1257, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   51 LEU  HA           86 GLY  HN          3.50    (#    819:10  Unique         2.87, 3.10 A)
 &rst
  ixpk= 819, nxpk= 10, iat= 731,1257, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:820     86 GLY  HN          2.80    (#    820:10  Single Ambig)
 &rst
  ixpk= 820, nxpk= 10, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1259,1260,1241,1242,
 &end
#
#   85 PHE  HB-          86 GLY  HN          4.50    (#    821:10  Unique         2.93, 3.78 A)
 &rst
  ixpk= 821, nxpk= 10, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1241,1242,
 &end
#
#    0 AMB  10-2:822     86 GLY  HN          5.50    (#    822:10  Single Ambig)
 &rst
  ixpk= 822, nxpk= 10, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 692, 693, 694,  49,  50,  51,
 &end
#
#   51 LEU  MDY          86 GLY  HN          4.50    (#    823:10  Unique         3.69, 5.88 A)
 &rst
  ixpk= 823, nxpk= 10, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  10-2:824    113 GLY  HN          4.50    (#    824:10  Single Ambig)
 &rst
  ixpk= 824, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1624,1157,
 &end
#
#    0 AMB  10-2:825    113 GLY  HN          2.80    (#    825:10  Single Ambig)
 &rst
  ixpk= 825, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1656,1638,
 &end
#
#    0 AMB  10-2:826    113 GLY  HN          3.50    (#    826:10  Single Ambig)
 &rst
  ixpk= 826, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1640,1658,
 &end
#
#    0 AMB  10-2:827    113 GLY  HN          3.50    (#    827:10  Single Ambig)
 &rst
  ixpk= 827, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1626,1604,
 &end
#
#  112 SER  HB+         113 GLY  HN          5.50    (#    828:10  Unique         3.90, 4.03 A)
 &rst
  ixpk= 828, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1642,1643,
 &end
#
#  113 GLY  HA+         113 GLY  HN          2.80    (#    829:10  Unique         2.57, 2.77 A)
 &rst
  ixpk= 829, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1651,1652,
 &end
#
#  114 ALA  MB          113 GLY  HN          4.50    (#    830:10  Unique         4.21, 5.03 A)
 &rst
  ixpk= 830, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1660,1661,1662,
 &end
#
#   47 SER  HN           48 GLY  HN          5.50    (#    831:10  Unique         3.91, 3.99 A)
 &rst
  ixpk= 831, nxpk= 10, iat= 668, 679, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLY  HA+          48 GLY  HN          2.80    (#    832:10  Unique         2.53, 2.75 A)
 &rst
  ixpk= 832, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 681, 682,
 &end
#
#    0 AMB  10-2:833     48 GLY  HN          2.80    (#    833:10  Single Ambig)
 &rst
  ixpk= 833, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1199, 670,
 &end
#
#   48 GLY  HA-          48 GLY  HN          2.80    (#    834:10  Unique         2.53, 2.75 A)
 &rst
  ixpk= 834, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 681, 682,
 &end
#
#   83 VAL  HB           48 GLY  HN          4.50    (#    835:10  Unique         2.22, 2.44 A)
 &rst
  ixpk= 835, nxpk= 10, iat=1201, 679, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ALA  MB           48 GLY  HN          4.50    (#    836:10  Unique         3.69, 5.23 A)
 &rst
  ixpk= 836, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1191,1192,1193,
 &end
#
#    0 AMB  10-2:837     48 GLY  HN          5.50    (#    837:10  Single Ambig)
 &rst
  ixpk= 837, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 699, 700, 701, 696, 697,1166,1167,1168,1170,1171,
      1172,
 &end
#
#   83 VAL  MGX          48 GLY  HN          4.50    (#    838:10  Unique         2.98, 4.28 A)
 &rst
  ixpk= 838, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   99 CYS  HA          100 GLY  HN          3.50    (#    843:10  Unique         2.15, 2.36 A)
 &rst
  ixpk= 843, nxpk= 10, iat=1445,1454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 GLY  HA-         100 GLY  HN          3.50    (#    844:10  Unique         2.29, 2.66 A)
 &rst
  ixpk= 844, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1456,1457,
 &end
#
#  100 GLY  HA+         100 GLY  HN          3.50    (#    845:10  Unique         2.29, 2.66 A)
 &rst
  ixpk= 845, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1456,1457,
 &end
#
#   60 GLY  HA+          60 GLY  HN          4.50    (#    847:10  Unique         2.29, 2.56 A)
 &rst
  ixpk= 847, nxpk= 10, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 855, 856,
 &end
#
#   60 GLY  HA-          60 GLY  HN          4.50    (#    848:10  Unique         2.29, 2.56 A)
 &rst
  ixpk= 848, nxpk= 10, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 855, 856,
 &end
#
#   29 ALA  HN           30 GLY  HN          2.80    (#    849:10  Unique         2.60, 2.64 A)
 &rst
  ixpk= 849, nxpk= 10, iat= 409, 419, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:850     30 GLY  HN          4.50    (#    850:10  Single Ambig)
 &rst
  ixpk= 850, nxpk= 10, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 381, 428,
 &end
#
#   29 ALA  HA           30 GLY  HN          3.50    (#    851:10  Unique         3.48, 3.48 A)
 &rst
  ixpk= 851, nxpk= 10, iat= 411, 419, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:852     30 GLY  HN          2.80    (#    852:10  Single Ambig)
 &rst
  ixpk= 852, nxpk= 10, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 421, 422, 396,
 &end
#
#   30 GLY  HA-          30 GLY  HN          2.80    (#    853:10  Unique         2.59, 2.77 A)
 &rst
  ixpk= 853, nxpk= 10, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 421, 422,
 &end
#
#   29 ALA  MB           30 GLY  HN          3.50    (#    854:10  Unique         2.92, 3.65 A)
 &rst
  ixpk= 854, nxpk= 10, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 413, 414, 415,
 &end
#
#  139 LEU  HN          140 GLY  HN          3.50    (#    856:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 856, nxpk= 10, iat=2046,2065, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  141 SER  HN          140 GLY  HN          3.50    (#    857:10  Unique         2.92, 2.96 A)
 &rst
  ixpk= 857, nxpk= 10, iat=2072,2065, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  140 GLY  HA+         140 GLY  HN          2.80    (#    858:10  Unique         2.29, 2.56 A)
 &rst
  ixpk= 858, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2067,2068,
 &end
#
#  140 GLY  HA-         140 GLY  HN          2.80    (#    859:10  Unique         2.29, 2.56 A)
 &rst
  ixpk= 859, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2067,2068,
 &end
#
#  139 LEU  HB+         140 GLY  HN          4.50    (#    860:10  Unique         2.58, 2.90 A)
 &rst
  ixpk= 860, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2050,2051,
 &end
#
#  139 LEU  HB-         140 GLY  HN          3.50    (#    861:10  Unique         2.58, 2.90 A)
 &rst
  ixpk= 861, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2050,2051,
 &end
#
#    0 AMB  10-2:862    121 LEU  HN          4.50    (#    862:10  Single Ambig)
 &rst
  ixpk= 862, nxpk= 10, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1268,1269,1270,1310,1311,
 &end
#
#   88 ILE  HA          121 LEU  HN          4.50    (#    863:10  Unique         2.13, 2.63 A)
 &rst
  ixpk= 863, nxpk= 10, iat=1276,1755, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  120 THR  HN          121 LEU  HN          5.50    (#    864:10  Unique         4.27, 4.51 A)
 &rst
  ixpk= 864, nxpk= 10, iat=1741,1755, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   89 GLY  HN          121 LEU  HN          5.50    (#    865:10  Unique         2.82, 3.26 A)
 &rst
  ixpk= 865, nxpk= 10, iat=1293,1755, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HB-         121 LEU  HN          3.50    (#    866:10  Unique         2.05, 2.62 A)
 &rst
  ixpk= 866, nxpk= 10, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1759,1760,
 &end
#
#    0 AMB  10-2:867    121 LEU  HN          4.50    (#    867:10  Single Ambig)
 &rst
  ixpk= 867, nxpk= 10, iat=  -1,1755, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1762,1280,1281,1282,
 &end
#
#    7 ILE  HN            6 LEU  HN          5.50    (#    868:10  Unique         4.24, 4.28 A)
 &rst
  ixpk= 868, nxpk= 10, iat=  95,  76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 LEU  HN            6 LEU  HN          5.50    (#    869:10  Unique         5.08, 5.11 A)
 &rst
  ixpk= 869, nxpk= 10, iat= 729,  76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 THR  HA            6 LEU  HN          4.50    (#    870:10  Unique         4.09, 4.19 A)
 &rst
  ixpk= 870, nxpk= 10, iat= 491,  76, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:871      6 LEU  HN          5.50    (#    871:10  Single Ambig)
 &rst
  ixpk= 871, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  83, 317, 318, 319,
 &end
#
#   36 LEU  MDY           6 LEU  HN          3.50    (#    872:10  Unique         2.24, 3.85 A)
 &rst
  ixpk= 872, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#   84 ARG  HN           50 TRP  HN          5.50    (#    873:10  Unique         3.55, 3.84 A)
 &rst
  ixpk= 873, nxpk= 10, iat=1213, 705, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 TRP  HA           50 TRP  HN          4.50    (#    874:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 874, nxpk= 10, iat= 707, 705, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 THR  MG2          36 LEU  HN          2.80    (#    875:10  Unique         2.33, 3.40 A)
 &rst
  ixpk= 875, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 495, 496, 497,
 &end
#
#    8 SER  HN           36 LEU  HN          5.50    (#    876:10  Unique         3.93, 4.03 A)
 &rst
  ixpk= 876, nxpk= 10, iat= 114, 503, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    6 LEU  HN           36 LEU  HN          4.50    (#    877:10  Unique         4.32, 4.38 A)
 &rst
  ixpk= 877, nxpk= 10, iat=  76, 503, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ILE  MG2          36 LEU  HN          7.00    (#    878:10  Unique         6.49, 7.32 A)
 &rst
  ixpk= 878, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 101, 102, 103,
 &end
#
#    0 AMB  10-2:879     36 LEU  HN          7.00    (#    879:10  Single Ambig)
 &rst
  ixpk= 879, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 493, 254,
 &end
#
#  113 GLY  HA+          80 LEU  HN          5.50    (#    881:10  Unique         2.33, 3.20 A)
 &rst
  ixpk= 881, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1651,1652,
 &end
#
#   79 ASP  HB+          80 LEU  HN          5.50    (#    882:10  Unique         4.28, 4.44 A)
 &rst
  ixpk= 882, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1149,1150,
 &end
#
#   80 LEU  HB+          80 LEU  HN          3.50    (#    883:10  Unique         2.47, 3.09 A)
 &rst
  ixpk= 883, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1161,1162,
 &end
#
#   49 ILE  HA           84 ARG  HN          3.50    (#    885:10  Unique         2.78, 3.15 A)
 &rst
  ixpk= 885, nxpk= 10, iat= 688,1213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ILE  MG2          84 ARG  HN          5.50    (#    886:10  Unique         4.23, 5.36 A)
 &rst
  ixpk= 886, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 692, 693, 694,
 &end
#
#   51 LEU  HB-          52 VAL  HN          5.50    (#    887:10  Unique         3.26, 3.85 A)
 &rst
  ixpk= 887, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   53 ILE  HN           52 VAL  HN          5.50    (#    888:10  Unique         4.39, 4.45 A)
 &rst
  ixpk= 888, nxpk= 10, iat= 764, 748, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:889    116 GLN  HN          4.50    (#    889:10  Single Ambig)
 &rst
  ixpk= 889, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1695,1696,1673,1674,
 &end
#
#  110 LYS  HB-         116 GLN  HN          5.50    (#    890:10  Unique         3.51, 4.51 A)
 &rst
  ixpk= 890, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1606,1607,
 &end
#
#  116 GLN  HE2-        116 GLN  HN          7.00    (#    891:10  Unique         6.30, 6.64 A)
 &rst
  ixpk= 891, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1700,1701,
 &end
#
#  117 THR  HN          116 GLN  HN          4.50    (#    892:10  Unique         4.42, 4.47 A)
 &rst
  ixpk= 892, nxpk= 10, iat=1705,1688, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 LEU  HN          138 TRP  HE1         5.50    (#    896:10  Unique         4.45, 4.86 A)
 &rst
  ixpk= 896, nxpk= 10, iat=1755,2032, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  119 GLU  HN          138 TRP  HE1         4.50    (#    897:10  Unique         2.72, 4.11 A)
 &rst
  ixpk= 897, nxpk= 10, iat=1726,2032, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:898    138 TRP  HE1         4.50    (#    898:10  Single Ambig)
 &rst
  ixpk= 898, nxpk= 10, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1757,1721,1722,
 &end
#
#  119 GLU  HB-         138 TRP  HE1         5.50    (#    899:10  Unique         2.00, 3.55 A)
 &rst
  ixpk= 899, nxpk= 10, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1730,1731,
 &end
#
#  119 GLU  HG+         138 TRP  HE1         7.00    (#    900:10  Unique         2.08, 2.59 A)
 &rst
  ixpk= 900, nxpk= 10, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1733,1734,
 &end
#
#    8 SER  HA           53 ILE  HN          5.50    (#    901:10  Unique         3.24, 3.45 A)
 &rst
  ixpk= 901, nxpk= 10, iat= 116, 764, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 VAL  MGY          53 ILE  HN          3.50    (#    902:10  Unique         2.05, 3.93 A)
 &rst
  ixpk= 902, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 754, 755, 756, 758, 759, 760,
 &end
#
#    0 AMB  10-2:903     53 ILE  HN          3.50    (#    903:10  Single Ambig)
 &rst
  ixpk= 903, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 777, 778, 779, 774, 775,
 &end
#
#    0 AMB  10-2:904     53 ILE  HN          5.50    (#    904:10  Single Ambig)
 &rst
  ixpk= 904, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 101, 102, 103,1287,1288,1289,
 &end
#
#    0 AMB  10-2:905    142 TRP  HN          5.50    (#    905:10  Single Ambig)
 &rst
  ixpk= 905, nxpk= 10, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=2102,2041,2030,2039,2156,2035,2037,
 &end
#
#    0 AMB  10-2:906    142 TRP  HN          5.50    (#    906:10  Single Ambig)
 &rst
  ixpk= 906, nxpk= 10, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1764,1765,1766,1768,1769,1770,2113,2114,2115,2117,
      2118,2119,2113,2114,2115,2117,2118,2119,2055,2056,
      2057,2059,2060,2061,
 &end
#
#    0 AMB  10-2:907    142 TRP  HN          5.50    (#    907:10  Single Ambig)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2146,2147,2148,2150,2151,2152,1764,1765,1766,1768,
      1769,1770,
 &end
#
#   58 GLY  HA+          59 ALA  HN          2.80    (#    908:10  Unique         2.28, 3.04 A)
 &rst
  ixpk= 908, nxpk= 10, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 838, 839,
 &end
#
#   59 ALA  HA           59 ALA  HN          4.50    (#    909:10  Unique         2.28, 2.81 A)
 &rst
  ixpk= 909, nxpk= 10, iat= 845, 843, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 GLY  HN           59 ALA  HN          5.50    (#    910:10  Unique         1.89, 2.30 A)
 &rst
  ixpk= 910, nxpk= 10, iat= 853, 843, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:911    117 THR  HN          3.50    (#    911:10  Single Ambig)
 &rst
  ixpk= 911, nxpk= 10, iat=  -1,1705, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1237,1688,
 &end
#
#  121 LEU  HG          122 LYS  HN          5.50    (#    912:10  Unique         2.45, 3.31 A)
 &rst
  ixpk= 912, nxpk= 10, iat=1762,1774, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  MDY         122 LYS  HN          3.50    (#    913:10  Unique         2.83, 5.00 A)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#  122 LYS  HG+         122 LYS  HN          4.50    (#    914:10  Unique         1.94, 2.95 A)
 &rst
  ixpk= 914, nxpk= 10, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1781,1782,
 &end
#
#   89 GLY  HN          122 LYS  HN          5.50    (#    915:10  Unique         3.76, 4.00 A)
 &rst
  ixpk= 915, nxpk= 10, iat=1293,1774, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:916     84 ARG  HE          5.50    (#    916:10  Single Ambig)
 &rst
  ixpk= 916, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2165,2166,2167,2169,2170,2171,1203,1204,1205,1207,
      1208,1209,
 &end
#
#    0 AMB  10-2:917     84 ARG  HE          7.00    (#    917:10  Single Ambig)
 &rst
  ixpk= 917, nxpk= 10, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1721,1722,1199,
 &end
#
#    0 AMB  10-2:920      5 THR  HN          5.50    (#    920:10  Single Ambig)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 738, 739, 740, 742, 743, 744,  56,  57,  58, 105,
       106,
 &end
#
#    0 AMB  10-2:921      5 THR  HN          5.50    (#    921:10  Single Ambig)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 629, 630,  53,  54,
 &end
#
#    5 THR  MG2           5 THR  HN          3.50    (#    922:10  Unique         1.95, 2.93 A)
 &rst
  ixpk= 922, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  68,  69,  70,
 &end
#
#    0 AMB  10-2:923      5 THR  HN          5.50    (#    923:10  Single Ambig)
 &rst
  ixpk= 923, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  47, 696, 697,
 &end
#
#   49 ILE  HB            5 THR  HN          5.50    (#    924:10  Unique         4.01, 4.16 A)
 &rst
  ixpk= 924, nxpk= 10, iat= 690,  62, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 TRP  HD1           5 THR  HN          4.50    (#    925:10  Unique         4.00, 4.11 A)
 &rst
  ixpk= 925, nxpk= 10, iat= 713,  62, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    4 ILE  HN            5 THR  HN          5.50    (#    926:10  Unique         4.33, 4.41 A)
 &rst
  ixpk= 926, nxpk= 10, iat=  43,  62, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 LEU  HN            5 THR  HN          5.50    (#    927:10  Unique         3.55, 3.63 A)
 &rst
  ixpk= 927, nxpk= 10, iat= 729,  62, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:928      5 THR  HN          5.50    (#    928:10  Single Ambig)
 &rst
  ixpk= 928, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=  76,1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  10-2:929     51 LEU  HN          5.50    (#    929:10  Single Ambig)
 &rst
  ixpk= 929, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 105, 106, 754, 755, 756, 758, 759, 760,
 &end
#
#   51 LEU  MDX          51 LEU  HN          7.00    (#    930:10  Unique         3.73, 4.64 A)
 &rst
  ixpk= 930, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 738, 739, 740, 742, 743, 744,
 &end
#
#    0 AMB  10-2:931     51 LEU  HN          7.00    (#    931:10  Single Ambig)
 &rst
  ixpk= 931, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1=  99,  80,  81, 774, 775,
 &end
#
#    6 LEU  HG           51 LEU  HN          7.00    (#    932:10  Unique         6.50, 6.58 A)
 &rst
  ixpk= 932, nxpk= 10, iat=  83, 729, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   50 TRP  HB+          51 LEU  HN          5.50    (#    933:10  Unique         3.68, 4.09 A)
 &rst
  ixpk= 933, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 709, 710,
 &end
#
#    5 THR  HB           51 LEU  HN          5.50    (#    934:10  Unique         5.06, 5.13 A)
 &rst
  ixpk= 934, nxpk= 10, iat=  66, 729, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 VAL  HN           51 LEU  HN          5.50    (#    936:10  Unique         4.29, 4.36 A)
 &rst
  ixpk= 936, nxpk= 10, iat= 748, 729, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 ILE  HN           51 LEU  HN          4.50    (#    937:10  Unique         4.17, 4.28 A)
 &rst
  ixpk= 937, nxpk= 10, iat=  95, 729, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  MDX          46 ALA  HN          7.00    (#    938:10  Unique         4.75, 6.43 A)
 &rst
  ixpk= 938, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   89 GLY  HA-         124 ASN  HN          7.00    (#    939:10  Unique         6.22, 6.72 A)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1295,1296,
 &end
#
#  129 ASP  HB+         124 ASN  HN          7.00    (#    940:10  Unique         5.23, 6.10 A)
 &rst
  ixpk= 940, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1900,1901,
 &end
#
#   87 ALA  MB          120 THR  HN          5.50    (#    941:10  Unique         4.45, 5.65 A)
 &rst
  ixpk= 941, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1268,1269,1270,
 &end
#
#  120 THR  HA          120 THR  HN          3.50    (#    942:10  Unique         2.74, 2.76 A)
 &rst
  ixpk= 942, nxpk= 10, iat=1743,1741, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:943    120 THR  HN          4.50    (#    943:10  Single Ambig)
 &rst
  ixpk= 943, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1350,1700,1701,
 &end
#
#    0 AMB  10-2:944    120 THR  HN          7.00    (#    944:10  Single Ambig)
 &rst
  ixpk= 944, nxpk= 10, iat=  -1,1741, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1755,1361,
 &end
#
#    0 AMB  10-2:947     50 TRP  HE1         7.00    (#    947:10  Single Ambig)
 &rst
  ixpk= 947, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 686, 679,
 &end
#
#   46 ALA  HA           50 TRP  HE1         7.00    (#    948:10  Unique         3.31, 3.37 A)
 &rst
  ixpk= 948, nxpk= 10, iat= 660, 715, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   45 PRO  HD-          50 TRP  HE1         7.00    (#    949:10  Unique         4.72, 5.37 A)
 &rst
  ixpk= 949, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 645, 646,
 &end
#
#   45 PRO  HG-          50 TRP  HE1         7.00    (#    950:10  Unique         5.05, 5.82 A)
 &rst
  ixpk= 950, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 648, 649,
 &end
#
#    0 AMB  10-2:951     50 TRP  HE1         5.50    (#    951:10  Single Ambig)
 &rst
  ixpk= 951, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 648, 649, 690,
 &end
#
#    0 AMB  10-2:952     50 TRP  HE1         7.00    (#    952:10  Single Ambig)
 &rst
  ixpk= 952, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 662, 663, 664, 632,
 &end
#
#    0 AMB  10-2:953     50 TRP  HE1         5.50    (#    953:10  Single Ambig)
 &rst
  ixpk= 953, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=  68,  69,  70,1166,1167,1168,1170,1171,1172,1166,
      1167,1168,1170,1171,1172,
 &end
#
#   44 LEU  MDX          50 TRP  HE1         7.00    (#    954:10  Unique         4.74, 6.18 A)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#    0 AMB  10-2:955     50 TRP  HE1         7.00    (#    955:10  Single Ambig)
 &rst
  ixpk= 955, nxpk= 10, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 654, 681, 682,
 &end
#
#    0 AMB  10-2:956      7 ILE  HN          4.50    (#    956:10  Single Ambig)
 &rst
  ixpk= 956, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 101, 102, 103,1287,1288,1289,
 &end
#
#    7 ILE  HG1-          7 ILE  HN          4.50    (#    957:10  Unique         1.99, 2.63 A)
 &rst
  ixpk= 957, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 105, 106,
 &end
#
#   53 ILE  MD1           7 ILE  HN          5.50    (#    958:10  Unique         2.71, 3.62 A)
 &rst
  ixpk= 958, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 777, 778, 779,
 &end
#
#    0 AMB  10-2:959      7 ILE  HN          5.50    (#    959:10  Single Ambig)
 &rst
  ixpk= 959, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=  68,  69,  70, 754, 755, 756, 758, 759, 760, 512,
       513, 514, 516, 517, 518,
 &end
#
#    6 LEU  HB+           7 ILE  HN          5.50    (#    960:10  Unique         3.47, 4.05 A)
 &rst
  ixpk= 960, nxpk= 10, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  80,  81,
 &end
#
#   51 LEU  HN            7 ILE  HN          4.50    (#    961:10  Unique         4.17, 4.28 A)
 &rst
  ixpk= 961, nxpk= 10, iat= 729,  95, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 LEU  HN            7 ILE  HN          7.00    (#    962:10  Unique         4.24, 4.28 A)
 &rst
  ixpk= 962, nxpk= 10, iat=  76,  95, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   87 ALA  HA           87 ALA  HN          4.50    (#    965:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 965, nxpk= 10, iat=1266,1264, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  116 GLN  HE2+         87 ALA  HN          4.50    (#    966:10  Unique         2.58, 3.44 A)
 &rst
  ixpk= 966, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1700,1701,
 &end
#
#    0 AMB  10-2:967     87 ALA  HN          7.00    (#    967:10  Single Ambig)
 &rst
  ixpk= 967, nxpk= 10, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1257,1741,
 &end
#
#   88 ILE  HN           87 ALA  HN          5.50    (#    968:10  Unique         4.42, 4.51 A)
 &rst
  ixpk= 968, nxpk= 10, iat=1274,1264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:969    123 ILE  HN          3.50    (#    969:10  Single Ambig)
 &rst
  ixpk= 969, nxpk= 10, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1802,1803,1804,1764,1765,1766,1768,1769,1770,
 &end
#
#  123 ILE  HG1+        123 ILE  HN          5.50    (#    970:10  Unique         2.03, 2.96 A)
 &rst
  ixpk= 970, nxpk= 10, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1806,1807,
 &end
#
#  123 ILE  HA          123 ILE  HN          4.50    (#    971:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 971, nxpk= 10, iat=1798,1796, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 GLY  HN          123 ILE  HN          4.50    (#    972:10  Unique         3.68, 3.93 A)
 &rst
  ixpk= 972, nxpk= 10, iat=1293,1796, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  146 LEU  MDX         147 LYS  HN          5.50    (#    973:10  Unique         3.16, 4.32 A)
 &rst
  ixpk= 973, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#    0 AMB  10-2:974    147 LYS  HN          7.00    (#    974:10  Single Ambig)
 &rst
  ixpk= 974, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#  145 LEU  HA          147 LYS  HN          5.50    (#    975:10  Unique         4.24, 4.33 A)
 &rst
  ixpk= 975, nxpk= 10, iat=2139,2175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 ASN  HA          147 LYS  HN          5.50    (#    976:10  Unique         3.18, 3.53 A)
 &rst
  ixpk= 976, nxpk= 10, iat=2125,2175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  145 LEU  HN          147 LYS  HN          5.50    (#    977:10  Unique         3.66, 3.72 A)
 &rst
  ixpk= 977, nxpk= 10, iat=2137,2175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 SER  HN           82 ALA  HN          3.50    (#    978:10  Unique         2.39, 2.50 A)
 &rst
  ixpk= 978, nxpk= 10, iat=1176,1187, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HB-          82 ALA  HN          5.50    (#    979:10  Unique         3.94, 4.61 A)
 &rst
  ixpk= 979, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1161,1162,
 &end
#
#   80 LEU  MDX          82 ALA  HN          5.50    (#    980:10  Unique         4.28, 6.14 A)
 &rst
  ixpk= 980, nxpk= 10, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   98 PHE  HB-          98 PHE  HN          7.00    (#    981:10  Unique         2.09, 2.76 A)
 &rst
  ixpk= 981, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1427,1428,
 &end
#
#   98 PHE  HB+          98 PHE  HN          5.50    (#    982:10  Unique         2.09, 2.76 A)
 &rst
  ixpk= 982, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1427,1428,
 &end
#
#    0 AMB  10-2:983     41 LEU  HN          5.50    (#    983:10  Single Ambig)
 &rst
  ixpk= 983, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 588, 589, 590, 592, 593, 594, 512, 513, 514, 516,
       517, 518,
 &end
#
#   41 LEU  MDY          41 LEU  HN          5.50    (#    984:10  Unique         3.75, 5.37 A)
 &rst
  ixpk= 984, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#   41 LEU  HA           41 LEU  HN          3.50    (#    985:10  Unique         2.28, 2.28 A)
 &rst
  ixpk= 985, nxpk= 10, iat= 581, 579, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 PHE  HA           41 LEU  HN          7.00    (#    986:10  Unique         6.70, 6.88 A)
 &rst
  ixpk= 986, nxpk= 10, iat= 977, 579, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:987     41 LEU  HN          7.00    (#    987:10  Single Ambig)
 &rst
  ixpk= 987, nxpk= 10, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 613,1104,1105,
 &end
#
#   40 LEU  HN           41 LEU  HN          7.00    (#    989:10  Unique         1.99, 2.03 A)
 &rst
  ixpk= 989, nxpk= 10, iat= 560, 579, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  139 LEU  MDY          26 LEU  HN          4.50    (#    990:10  Unique         3.26, 4.99 A)
 &rst
  ixpk= 990, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#    0 AMB  10-2:991     26 LEU  HN          7.00    (#    991:10  Single Ambig)
 &rst
  ixpk= 991, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1= 348, 349, 317, 318, 319,
 &end
#
#   25 LYS  HB-          26 LEU  HN          4.50    (#    992:10  Unique         2.24, 2.91 A)
 &rst
  ixpk= 992, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 342, 343,
 &end
#
#   27 GLU  HG+          26 LEU  HN          7.00    (#    993:10  Unique         5.28, 5.79 A)
 &rst
  ixpk= 993, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 386, 387,
 &end
#
#   28 GLU  HN           26 LEU  HN          5.50    (#    994:10  Unique         4.10, 4.26 A)
 &rst
  ixpk= 994, nxpk= 10, iat= 394, 360, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 LYS  HG+          26 LEU  HN          7.00    (#    996:10  Unique         3.85, 4.28 A)
 &rst
  ixpk= 996, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 345, 346,
 &end
#
#    0 AMB  10-2:998    132 GLU  HN          4.50    (#    998:10  Single Ambig)
 &rst
  ixpk= 998, nxpk= 10, iat=  -1,1941, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1931,1932,1934,1935,
 &end
#
#  131 PRO  HB-         132 GLU  HN          5.50    (#    999:10  Unique         2.03, 3.26 A)
 &rst
  ixpk= 999, nxpk= 10, iat=  -1,1941, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1934,1935,
 &end
#
#   36 LEU  MDY          37 HIS  HN          4.50    (#   1000:10  Unique         4.81, 5.75 A)
 &rst
  ixpk= 1000, nxpk= 10, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#    0 AMB  10-2:1001    37 HIS  HN          5.50    (#   1001:10  Single Ambig)
 &rst
  ixpk= 1001, nxpk= 10, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 512, 513, 514, 516, 517, 518, 495, 496, 497,
 &end
#
#   83 VAL  MGY          83 VAL  HN          4.50    (#   1002:10  Unique         1.91, 3.77 A)
 &rst
  ixpk= 1002, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    0 AMB  10-2:1003    83 VAL  HN          7.00    (#   1003:10  Single Ambig)
 &rst
  ixpk= 1003, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1220,1221,1220,1221,1217,1218,
 &end
#
#   80 LEU  HB+          83 VAL  HN          5.50    (#   1004:10  Unique         3.24, 4.06 A)
 &rst
  ixpk= 1004, nxpk= 10, iat=  -1,1197, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1161,1162,
 &end
#
#  109 LEU  HB-         114 ALA  HN          7.00    (#   1005:10  Unique         6.10, 6.66 A)
 &rst
  ixpk= 1005, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1587,1588,
 &end
#
#   80 LEU  HG          114 ALA  HN          7.00    (#   1006:10  Unique         3.79, 3.90 A)
 &rst
  ixpk= 1006, nxpk= 10, iat=1164,1656, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  113 GLY  HA-         114 ALA  HN          4.50    (#   1007:10  Unique         2.86, 3.21 A)
 &rst
  ixpk= 1007, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1651,1652,
 &end
#
#    0 AMB  10-2:1008   114 ALA  HN          5.50    (#   1008:10  Single Ambig)
 &rst
  ixpk= 1008, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1642,1643,1180,1181,
 &end
#
#  112 SER  HB+         114 ALA  HN          7.00    (#   1009:10  Unique         4.33, 4.56 A)
 &rst
  ixpk= 1009, nxpk= 10, iat=  -1,1656, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1642,1643,
 &end
#
#  110 LYS  HA          114 ALA  HN          4.50    (#   1010:10  Unique         3.82, 3.94 A)
 &rst
  ixpk= 1010, nxpk= 10, iat=1604,1656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1013    28 GLU  HN          4.50    (#   1013:10  Single Ambig)
 &rst
  ixpk= 1013, nxpk= 10, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 413, 414, 415, 342, 343,
 &end
#
#   25 LYS  HD+          28 GLU  HN          5.50    (#   1014:10  Unique         5.11, 6.08 A)
 &rst
  ixpk= 1014, nxpk= 10, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 348, 349,
 &end
#
#   30 GLY  HN           28 GLU  HN          5.50    (#   1015:10  Unique         4.40, 4.47 A)
 &rst
  ixpk= 1015, nxpk= 10, iat= 419, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 LEU  HN           28 GLU  HN          4.50    (#   1016:10  Unique         4.10, 4.26 A)
 &rst
  ixpk= 1016, nxpk= 10, iat= 360, 394, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1017    23 ALA  HN          3.50    (#   1017:10  Single Ambig)
 &rst
  ixpk= 1017, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  85,  86,  87,  89,  90,  91, 369, 370, 371, 373,
       374, 375,
 &end
#
#   22 LEU  HB+          23 ALA  HN          3.50    (#   1018:10  Unique         2.42, 2.69 A)
 &rst
  ixpk= 1018, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 298, 299,
 &end
#
#    0 AMB  10-2:1019    23 ALA  HN          7.00    (#   1019:10  Single Ambig)
 &rst
  ixpk= 1019, nxpk= 10, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1= 256, 257, 258, 774, 775,
 &end
#
#    4 ILE  MG2           3 ASP  HN          5.50    (#   1021:10  Unique         6.18, 6.54 A)
 &rst
  ixpk= 1021, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  49,  50,  51,
 &end
#
#    4 ILE  HG1-          3 ASP  HN          5.50    (#   1022:10  Unique         4.05, 4.82 A)
 &rst
  ixpk= 1022, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  53,  54,
 &end
#
#   66 LEU  MDX          69 PHE  HN          5.50    (#   1023:10  Unique         2.28, 5.30 A)
 &rst
  ixpk= 1023, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 940, 941, 942, 944, 945, 946,
 &end
#
#   66 LEU  MDY          69 PHE  HN          5.50    (#   1024:10  Unique         2.28, 5.30 A)
 &rst
  ixpk= 1024, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 940, 941, 942, 944, 945, 946,
 &end
#
#   68 PRO  HB+          69 PHE  HN          4.50    (#   1025:10  Unique         3.02, 3.57 A)
 &rst
  ixpk= 1025, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 968, 969,
 &end
#
#   68 PRO  HD-          69 PHE  HN          4.50    (#   1026:10  Unique         2.65, 3.26 A)
 &rst
  ixpk= 1026, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 962, 963,
 &end
#
#    0 AMB  10-2:1027    69 PHE  HN          5.50    (#   1027:10  Single Ambig)
 &rst
  ixpk= 1027, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 971, 145,
 &end
#
#   71 GLU  HN           69 PHE  HN          5.50    (#   1028:10  Unique         4.10, 4.16 A)
 &rst
  ixpk= 1028, nxpk= 10, iat=1016, 975, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  109 LEU  MDY         109 LEU  HN          4.50    (#   1029:10  Unique         2.95, 4.29 A)
 &rst
  ixpk= 1029, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#  109 LEU  MDX         109 LEU  HN          4.50    (#   1030:10  Unique         2.95, 4.29 A)
 &rst
  ixpk= 1030, nxpk= 10, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#  108 GLU  HA          109 LEU  HN          5.50    (#   1031:10  Unique         3.50, 3.52 A)
 &rst
  ixpk= 1031, nxpk= 10, iat=1570,1583, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 LEU  MDX          72 ALA  HN          5.50    (#   1033:10  Unique         5.70, 6.79 A)
 &rst
  ixpk= 1033, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#   41 LEU  MDY          72 ALA  HN          7.00    (#   1034:10  Unique         3.72, 5.31 A)
 &rst
  ixpk= 1034, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#   73 LEU  HB-          72 ALA  HN          7.00    (#   1035:10  Unique         4.46, 5.34 A)
 &rst
  ixpk= 1035, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1045,1046,
 &end
#
#    0 AMB  10-2:1036    72 ALA  HN          7.00    (#   1036:10  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1023,1024,1084,1085,
 &end
#
#    0 AMB  10-2:1037    72 ALA  HN          5.50    (#   1037:10  Single Ambig)
 &rst
  ixpk= 1037, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 999,1000, 979, 980,
 &end
#
#   68 PRO  HA           72 ALA  HN          5.50    (#   1038:10  Unique         3.48, 3.71 A)
 &rst
  ixpk= 1038, nxpk= 10, iat= 971,1031, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  107 ALA  MB          111 ASN  HN          5.50    (#   1041:10  Unique         5.12, 5.72 A)
 &rst
  ixpk= 1041, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1562,1563,1564,
 &end
#
#    0 AMB  10-2:1042   111 ASN  HN          5.50    (#   1042:10  Single Ambig)
 &rst
  ixpk= 1042, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1612,1613,1612,1613,
 &end
#
#  110 LYS  HG+         111 ASN  HN          5.50    (#   1043:10  Unique         4.06, 4.57 A)
 &rst
  ixpk= 1043, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1609,1610,
 &end
#
#  109 LEU  HB+         111 ASN  HN          7.00    (#   1044:10  Unique         4.81, 5.24 A)
 &rst
  ixpk= 1044, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1587,1588,
 &end
#
#  107 ALA  HA          111 ASN  HN          7.00    (#   1045:10  Unique         4.13, 4.17 A)
 &rst
  ixpk= 1045, nxpk= 10, iat=1560,1624, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1046   111 ASN  HN          7.00    (#   1046:10  Single Ambig)
 &rst
  ixpk= 1046, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1585,1545,
 &end
#
#    0 AMB  10-2:1047   111 ASN  HN          5.50    (#   1047:10  Single Ambig)
 &rst
  ixpk= 1047, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1640,1668,
 &end
#
#  111 ASN  HD2-        111 ASN  HN          5.50    (#   1048:10  Unique         3.54, 4.31 A)
 &rst
  ixpk= 1048, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1633,1634,
 &end
#
#    0 AMB  10-2:1049   111 ASN  HN          5.50    (#   1049:10  Single Ambig)
 &rst
  ixpk= 1049, nxpk= 10, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1649,1568,
 &end
#
#    0 AMB  10-2:1053    27 GLU  HN          5.50    (#   1053:10  Single Ambig)
 &rst
  ixpk= 1053, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 367,2053,
 &end
#
#   24 GLU  HA           27 GLU  HN          4.50    (#   1054:10  Unique         3.70, 3.75 A)
 &rst
  ixpk= 1054, nxpk= 10, iat= 325, 379, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1055    27 GLU  HN          4.50    (#   1055:10  Single Ambig)
 &rst
  ixpk= 1055, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 362, 340,
 &end
#
#  139 LEU  HB+         139 LEU  HN          3.50    (#   1057:10  Unique         2.05, 2.70 A)
 &rst
  ixpk= 1057, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2050,2051,
 &end
#
#  139 LEU  MDX         139 LEU  HN          5.50    (#   1058:10  Unique         1.96, 4.29 A)
 &rst
  ixpk= 1058, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#  139 LEU  MDY         139 LEU  HN          4.50    (#   1059:10  Unique         1.96, 4.29 A)
 &rst
  ixpk= 1059, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#  121 LEU  MDX         139 LEU  HN          5.50    (#   1060:10  Unique         3.16, 4.89 A)
 &rst
  ixpk= 1060, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1764,1765,1766,1768,1769,1770,
 &end
#
#  121 LEU  HG          139 LEU  HN          5.50    (#   1061:10  Unique         3.84, 4.19 A)
 &rst
  ixpk= 1061, nxpk= 10, iat=1762,2046, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1062   139 LEU  HN          5.50    (#   1062:10  Single Ambig)
 &rst
  ixpk= 1062, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1996,1997,2011,2012,
 &end
#
#    0 AMB  10-2:1063   139 LEU  HN          4.50    (#   1063:10  Single Ambig)
 &rst
  ixpk= 1063, nxpk= 10, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2041,2102,2030,
 &end
#
#  128 HIS  HB-         129 ASP  HN          4.50    (#   1065:10  Unique         2.20, 3.74 A)
 &rst
  ixpk= 1065, nxpk= 10, iat=  -1,1896, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1883,1884,
 &end
#
#  129 ASP  HA          129 ASP  HN          2.80    (#   1066:10  Unique         2.76, 2.85 A)
 &rst
  ixpk= 1066, nxpk= 10, iat=1898,1896, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    4 ILE  HG1-         49 ILE  HN          5.50    (#   1068:10  Unique         3.32, 4.13 A)
 &rst
  ixpk= 1068, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  53,  54,
 &end
#
#   49 ILE  HG1-         49 ILE  HN          2.80    (#   1069:10  Unique         2.41, 3.33 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 696, 697,
 &end
#
#    0 AMB  10-2:1070    49 ILE  HN          7.00    (#   1070:10  Single Ambig)
 &rst
  ixpk= 1070, nxpk= 10, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1213,  43,
 &end
#
#    5 THR  HN           49 ILE  HN          5.50    (#   1071:10  Unique         3.99, 4.07 A)
 &rst
  ixpk= 1071, nxpk= 10, iat=  62, 686, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1072    34 GLU  HN          5.50    (#   1072:10  Single Ambig)
 &rst
  ixpk= 1072, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 512, 513, 514, 516, 517, 518,  68,  69,  70,
 &end
#
#    0 AMB  10-2:1073    34 GLU  HN          4.50    (#   1073:10  Single Ambig)
 &rst
  ixpk= 1073, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 466, 467, 468, 733, 734,
 &end
#
#   34 GLU  HG+          34 GLU  HN          7.00    (#   1074:10  Unique         4.42, 4.47 A)
 &rst
  ixpk= 1074, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 481, 482,
 &end
#
#   34 GLU  HA           34 GLU  HN          3.50    (#   1075:10  Unique         2.95, 2.95 A)
 &rst
  ixpk= 1075, nxpk= 10, iat= 476, 474, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 ILE  HN           34 GLU  HN          4.50    (#   1076:10  Unique         3.98, 4.01 A)
 &rst
  ixpk= 1076, nxpk= 10, iat=  43, 474, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1077    34 GLU  HN          4.50    (#   1077:10  Single Ambig)
 &rst
  ixpk= 1077, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 489,  31,
 &end
#
#    0 AMB  10-2:1079    34 GLU  HN          5.50    (#   1079:10  Single Ambig)
 &rst
  ixpk= 1079, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  62, 503,
 &end
#
#   18 VAL  MGX          19 ALA  HN          5.50    (#   1080:10  Unique         2.15, 4.05 A)
 &rst
  ixpk= 1080, nxpk= 10, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#   19 ALA  HA           19 ALA  HN          4.50    (#   1081:10  Unique         2.78, 2.80 A)
 &rst
  ixpk= 1081, nxpk= 10, iat= 254, 252, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1083    94 GLU  HN          5.50    (#   1083:10  Single Ambig)
 &rst
  ixpk= 1083, nxpk= 10, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1341,1342,1368,1369,
 &end
#
#   94 GLU  HA           94 GLU  HN          5.50    (#   1084:10  Unique         2.76, 2.84 A)
 &rst
  ixpk= 1084, nxpk= 10, iat=1363,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   95 TYR  HN           94 GLU  HN          5.50    (#   1085:10  Unique         1.90, 2.38 A)
 &rst
  ixpk= 1085, nxpk= 10, iat=1376,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 LEU  MDY          44 LEU  HN          3.50    (#   1086:10  Unique         3.61, 4.70 A)
 &rst
  ixpk= 1086, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#   36 LEU  MDX          44 LEU  HN          7.00    (#   1087:10  Unique         4.56, 6.06 A)
 &rst
  ixpk= 1087, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#    5 THR  MG2          44 LEU  HN          5.50    (#   1088:10  Unique         3.14, 3.97 A)
 &rst
  ixpk= 1088, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  68,  69,  70,
 &end
#
#   44 LEU  HB-          44 LEU  HN          3.50    (#   1089:10  Unique         2.40, 3.04 A)
 &rst
  ixpk= 1089, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 629, 630,
 &end
#
#   40 LEU  HB+          44 LEU  HN          7.00    (#   1090:10  Unique         6.05, 6.40 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 564, 565,
 &end
#
#   40 LEU  HB-          44 LEU  HN          7.00    (#   1091:10  Unique         6.05, 6.40 A)
 &rst
  ixpk= 1091, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 564, 565,
 &end
#
#   43 ASP  HA           44 LEU  HN          4.50    (#   1092:10  Unique         3.45, 3.46 A)
 &rst
  ixpk= 1092, nxpk= 10, iat= 615, 625, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 GLU  HN           44 LEU  HN          5.50    (#   1093:10  Unique         5.01, 5.02 A)
 &rst
  ixpk= 1093, nxpk= 10, iat= 598, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 ASP  HB-         104 LYS  HN          4.50    (#   1095:10  Unique         4.13, 4.29 A)
 &rst
  ixpk= 1095, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1494,1495,
 &end
#
#   92 SER  HB+         104 LYS  HN          5.50    (#   1096:10  Unique         4.96, 5.63 A)
 &rst
  ixpk= 1096, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1330,1331,
 &end
#
#  104 LYS  HA          104 LYS  HN          3.50    (#   1097:10  Unique         2.70, 2.75 A)
 &rst
  ixpk= 1097, nxpk= 10, iat=1504,1502, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 ALA  HN          104 LYS  HN          5.50    (#   1098:10  Unique         4.65, 4.77 A)
 &rst
  ixpk= 1098, nxpk= 10, iat=1558,1502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1099   104 LYS  HN          5.50    (#   1099:10  Single Ambig)
 &rst
  ixpk= 1099, nxpk= 10, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1543, 917,
 &end
#
#   19 ALA  MB           18 VAL  HN          5.50    (#   1100:10  Unique         3.99, 4.90 A)
 &rst
  ixpk= 1100, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 256, 257, 258,
 &end
#
#    0 AMB  10-2:1101    18 VAL  HN          7.00    (#   1101:10  Single Ambig)
 &rst
  ixpk= 1101, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 207, 208, 298, 299,
 &end
#
#   21 HIS  HB-          18 VAL  HN          5.50    (#   1102:10  Unique         5.07, 5.79 A)
 &rst
  ixpk= 1102, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 281, 282,
 &end
#
#   17 TYR  HB-          18 VAL  HN          7.00    (#   1103:10  Unique         2.14, 2.89 A)
 &rst
  ixpk= 1103, nxpk= 10, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 219, 220,
 &end
#
#    4 ILE  MD1          31 PHE  HN          7.00    (#   1105:10  Unique         4.98, 5.72 A)
 &rst
  ixpk= 1105, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=  56,  57,  58,
 &end
#
#    0 AMB  10-2:1106    31 PHE  HN          5.50    (#   1106:10  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 369, 370, 371, 373, 374, 375, 369, 370, 371, 373,
       374, 375,  49,  50,  51,
 &end
#
#   33 THR  MG2          31 PHE  HN          4.50    (#   1107:10  Unique         5.32, 5.68 A)
 &rst
  ixpk= 1107, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 466, 467, 468,
 &end
#
#    0 AMB  10-2:1108    31 PHE  HN          5.50    (#   1108:10  Single Ambig)
 &rst
  ixpk= 1108, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 383, 384, 398, 399,
 &end
#
#   30 GLY  HA-          31 PHE  HN          4.50    (#   1109:10  Unique         3.11, 3.27 A)
 &rst
  ixpk= 1109, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 421, 422,
 &end
#
#   32 THR  HN           31 PHE  HN          5.50    (#   1110:10  Unique         4.45, 4.45 A)
 &rst
  ixpk= 1110, nxpk= 10, iat= 446, 426, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   83 VAL  MGX         115 LYS  HN          7.00    (#   1111:10  Unique         5.64, 6.70 A)
 &rst
  ixpk= 1111, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#  117 THR  MG2         115 LYS  HN          7.00    (#   1112:10  Unique         7.70, 8.30 A)
 &rst
  ixpk= 1112, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1711,1712,1713,
 &end
#
#    0 AMB  10-2:1113   115 LYS  HN          5.50    (#   1113:10  Single Ambig)
 &rst
  ixpk= 1113, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1161,1162,1692,1693,
 &end
#
#  115 LYS  HG-         115 LYS  HN          4.50    (#   1114:10  Unique         1.98, 2.47 A)
 &rst
  ixpk= 1114, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1673,1674,
 &end
#
#    0 AMB  10-2:1115   115 LYS  HN          7.00    (#   1115:10  Single Ambig)
 &rst
  ixpk= 1115, nxpk= 10, iat=  -1,1666, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1187,1157,1624,
 &end
#
#   85 PHE  HN          115 LYS  HN          4.50    (#   1116:10  Unique         2.78, 3.11 A)
 &rst
  ixpk= 1116, nxpk= 10, iat=1237,1666, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 LEU  HA          105 LEU  HN          4.50    (#   1117:10  Unique         2.74, 2.75 A)
 &rst
  ixpk= 1117, nxpk= 10, iat=1526,1524, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1118   105 LEU  HN          5.50    (#   1118:10  Single Ambig)
 &rst
  ixpk= 1118, nxpk= 10, iat=  -1,1524, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1533,1534,1535,1537,1538,1539, 940, 941, 942, 944,
       945, 946,
 &end
#
#  105 LEU  HB-         105 LEU  HN          4.50    (#   1119:10  Unique         2.15, 2.54 A)
 &rst
  ixpk= 1119, nxpk= 10, iat=  -1,1524, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1528,1529,
 &end
#
#  104 LYS  HB+         105 LEU  HN          4.50    (#   1120:10  Unique         2.48, 3.07 A)
 &rst
  ixpk= 1120, nxpk= 10, iat=  -1,1524, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1506,1507,
 &end
#
#   56 THR  HB          105 LEU  HN          7.00    (#   1121:10  Unique         4.78, 5.29 A)
 &rst
  ixpk= 1121, nxpk= 10, iat= 809,1524, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1122    88 ILE  HN          4.50    (#   1122:10  Single Ambig)
 &rst
  ixpk= 1122, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1287,1288,1289, 738, 739, 740, 742, 743, 744,
 &end
#
#   88 ILE  HG1+         88 ILE  HN          5.50    (#   1123:10  Unique         2.46, 3.22 A)
 &rst
  ixpk= 1123, nxpk= 10, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1284,1285,
 &end
#
#   26 LEU  MDX          29 ALA  HN          5.50    (#   1127:10  Unique         5.22, 6.36 A)
 &rst
  ixpk= 1127, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 369, 370, 371, 373, 374, 375,
 &end
#
#    0 AMB  10-2:1128    29 ALA  HN          5.50    (#   1128:10  Single Ambig)
 &rst
  ixpk= 1128, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2113,2114,2115,2117,2118,2119,2055,2056,2057,2059,
      2060,2061,
 &end
#
#   33 THR  MG2          29 ALA  HN          7.00    (#   1129:10  Unique         5.38, 6.16 A)
 &rst
  ixpk= 1129, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 466, 467, 468,
 &end
#
#   28 GLU  HG+          29 ALA  HN          5.50    (#   1130:10  Unique         4.42, 5.17 A)
 &rst
  ixpk= 1130, nxpk= 10, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 401, 402,
 &end
#
#   30 GLY  HN           29 ALA  HN          2.80    (#   1131:10  Unique         2.60, 2.64 A)
 &rst
  ixpk= 1131, nxpk= 10, iat= 419, 409, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   28 GLU  HN           29 ALA  HN          2.80    (#   1132:10  Unique         2.47, 2.57 A)
 &rst
  ixpk= 1132, nxpk= 10, iat= 394, 409, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  105 LEU  MDY          70 TYR  HN          7.00    (#   1133:10  Unique         3.00, 4.91 A)
 &rst
  ixpk= 1133, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  10-2:1134    70 TYR  HN          7.00    (#   1134:10  Single Ambig)
 &rst
  ixpk= 1134, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=1533,1534,1535,1537,1538,1539, 940, 941, 942, 944,
       945, 946,
 &end
#
#   70 TYR  HB-          70 TYR  HN          3.50    (#   1135:10  Unique         2.07, 2.64 A)
 &rst
  ixpk= 1135, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 999,1000,
 &end
#
#   69 PHE  HB+          70 TYR  HN          4.50    (#   1136:10  Unique         2.06, 2.61 A)
 &rst
  ixpk= 1136, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 979, 980,
 &end
#
#   70 TYR  HA           70 TYR  HN          4.50    (#   1137:10  Unique         2.76, 2.77 A)
 &rst
  ixpk= 1137, nxpk= 10, iat= 997, 995, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ILE  MG2           8 SER  HN          4.50    (#   1138:10  Unique         3.51, 4.10 A)
 &rst
  ixpk= 1138, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 101, 102, 103,
 &end
#
#    0 AMB  10-2:1139     8 SER  HN          5.50    (#   1139:10  Single Ambig)
 &rst
  ixpk= 1139, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 777, 778, 779, 495, 496, 497,
 &end
#
#   36 LEU  HB-           8 SER  HN          5.50    (#   1140:10  Unique         3.68, 4.53 A)
 &rst
  ixpk= 1140, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 507, 508,
 &end
#
#    0 AMB  10-2:1141     8 SER  HN          4.50    (#   1141:10  Single Ambig)
 &rst
  ixpk= 1141, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  99, 256, 257, 258, 510,
 &end
#
#   36 LEU  HN            8 SER  HN          5.50    (#   1142:10  Unique         3.93, 4.03 A)
 &rst
  ixpk= 1142, nxpk= 10, iat= 503, 114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 THR  MG2          61 ASP  HN          5.50    (#   1143:10  Unique         5.46, 6.87 A)
 &rst
  ixpk= 1143, nxpk= 10, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 811, 812, 813,
 &end
#
#   60 GLY  HA-          61 ASP  HN          5.50    (#   1144:10  Unique         2.18, 2.58 A)
 &rst
  ixpk= 1144, nxpk= 10, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 855, 856,
 &end
#
#   60 GLY  HA+          61 ASP  HN          5.50    (#   1145:10  Unique         2.18, 2.58 A)
 &rst
  ixpk= 1145, nxpk= 10, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 855, 856,
 &end
#
#  111 ASN  HN          110 LYS  HN          2.80    (#   1147:10  Unique         2.36, 2.43 A)
 &rst
  ixpk= 1147, nxpk= 10, iat=1624,1602, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  110 LYS  HA          110 LYS  HN          3.50    (#   1150:10  Unique         2.87, 2.88 A)
 &rst
  ixpk= 1150, nxpk= 10, iat=1604,1602, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 ALA  HA          110 LYS  HN          5.50    (#   1151:10  Unique         3.85, 3.89 A)
 &rst
  ixpk= 1151, nxpk= 10, iat=1560,1602, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1152   110 LYS  HN          5.50    (#   1152:10  Single Ambig)
 &rst
  ixpk= 1152, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1547,1548,1550,1551,
 &end
#
#    0 AMB  10-2:1153   110 LYS  HN          3.50    (#   1153:10  Single Ambig)
 &rst
  ixpk= 1153, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1612,1613,1612,1613,
 &end
#
#    0 AMB  10-2:1154   110 LYS  HN          5.50    (#   1154:10  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1590,1562,1563,1564,
 &end
#
#  109 LEU  HB+         110 LYS  HN          3.50    (#   1155:10  Unique         2.51, 3.05 A)
 &rst
  ixpk= 1155, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1587,1588,
 &end
#
#  109 LEU  MDY         110 LYS  HN          5.50    (#   1156:10  Unique         4.99, 5.64 A)
 &rst
  ixpk= 1156, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#   44 LEU  MDY          43 ASP  HN          7.00    (#   1161:10  Unique         5.41, 6.68 A)
 &rst
  ixpk= 1161, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 634, 635, 636, 638, 639, 640,
 &end
#
#    0 AMB  10-2:1162    43 ASP  HN          5.50    (#   1162:10  Single Ambig)
 &rst
  ixpk= 1162, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 101, 102, 103, 634, 635, 636, 638, 639, 640,
 &end
#
#    0 AMB  10-2:1163    43 ASP  HN          5.50    (#   1163:10  Single Ambig)
 &rst
  ixpk= 1163, nxpk= 10, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 629, 630, 583, 584, 567,
 &end
#
#   42 GLU  HN           43 ASP  HN          3.50    (#   1164:10  Unique         3.11, 3.18 A)
 &rst
  ixpk= 1164, nxpk= 10, iat= 598, 613, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 TYR  HB-          17 TYR  HN          5.50    (#   1165:10  Unique         2.14, 2.58 A)
 &rst
  ixpk= 1165, nxpk= 10, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 219, 220,
 &end
#
#  105 LEU  MDX         107 ALA  HN          7.00    (#   1166:10  Unique         4.86, 6.31 A)
 &rst
  ixpk= 1166, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#  105 LEU  HB-         107 ALA  HN          7.00    (#   1167:10  Unique         4.37, 4.81 A)
 &rst
  ixpk= 1167, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1528,1529,
 &end
#
#    0 AMB  10-2:1168   107 ALA  HN          5.50    (#   1168:10  Single Ambig)
 &rst
  ixpk= 1168, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1572,1573,1341,1342,1606,1607,1606,1607,
 &end
#
#  104 LYS  HB+         107 ALA  HN          5.50    (#   1169:10  Unique         5.23, 5.38 A)
 &rst
  ixpk= 1169, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1506,1507,
 &end
#
#  106 GLU  HA          107 ALA  HN          5.50    (#   1170:10  Unique         3.49, 3.50 A)
 &rst
  ixpk= 1170, nxpk= 10, iat=1545,1558, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1171   107 ALA  HN          5.50    (#   1171:10  Single Ambig)
 &rst
  ixpk= 1171, nxpk= 10, iat=  -1,1558, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1492,1570,
 &end
#
#  108 GLU  HN          107 ALA  HN          3.50    (#   1172:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 1172, nxpk= 10, iat=1568,1558, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 LEU  MDX         106 GLU  HN          4.50    (#   1173:10  Unique         2.75, 4.64 A)
 &rst
  ixpk= 1173, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#  105 LEU  MDY         106 GLU  HN          5.50    (#   1174:10  Unique         2.75, 4.64 A)
 &rst
  ixpk= 1174, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  10-2:1175   106 GLU  HN          5.50    (#   1175:10  Single Ambig)
 &rst
  ixpk= 1175, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1562,1563,1564,1304,
 &end
#
#  109 LEU  MDY         106 GLU  HN          5.50    (#   1176:10  Unique         3.98, 5.99 A)
 &rst
  ixpk= 1176, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#  106 GLU  HG+         106 GLU  HN          5.50    (#   1177:10  Unique         2.14, 2.92 A)
 &rst
  ixpk= 1177, nxpk= 10, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1550,1551,
 &end
#
#   18 VAL  MGY          21 HIS  HN          5.50    (#   1178:10  Unique         4.80, 6.20 A)
 &rst
  ixpk= 1178, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 242, 243, 244, 246, 247, 248,
 &end
#
#   20 GLU  HG+          21 HIS  HN          5.50    (#   1179:10  Unique         3.95, 4.74 A)
 &rst
  ixpk= 1179, nxpk= 10, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 269, 270,
 &end
#
#  146 LEU  MDY         146 LEU  HN          4.50    (#   1180:10  Unique         1.95, 4.42 A)
 &rst
  ixpk= 1180, nxpk= 10, iat=  -1,2156, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   41 LEU  MDY          73 LEU  HN          7.00    (#   1181:10  Unique         3.30, 4.60 A)
 &rst
  ixpk= 1181, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#   73 LEU  HB+          73 LEU  HN          2.80    (#   1182:10  Unique         2.29, 2.94 A)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1045,1046,
 &end
#
#    0 AMB  10-2:1183    73 LEU  HN          4.50    (#   1183:10  Single Ambig)
 &rst
  ixpk= 1183, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1081,1082,1067,1068,1064,1065,1572,1573,
 &end
#
#   74 GLN  HN           73 LEU  HN          3.50    (#   1184:10  Unique         2.98, 3.00 A)
 &rst
  ixpk= 1184, nxpk= 10, iat=1060,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1185    73 LEU  HN          5.50    (#   1185:10  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1077, 995,
 &end
#
#   21 HIS  HB-          22 LEU  HN          4.50    (#   1186:10  Unique         2.21, 3.07 A)
 &rst
  ixpk= 1186, nxpk= 10, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 281, 282,
 &end
#
#    0 AMB  10-2:1187   145 LEU  HN          5.50    (#   1187:10  Single Ambig)
 &rst
  ixpk= 1187, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
      2118,2119,
 &end
#
#  145 LEU  HB-         145 LEU  HN          3.50    (#   1188:10  Unique         2.04, 2.69 A)
 &rst
  ixpk= 1188, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2141,2142,
 &end
#
#    0 AMB  10-2:1191   145 LEU  HN          3.50    (#   1191:10  Single Ambig)
 &rst
  ixpk= 1191, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2127,2128,2127,2128,
 &end
#
#  143 VAL  HA          145 LEU  HN          7.00    (#   1192:10  Unique         3.88, 3.95 A)
 &rst
  ixpk= 1192, nxpk= 10, iat=2109,2137, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  142 TRP  HA          145 LEU  HN          5.50    (#   1193:10  Unique         3.44, 3.52 A)
 &rst
  ixpk= 1193, nxpk= 10, iat=2085,2137, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1194   145 LEU  HN          5.50    (#   1194:10  Single Ambig)
 &rst
  ixpk= 1194, nxpk= 10, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2158,2076,2077,
 &end
#
#  143 VAL  HN          145 LEU  HN          5.50    (#   1195:10  Unique         3.75, 3.84 A)
 &rst
  ixpk= 1195, nxpk= 10, iat=2107,2137, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 ALA  HA           22 LEU  HN          5.50    (#   1196:10  Unique         3.73, 3.80 A)
 &rst
  ixpk= 1196, nxpk= 10, iat= 254, 294, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLU  HA           95 TYR  HN          3.50    (#   1197:10  Unique         3.48, 3.53 A)
 &rst
  ixpk= 1197, nxpk= 10, iat=1363,1376, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 ILE  MG2          40 LEU  HN          7.00    (#   1199:10  Unique         4.94, 6.00 A)
 &rst
  ixpk= 1199, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 101, 102, 103,
 &end
#
#   36 LEU  MDX          40 LEU  HN          7.00    (#   1200:10  Unique         4.18, 5.82 A)
 &rst
  ixpk= 1200, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 512, 513, 514, 516, 517, 518,
 &end
#
#    0 AMB  10-2:1201    40 LEU  HN          7.00    (#   1201:10  Single Ambig)
 &rst
  ixpk= 1201, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 512, 513, 514, 516, 517, 518, 588, 589, 590, 592,
       593, 594,
 &end
#
#   36 LEU  HB-          40 LEU  HN          7.00    (#   1202:10  Unique         4.68, 4.89 A)
 &rst
  ixpk= 1202, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 507, 508,
 &end
#
#   39 PRO  HB+          40 LEU  HN          3.50    (#   1204:10  Unique         2.84, 3.37 A)
 &rst
  ixpk= 1204, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 553, 554,
 &end
#
#   43 ASP  HB+          40 LEU  HN          5.50    (#   1205:10  Unique         5.50, 6.17 A)
 &rst
  ixpk= 1205, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 617, 618,
 &end
#
#   43 ASP  HN           40 LEU  HN          5.50    (#   1206:10  Unique         4.73, 4.82 A)
 &rst
  ixpk= 1206, nxpk= 10, iat= 613, 560, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  139 LEU  MDY          25 LYS  HN          5.50    (#   1207:10  Unique         4.82, 6.72 A)
 &rst
  ixpk= 1207, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#   25 LYS  HA           25 LYS  HN          3.50    (#   1208:10  Unique         2.76, 2.77 A)
 &rst
  ixpk= 1208, nxpk= 10, iat= 340, 338, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 GLU  HN           25 LYS  HN          5.50    (#   1209:10  Unique         4.11, 4.19 A)
 &rst
  ixpk= 1209, nxpk= 10, iat= 379, 338, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 PRO  HG-          67 SER  HN          5.50    (#   1213:10  Unique         3.88, 4.22 A)
 &rst
  ixpk= 1213, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 965, 966,
 &end
#
#    0 AMB  10-2:1214    67 SER  HN          7.00    (#   1214:10  Single Ambig)
 &rst
  ixpk= 1214, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 979, 980, 999,1000, 921, 922,
 &end
#
#   69 PHE  HN           67 SER  HN          4.50    (#   1216:10  Unique         3.44, 3.67 A)
 &rst
  ixpk= 1216, nxpk= 10, iat= 975, 950, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1217    67 SER  HN          7.00    (#   1217:10  Single Ambig)
 &rst
  ixpk= 1217, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 905, 132,
 &end
#
#    0 AMB  10-2:1218   119 GLU  HN          4.50    (#   1218:10  Single Ambig)
 &rst
  ixpk= 1218, nxpk= 10, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1711,1712,1713,1764,1765,1766,1768,1769,1770,2146,
      2147,2148,2150,2151,2152,
 &end
#
#  142 TRP  HD1         119 GLU  HN          7.00    (#   1219:10  Unique         3.48, 4.20 A)
 &rst
  ixpk= 1219, nxpk= 10, iat=2091,1726, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  118 GLY  HN          119 GLU  HN          4.50    (#   1220:10  Unique         2.34, 4.28 A)
 &rst
  ixpk= 1220, nxpk= 10, iat=1719,1726, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  120 THR  HN          119 GLU  HN          4.50    (#   1221:10  Unique         4.37, 4.42 A)
 &rst
  ixpk= 1221, nxpk= 10, iat=1741,1726, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  138 TRP  HE1         119 GLU  HN          4.50    (#   1222:10  Unique         2.72, 4.11 A)
 &rst
  ixpk= 1222, nxpk= 10, iat=2032,1726, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 ALA  MB           71 GLU  HN          7.00    (#   1223:10  Unique         4.91, 5.62 A)
 &rst
  ixpk= 1223, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1035,1036,1037,
 &end
#
#   71 GLU  HG-          71 GLU  HN          4.50    (#   1224:10  Unique         2.95, 3.12 A)
 &rst
  ixpk= 1224, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1023,1024,
 &end
#
#  145 LEU  HB+         118 GLY  HN          7.00    (#   1225:10  Unique         5.54, 6.45 A)
 &rst
  ixpk= 1225, nxpk= 10, iat=  -1,1719, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2141,2142,
 &end
#
#    0 AMB  10-2:1226   118 GLY  HN          5.50    (#   1226:10  Single Ambig)
 &rst
  ixpk= 1226, nxpk= 10, iat=  -1,1719, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2141,2142,1676,1677,1217,1218,1220,1221,
 &end
#
#    0 AMB  10-2:1227   118 GLY  HN          5.50    (#   1227:10  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 10, iat=  -1,1719, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1733,1734,1695,1696,
 &end
#
#  118 GLY  HA+         118 GLY  HN          2.80    (#   1228:10  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1228, nxpk= 10, iat=  -1,1719, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1721,1722,
 &end
#
#  117 THR  HB          118 GLY  HN          5.50    (#   1229:10  Unique         3.89, 4.16 A)
 &rst
  ixpk= 1229, nxpk= 10, iat=1709,1719, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  118 GLY  HA-         118 GLY  HN          2.80    (#   1230:10  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1230, nxpk= 10, iat=  -1,1719, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1721,1722,
 &end
#
#  142 TRP  HD1         118 GLY  HN          7.00    (#   1232:10  Unique         3.87, 4.64 A)
 &rst
  ixpk= 1232, nxpk= 10, iat=2091,1719, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  109 LEU  MDY         108 GLU  HN          7.00    (#   1234:10  Unique         5.15, 6.42 A)
 &rst
  ixpk= 1234, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#   73 LEU  MDY         108 GLU  HN          5.50    (#   1235:10  Unique         4.37, 6.12 A)
 &rst
  ixpk= 1235, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#  105 LEU  MDY         108 GLU  HN          7.00    (#   1236:10  Unique         4.93, 6.11 A)
 &rst
  ixpk= 1236, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#    0 AMB  10-2:1237   108 GLU  HN          5.50    (#   1237:10  Single Ambig)
 &rst
  ixpk= 1237, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1587,1588,1509,1510,
 &end
#
#    0 AMB  10-2:1238   108 GLU  HN          5.50    (#   1238:10  Single Ambig)
 &rst
  ixpk= 1238, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1547,1548,1550,1551,
 &end
#
#  110 LYS  HN          108 GLU  HN          5.50    (#   1239:10  Unique         4.23, 4.27 A)
 &rst
  ixpk= 1239, nxpk= 10, iat=1602,1568, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 GLU  HN          108 GLU  HN          5.50    (#   1240:10  Unique         4.61, 4.65 A)
 &rst
  ixpk= 1240, nxpk= 10, iat=1543,1568, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 SER  HA           10 SER  HN          5.50    (#   1241:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 1241, nxpk= 10, iat= 134, 132, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 GLY  HA+          10 SER  HN          4.50    (#   1242:10  Unique         2.16, 2.84 A)
 &rst
  ixpk= 1242, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 127, 128,
 &end
#
#   65 ASN  HD2-         10 SER  HN          7.00    (#   1244:10  Unique         6.22, 7.31 A)
 &rst
  ixpk= 1244, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 926, 927,
 &end
#
#   90 ILE  HG1-         54 SER  HN          4.50    (#   1245:10  Unique         1.91, 2.72 A)
 &rst
  ixpk= 1245, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1310,1311,
 &end
#
#   53 ILE  HB           54 SER  HN          7.00    (#   1246:10  Unique         4.15, 4.21 A)
 &rst
  ixpk= 1246, nxpk= 10, iat= 768, 783, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   54 SER  HB-          54 SER  HN          3.50    (#   1247:10  Unique         2.82, 3.58 A)
 &rst
  ixpk= 1247, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#   54 SER  HA           54 SER  HN          4.50    (#   1248:10  Unique         2.89, 2.89 A)
 &rst
  ixpk= 1248, nxpk= 10, iat= 785, 783, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   88 ILE  HN           54 SER  HN          5.50    (#   1249:10  Unique         3.44, 3.68 A)
 &rst
  ixpk= 1249, nxpk= 10, iat=1274, 783, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 ILE  HN           54 SER  HN          5.50    (#   1250:10  Unique         4.06, 4.13 A)
 &rst
  ixpk= 1250, nxpk= 10, iat= 764, 783, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1252    85 PHE  HN          5.50    (#   1252:10  Single Ambig)
 &rst
  ixpk= 1252, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 699, 700, 701,1711,1712,1713,1166,1167,1168,1170,
      1171,1172,
 &end
#
#  114 ALA  MB           85 PHE  HN          5.50    (#   1253:10  Unique         2.41, 3.76 A)
 &rst
  ixpk= 1253, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1660,1661,1662,
 &end
#
#  115 LYS  HG+          85 PHE  HN          5.50    (#   1254:10  Unique         3.42, 4.54 A)
 &rst
  ixpk= 1254, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1673,1674,
 &end
#
#   83 VAL  MGY          85 PHE  HN          5.50    (#   1255:10  Unique         5.28, 6.44 A)
 &rst
  ixpk= 1255, nxpk= 10, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   20 GLU  HA           20 GLU  HN          5.50    (#   1256:10  Unique         2.75, 2.76 A)
 &rst
  ixpk= 1256, nxpk= 10, iat= 264, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 THR  MG2          20 GLU  HN          7.00    (#   1257:10  Unique         3.28, 4.25 A)
 &rst
  ixpk= 1257, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 495, 496, 497,
 &end
#
#    0 AMB  10-2:1258     0 AMB  10-1:1258   4.50    (#   1258:10  Double Ambig)
 &rst
  ixpk= 1258, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1064,1065, 207, 208, 298, 299,
 igr2=1077, 262,
 &end
#
#   75 GLU  HG+          75 GLU  HN          4.50    (#   1259:10  Unique         4.40, 4.47 A)
 &rst
  ixpk= 1259, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1084,1085,
 &end
#
#    0 AMB  10-2:1260    20 GLU  HN          5.50    (#   1260:10  Single Ambig)
 &rst
  ixpk= 1260, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 204, 205, 317, 318, 319,
 &end
#
#   75 GLU  HA           75 GLU  HN          3.50    (#   1261:10  Unique         2.90, 2.90 A)
 &rst
  ixpk= 1261, nxpk= 10, iat=1079,1077, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 ALA  HA           75 GLU  HN          4.50    (#   1262:10  Unique         3.26, 3.29 A)
 &rst
  ixpk= 1262, nxpk= 10, iat=1033,1077, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 GLN  HN           75 GLU  HN          2.80    (#   1263:10  Unique         2.54, 2.55 A)
 &rst
  ixpk= 1263, nxpk= 10, iat=1060,1077, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   76 GLN  HN           75 GLU  HN          2.80    (#   1264:10  Unique         2.40, 2.41 A)
 &rst
  ixpk= 1264, nxpk= 10, iat=1092,1077, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   66 LEU  HN           65 ASN  HN          4.50    (#   1265:10  Unique         2.40, 3.14 A)
 &rst
  ixpk= 1265, nxpk= 10, iat= 931, 917, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 ASN  HA           65 ASN  HN          4.50    (#   1266:10  Unique         2.27, 2.75 A)
 &rst
  ixpk= 1266, nxpk= 10, iat= 919, 917, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   64 ASP  HA           65 ASN  HN          5.50    (#   1267:10  Unique         3.42, 3.55 A)
 &rst
  ixpk= 1267, nxpk= 10, iat= 907, 917, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1268    65 ASN  HN          5.50    (#   1268:10  Single Ambig)
 &rst
  ixpk= 1268, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 921, 922, 999,1000,
 &end
#
#   80 LEU  MDX          79 ASP  HN          5.50    (#   1269:10  Unique         3.43, 4.69 A)
 &rst
  ixpk= 1269, nxpk= 10, iat=  -1,1145, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   79 ASP  HA           79 ASP  HN          3.50    (#   1270:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 1270, nxpk= 10, iat=1147,1145, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1271   144 ASN  HN          4.50    (#   1271:10  Single Ambig)
 &rst
  ixpk= 1271, nxpk= 10, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=2179,2180, 413, 414, 415,
 &end
#
#  143 VAL  HB          144 ASN  HN          3.50    (#   1272:10  Unique         2.36, 2.43 A)
 &rst
  ixpk= 1272, nxpk= 10, iat=2111,2123, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  141 SER  HA          144 ASN  HN          4.50    (#   1273:10  Unique         3.53, 3.70 A)
 &rst
  ixpk= 1273, nxpk= 10, iat=2074,2123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1274    24 GLU  HN          5.50    (#   1274:10  Single Ambig)
 &rst
  ixpk= 1274, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 298, 299, 466, 467, 468,
 &end
#
#   35 THR  MG2          24 GLU  HN          7.00    (#   1276:10  Unique         5.22, 6.43 A)
 &rst
  ixpk= 1276, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 495, 496, 497,
 &end
#
#   25 LYS  HB+          24 GLU  HN          7.00    (#   1277:10  Unique         5.17, 5.84 A)
 &rst
  ixpk= 1277, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 342, 343,
 &end
#
#   22 LEU  HB-          24 GLU  HN          7.00    (#   1278:10  Unique         4.93, 5.10 A)
 &rst
  ixpk= 1278, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 298, 299,
 &end
#
#   24 GLU  HB+          24 GLU  HN          2.80    (#   1279:10  Unique         2.27, 2.53 A)
 &rst
  ixpk= 1279, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 327, 328,
 &end
#
#    0 AMB  10-2:1280    24 GLU  HN          4.50    (#   1280:10  Single Ambig)
 &rst
  ixpk= 1280, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 330, 331, 269, 270,
 &end
#
#   21 HIS  HA           24 GLU  HN          4.50    (#   1281:10  Unique         3.63, 3.66 A)
 &rst
  ixpk= 1281, nxpk= 10, iat= 279, 323, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1282    24 GLU  HN          5.50    (#   1282:10  Single Ambig)
 &rst
  ixpk= 1282, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 294, 379,
 &end
#
#   23 ALA  HN           24 GLU  HN          3.50    (#   1283:10  Unique         2.86, 2.88 A)
 &rst
  ixpk= 1283, nxpk= 10, iat= 313, 323, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 ILE  HG1-          4 ILE  HN          4.50    (#   1284:10  Unique         2.97, 3.52 A)
 &rst
  ixpk= 1284, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  53,  54,
 &end
#
#   33 THR  HB            4 ILE  HN          7.00    (#   1285:10  Unique         4.36, 4.45 A)
 &rst
  ixpk= 1285, nxpk= 10, iat= 464,  43, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1286     4 ILE  HN          5.50    (#   1286:10  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 10, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  23,  66,
 &end
#
#   34 GLU  HN            4 ILE  HN          5.50    (#   1287:10  Unique         3.98, 4.01 A)
 &rst
  ixpk= 1287, nxpk= 10, iat= 474,  43, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 THR  HN            4 ILE  HN          4.50    (#   1288:10  Unique         4.33, 4.37 A)
 &rst
  ixpk= 1288, nxpk= 10, iat= 446,  43, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 GLY  HA-          91 GLY  HN          3.50    (#   1289:10  Unique         2.30, 2.65 A)
 &rst
  ixpk= 1289, nxpk= 10, iat=  -1,1319, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1321,1322,
 &end
#
#   90 ILE  HB           91 GLY  HN          7.00    (#   1291:10  Unique         3.47, 3.81 A)
 &rst
  ixpk= 1291, nxpk= 10, iat=1304,1319, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   77 LYS  HN           76 GLN  HN          2.80    (#   1292:10  Unique         2.30, 2.31 A)
 &rst
  ixpk= 1292, nxpk= 10, iat=1109,1092, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1293    76 GLN  HN          2.80    (#   1293:10  Single Ambig)
 &rst
  ixpk= 1293, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1094,1079,
 &end
#
#    0 AMB  10-2:1294    76 GLN  HN          4.50    (#   1294:10  Single Ambig)
 &rst
  ixpk= 1294, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1113,1114,1064,1065,1067,1068,
 &end
#
#   72 ALA  MB           76 GLN  HN          5.50    (#   1295:10  Unique         4.54, 5.15 A)
 &rst
  ixpk= 1295, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1035,1036,1037,
 &end
#
#   77 LYS  HG-          76 GLN  HN          5.50    (#   1296:10  Unique         4.40, 4.61 A)
 &rst
  ixpk= 1296, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1116,1117,
 &end
#
#   56 THR  MG2          56 THR  HN          5.50    (#   1297:10  Unique         2.38, 3.73 A)
 &rst
  ixpk= 1297, nxpk= 10, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 811, 812, 813,
 &end
#
#   56 THR  HA           56 THR  HN          4.50    (#   1298:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 1298, nxpk= 10, iat= 807, 805, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 LEU  MDY          74 GLN  HN          5.50    (#   1299:10  Unique         4.63, 5.43 A)
 &rst
  ixpk= 1299, nxpk= 10, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#    0 AMB  10-2:1300     0 AMB  10-1:1300   5.50    (#   1300:10  Double Ambig)
 &rst
  ixpk= 1300, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2146,2147,2148,2150,2151,2152, 588, 589, 590, 592,
       593, 594,1764,1765,1766,1768,1769,1770,
 igr2=2072,1060,
 &end
#
#    0 AMB  10-2:1301     0 AMB  10-1:1301   5.50    (#   1301:10  Double Ambig)
 &rst
  ixpk= 1301, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.88, r4=11.38,
 igr1= 588, 589, 590, 592, 593, 594,2113,2114,2115,2117,
      2118,2119,2113,2114,2115,2117,2118,2119,1533,1534,
      1535,1537,1538,1539,2055,2056,2057,2059,2060,2061,
      
 igr2=1060,2072,
 &end
#
#    0 AMB  10-2:1302     0 AMB  10-1:1302   4.50    (#   1302:10  Double Ambig)
 &rst
  ixpk= 1302, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2087,2088,1035,1036,1037,
 igr2=2072,1060,
 &end
#
#    0 AMB  10-2:1303     0 AMB  10-1:1303   5.50    (#   1303:10  Double Ambig)
 &rst
  ixpk= 1303, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2014,2015,1023,1024,
 igr2=2072,1060,
 &end
#
#   73 LEU  HA           74 GLN  HN          5.50    (#   1304:10  Unique         3.57, 3.57 A)
 &rst
  ixpk= 1304, nxpk= 10, iat=1043,1060, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 GLN  HN           74 GLN  HN          4.50    (#   1305:10  Unique         4.53, 4.54 A)
 &rst
  ixpk= 1305, nxpk= 10, iat=1092,1060, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 GLU  HN           74 GLN  HN          5.50    (#   1306:10  Unique         5.01, 5.04 A)
 &rst
  ixpk= 1306, nxpk= 10, iat=1016,1060, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 LEU  MDY         112 SER  HN          7.00    (#   1307:10  Unique         5.51, 7.17 A)
 &rst
  ixpk= 1307, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1050,1051,1052,1054,1055,1056,
 &end
#
#  114 ALA  MB          112 SER  HN          7.00    (#   1308:10  Unique         5.15, 6.29 A)
 &rst
  ixpk= 1308, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1660,1661,1662,
 &end
#
#  112 SER  HB+         112 SER  HN          3.50    (#   1309:10  Unique         2.32, 2.99 A)
 &rst
  ixpk= 1309, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1642,1643,
 &end
#
#    0 AMB  10-2:1310   112 SER  HN          3.50    (#   1310:10  Single Ambig)
 &rst
  ixpk= 1310, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1626,1604,
 &end
#
#    0 AMB  10-2:1312    42 GLU  HN          5.50    (#   1312:10  Single Ambig)
 &rst
  ixpk= 1312, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 512, 513, 514, 516, 517, 518, 588, 589, 590, 592,
       593, 594,  68,  69,  70,
 &end
#
#   41 LEU  MDY          42 GLU  HN          7.00    (#   1313:10  Unique         4.84, 6.25 A)
 &rst
  ixpk= 1313, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#   44 LEU  HN           42 GLU  HN          7.00    (#   1314:10  Unique         5.01, 5.02 A)
 &rst
  ixpk= 1314, nxpk= 10, iat= 625, 598, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   40 LEU  HN           42 GLU  HN          5.50    (#   1315:10  Unique         3.04, 3.07 A)
 &rst
  ixpk= 1315, nxpk= 10, iat= 560, 598, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   92 SER  HB+          92 SER  HN          7.00    (#   1316:10  Unique         2.26, 3.09 A)
 &rst
  ixpk= 1316, nxpk= 10, iat=  -1,1326, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1330,1331,
 &end
#
#    0 AMB  10-2:1317    77 LYS  HN          7.00    (#   1317:10  Single Ambig)
 &rst
  ixpk= 1317, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1= 588, 589, 590, 592, 593, 594,1166,1167,1168,1170,
      1171,1172,1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  10-2:1318    77 LYS  HN          4.50    (#   1318:10  Single Ambig)
 &rst
  ixpk= 1318, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1096,1097,1081,1082,
 &end
#
#   83 VAL  MGX          81 SER  HN          5.50    (#   1320:10  Unique         4.30, 6.71 A)
 &rst
  ixpk= 1320, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#   80 LEU  MDX          81 SER  HN          4.50    (#   1321:10  Unique         4.40, 5.45 A)
 &rst
  ixpk= 1321, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#    0 AMB  10-2:1322    81 SER  HN          4.50    (#   1322:10  Single Ambig)
 &rst
  ixpk= 1322, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1191,1192,1193,1164,
 &end
#
#   80 LEU  HB+          81 SER  HN          4.50    (#   1323:10  Unique         4.04, 4.32 A)
 &rst
  ixpk= 1323, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1161,1162,
 &end
#
#   58 GLY  HA+          58 GLY  HN          4.50    (#   1324:10  Unique         2.31, 2.70 A)
 &rst
  ixpk= 1324, nxpk= 10, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 838, 839,
 &end
#
#    0 AMB  10-2:1325    58 GLY  HN          5.50    (#   1325:10  Single Ambig)
 &rst
  ixpk= 1325, nxpk= 10, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 845,1330,1331,
 &end
#
#  145 LEU  MDX         144 ASN  HD2+        5.50    (#   1327:10  Unique         4.46, 7.47 A)
 &rst
  ixpk= 1327, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2146,2147,2148,2150,2151,2152,
 igr2=2132,2133,
 &end
#
#    0 AMB  10-2:1331     0 AMB  10-1:1331   5.50    (#   1331:10  Double Ambig)
 &rst
  ixpk= 1331, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2146,2147,2148,2150,2151,2152,1802,1803,1804,
 igr2=2132,2133,1824,1825,
 &end
#
#  143 VAL  MGX         144 ASN  HD2-        4.50    (#   1332:10  Unique         4.63, 6.65 A)
 &rst
  ixpk= 1332, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2113,2114,2115,2117,2118,2119,
 igr2=2132,2133,
 &end
#
#  141 SER  HA          144 ASN  HD2-        5.50    (#   1333:10  Unique         2.20, 2.95 A)
 &rst
  ixpk= 1333, nxpk= 10, iat=2074,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2132,2133,
 &end
#
#  129 ASP  HB+         124 ASN  HD2-        4.50    (#   1334:10  Unique         1.98, 2.95 A)
 &rst
  ixpk= 1334, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1900,1901,
 igr2=1824,1825,
 &end
#
#   89 GLY  HA-         124 ASN  HD2-        7.00    (#   1335:10  Unique         4.75, 5.72 A)
 &rst
  ixpk= 1335, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1295,1296,
 igr2=1824,1825,
 &end
#
#    0 AMB  10-2:1336   124 ASN  HD2-        4.50    (#   1336:10  Single Ambig)
 &rst
  ixpk= 1336, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1914,1915,1916, 242, 243, 244, 246, 247, 248,
 igr2=1824,1825,
 &end
#
#    0 AMB  10-2:1338    89 GLY  HN          4.50    (#   1338:10  Single Ambig)
 &rst
  ixpk= 1338, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1=1809,1810,1811,1284,1285, 770, 771, 772,1313,1314,
      1315,
 &end
#
#    0 AMB  10-2:1339    89 GLY  HN          3.50    (#   1339:10  Single Ambig)
 &rst
  ixpk= 1339, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1747,1748,1749,1759,1760,
 &end
#
#    0 AMB  10-2:1340    89 GLY  HN          7.00    (#   1340:10  Single Ambig)
 &rst
  ixpk= 1340, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1806,1807,1781,1782,
 &end
#
#    0 AMB  10-2:1341    89 GLY  HN          4.50    (#   1341:10  Single Ambig)
 &rst
  ixpk= 1341, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1310,1311,1268,1269,1270,
 &end
#
#    0 AMB  10-2:1342    89 GLY  HN          5.50    (#   1342:10  Single Ambig)
 &rst
  ixpk= 1342, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1778,1779,1304,
 &end
#
#   89 GLY  HA-          89 GLY  HN          3.50    (#   1343:10  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1343, nxpk= 10, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1295,1296,
 &end
#
#  122 LYS  HA           89 GLY  HN          3.50    (#   1344:10  Unique         2.55, 2.95 A)
 &rst
  ixpk= 1344, nxpk= 10, iat=1776,1293, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 ILE  HN           89 GLY  HN          5.50    (#   1345:10  Unique         3.68, 3.93 A)
 &rst
  ixpk= 1345, nxpk= 10, iat=1796,1293, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   89 GLY  HA-         124 ASN  HD2+        5.50    (#   1346:10  Unique         4.75, 5.72 A)
 &rst
  ixpk= 1346, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1295,1296,
 igr2=1824,1825,
 &end
#
#  129 ASP  HB+         124 ASN  HD2+        3.50    (#   1347:10  Unique         1.98, 2.95 A)
 &rst
  ixpk= 1347, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1900,1901,
 igr2=1824,1825,
 &end
#
#  131 PRO  HG+         124 ASN  HD2+        5.50    (#   1348:10  Unique         1.93, 3.05 A)
 &rst
  ixpk= 1348, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1931,1932,
 igr2=1824,1825,
 &end
#
#   33 THR  MG2          32 THR  HN          5.50    (#   1349:10  Unique         4.30, 5.21 A)
 &rst
  ixpk= 1349, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 466, 467, 468,
 &end
#
#    4 ILE  MD1          32 THR  HN          7.00    (#   1350:10  Unique         4.83, 5.60 A)
 &rst
  ixpk= 1350, nxpk= 10, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=  56,  57,  58,
 &end
#
#    0 AMB  10-2:1351     0 AMB  10-1:1351   5.50    (#   1351:10  Double Ambig)
 &rst
  ixpk= 1351, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1572,1573,1096,1097,1135,1136,
 igr2=1633,1634,1104,1105,
 &end
#
#    0 AMB  10-2:1352     0 AMB  10-1:1352   4.50    (#   1352:10  Double Ambig)
 &rst
  ixpk= 1352, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1572,1573,1096,1097,1081,1082,
 igr2=1633,1634,1104,1105,
 &end
#
#   72 ALA  MB           76 GLN  HE2-        3.50    (#   1353:10  Unique         1.94, 3.18 A)
 &rst
  ixpk= 1353, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1035,1036,1037,
 igr2=1104,1105,
 &end
#
#  108 GLU  HA          111 ASN  HD2+        4.50    (#   1354:10  Unique         1.94, 2.73 A)
 &rst
  ixpk= 1354, nxpk= 10, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1633,1634,
 &end
#
#    0 AMB  10-2:1355     0 AMB  10-1:1355   5.50    (#   1355:10  Double Ambig)
 &rst
  ixpk= 1355, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1592,1593,1594,1596,1597,1598, 101, 102, 103,
 igr2=1104,1105,1104,1105,
 &end
#
#    0 AMB  10-2:1357     0 AMB  10-1:1357   5.50    (#   1357:10  Double Ambig)
 &rst
  ixpk= 1357, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1096,1097,1081,1082,
 igr2=1104,1105,1104,1105,
 &end
#
#    0 AMB  10-2:1358     0 AMB  10-1:1358   5.50    (#   1358:10  Double Ambig)
 &rst
  ixpk= 1358, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 583, 584,1113,1114,
 igr2=1104,1105,1633,1634,
 &end
#
#   76 GLN  HG+          76 GLN  HE2-        3.50    (#   1359:10  Unique         2.42, 3.08 A)
 &rst
  ixpk= 1359, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1099,1100,
 igr2=1104,1105,
 &end
#
#  146 LEU  MDX         143 VAL  HN          7.00    (#   1360:10  Unique         4.11, 6.51 A)
 &rst
  ixpk= 1360, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#    0 AMB  10-2:1361   143 VAL  HN          7.00    (#   1361:10  Single Ambig)
 &rst
  ixpk= 1361, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=2067,2068,2076,2077,
 &end
#
#    0 AMB  10-2:1362   143 VAL  HN          5.50    (#   1362:10  Single Ambig)
 &rst
  ixpk= 1362, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2048,2076,2077,
 &end
#
#  141 SER  HN          143 VAL  HN          7.00    (#   1363:10  Unique         4.23, 4.44 A)
 &rst
  ixpk= 1363, nxpk= 10, iat=2072,2107, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  145 LEU  HN          143 VAL  HN          5.50    (#   1364:10  Unique         3.75, 3.84 A)
 &rst
  ixpk= 1364, nxpk= 10, iat=2137,2107, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 LEU  MDY         143 VAL  HN          5.50    (#   1366:10  Unique         4.11, 6.51 A)
 &rst
  ixpk= 1366, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2165,2166,2167,2169,2170,2171,
 &end
#
#   96 ASP  HA           97 THR  HN          5.50    (#   1367:10  Unique         2.37, 2.74 A)
 &rst
  ixpk= 1367, nxpk= 10, iat=1399,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 ASP  HN           97 THR  HN          5.50    (#   1370:10  Unique         1.87, 2.88 A)
 &rst
  ixpk= 1370, nxpk= 10, iat=1397,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 GLN  HG+          74 GLN  HE2+        3.50    (#   1371:10  Unique         2.15, 3.24 A)
 &rst
  ixpk= 1371, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1067,1068,
 igr2=1072,1073,
 &end
#
#   13 GLY  HA+          13 GLY  HN          4.50    (#   1372:10  Unique         2.37, 2.75 A)
 &rst
  ixpk= 1372, nxpk= 10, iat=  -1, 176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 178, 179,
 &end
#
#   12 LEU  HB+          13 GLY  HN          5.50    (#   1373:10  Unique         4.12, 4.35 A)
 &rst
  ixpk= 1373, nxpk= 10, iat=  -1, 176, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 161, 162,
 &end
#
#    9 GLY  HA-          13 GLY  HN          2.80    (#   1374:10  Unique         2.27, 2.97 A)
 &rst
  ixpk= 1374, nxpk= 10, iat=  -1, 176, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 127, 128,
 &end
#
#    0 AMB  10-2:1376    33 THR  HN          7.00    (#   1376:10  Single Ambig)
 &rst
  ixpk= 1376, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3=10.99, r4=11.49,
 igr1=  85,  86,  87,  89,  90,  91,  85,  86,  87,  89,
        90,  91,  49,  50,  51,
 &end
#
#    0 AMB  10-2:1377     0 AMB  10-1:1377   5.50    (#   1377:10  Double Ambig)
 &rst
  ixpk= 1377, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 464, 541, 542, 136, 137,
 igr2= 460, 176,
 &end
#
#    0 AMB  10-2:1378    33 THR  HN          5.50    (#   1378:10  Single Ambig)
 &rst
  ixpk= 1378, nxpk= 10, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 474, 426,
 &end
#
#   32 THR  HN           33 THR  HN          5.50    (#   1379:10  Unique         4.53, 4.54 A)
 &rst
  ixpk= 1379, nxpk= 10, iat= 446, 460, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1380    47 SER  HN          4.50    (#   1380:10  Single Ambig)
 &rst
  ixpk= 1380, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 679,1197,
 &end
#
#    0 AMB  10-2:1381    47 SER  HN          4.50    (#   1381:10  Single Ambig)
 &rst
  ixpk= 1381, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 654, 681, 682,1159,
 &end
#
#   45 PRO  HB+          47 SER  HN          3.50    (#   1382:10  Unique         3.51, 4.24 A)
 &rst
  ixpk= 1382, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 651, 652,
 &end
#
#   80 LEU  MDX          47 SER  HN          5.50    (#   1383:10  Unique         4.58, 6.84 A)
 &rst
  ixpk= 1383, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#  114 ALA  MB           47 SER  HN          7.00    (#   1384:10  Unique         7.60, 8.62 A)
 &rst
  ixpk= 1384, nxpk= 10, iat=  -1, 668, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1660,1661,1662,
 &end
#
#    0 AMB  10-2:1385     0 AMB  10-1:1385   5.50    (#   1385:10  Double Ambig)
 &rst
  ixpk= 1385, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 807,1728,
 igr2= 926, 927,1700,1701,
 &end
#
#  120 THR  HA          116 GLN  HE2-        4.50    (#   1386:10  Unique         2.18, 3.13 A)
 &rst
  ixpk= 1386, nxpk= 10, iat=1743,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1700,1701,
 &end
#
#    0 AMB  10-2:1387     0 AMB  10-1:1387   3.50    (#   1387:10  Double Ambig)
 &rst
  ixpk= 1387, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1344,1345,1695,1696,
 igr2=1700,1701,1700,1701,
 &end
#
#  116 GLN  HG-         116 GLN  HE2+        3.50    (#   1388:10  Unique         2.25, 3.09 A)
 &rst
  ixpk= 1388, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1695,1696,
 igr2=1700,1701,
 &end
#
#   87 ALA  MB          116 GLN  HE2-        3.50    (#   1389:10  Unique         1.95, 3.34 A)
 &rst
  ixpk= 1389, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1268,1269,1270,
 igr2=1700,1701,
 &end
#
#    0 AMB  10-2:1390     0 AMB  10-1:1390   7.00    (#   1390:10  Double Ambig)
 &rst
  ixpk= 1390, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.34, r4=13.84,
 igr1=1747,1748,1749,1306,1307,1308,1310,1311,
 igr2=1700,1701,1700,1701,1700,1701,
 &end
#
#   66 LEU  MDY          65 ASN  HD2-        5.50    (#   1391:10  Unique         1.95, 4.78 A)
 &rst
  ixpk= 1391, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 926, 927,
 &end
#
#  120 THR  HN          116 GLN  HE2-        4.50    (#   1392:10  Unique         3.36, 3.55 A)
 &rst
  ixpk= 1392, nxpk= 10, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1700,1701,
 &end
#
#  120 THR  HN          116 GLN  HE2+        4.50    (#   1393:10  Unique         3.36, 3.55 A)
 &rst
  ixpk= 1393, nxpk= 10, iat=1741,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1700,1701,
 &end
#
#    0 AMB  10-2:1394     0 AMB  10-1:1394   3.50    (#   1394:10  Double Ambig)
 &rst
  ixpk= 1394, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 921, 922, 787, 788,
 igr2= 926, 927, 926, 927,
 &end
#
#   60 GLY  HA+          65 ASN  HD2+        5.50    (#   1395:10  Unique         1.92, 3.73 A)
 &rst
  ixpk= 1395, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 855, 856,
 igr2= 926, 927,
 &end
#
#   52 VAL  HN           86 GLY  HN          4.50    (#   1396:10  Unique         3.36, 3.50 A)
 &rst
  ixpk= 1396, nxpk= 10, iat= 748,1257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 GLY  HA+          86 GLY  HN          4.50    (#   1398:10  Unique         2.53, 2.76 A)
 &rst
  ixpk= 1398, nxpk= 10, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1259,1260,
 &end
#
#  113 GLY  HA-         113 GLY  HN          2.80    (#   1399:10  Unique         2.57, 2.77 A)
 &rst
  ixpk= 1399, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1651,1652,
 &end
#
#    0 AMB  10-2:1400   113 GLY  HN          4.50    (#   1400:10  Single Ambig)
 &rst
  ixpk= 1400, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1642,1643,1180,1181,
 &end
#
#  111 ASN  HB+         113 GLY  HN          7.00    (#   1401:10  Unique         5.22, 5.48 A)
 &rst
  ixpk= 1401, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1628,1629,
 &end
#
#    0 AMB  10-2:1403   113 GLY  HN          7.00    (#   1403:10  Single Ambig)
 &rst
  ixpk= 1403, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1606,1607,1606,1607,
 &end
#
#   80 LEU  MDX         113 GLY  HN          7.00    (#   1404:10  Unique         3.88, 6.19 A)
 &rst
  ixpk= 1404, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1166,1167,1168,1170,1171,1172,
 &end
#
#   80 LEU  HB-         113 GLY  HN          5.50    (#   1405:10  Unique         3.57, 4.57 A)
 &rst
  ixpk= 1405, nxpk= 10, iat=  -1,1649, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1161,1162,
 &end
#
#   84 ARG  HN           48 GLY  HN          4.50    (#   1406:10  Unique         3.70, 4.09 A)
 &rst
  ixpk= 1406, nxpk= 10, iat=1213, 679, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1407    48 GLY  HN          3.50    (#   1407:10  Single Ambig)
 &rst
  ixpk= 1407, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 672, 673, 672, 673,
 &end
#
#    0 AMB  10-2:1408    48 GLY  HN          5.50    (#   1408:10  Single Ambig)
 &rst
  ixpk= 1408, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1220,1221,1220,1221,1217,1218,
 &end
#
#   49 ILE  MG2          48 GLY  HN          7.00    (#   1409:10  Unique         6.75, 7.43 A)
 &rst
  ixpk= 1409, nxpk= 10, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 692, 693, 694,
 &end
#
#   97 THR  MG2         100 GLY  HN          5.50    (#   1411:10  Unique         3.54, 8.48 A)
 &rst
  ixpk= 1411, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1415,1416,1417,
 &end
#
#   59 ALA  MB           60 GLY  HN          5.50    (#   1413:10  Unique         2.33, 4.00 A)
 &rst
  ixpk= 1413, nxpk= 10, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 847, 848, 849,
 &end
#
#   31 PHE  HN           30 GLY  HN          2.80    (#   1415:10  Unique         1.91, 1.96 A)
 &rst
  ixpk= 1415, nxpk= 10, iat= 426, 419, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1416    30 GLY  HN          5.50    (#   1416:10  Single Ambig)
 &rst
  ixpk= 1416, nxpk= 10, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 430, 431, 401, 402,
 &end
#
#    0 AMB  10-2:1417    30 GLY  HN          5.50    (#   1417:10  Single Ambig)
 &rst
  ixpk= 1417, nxpk= 10, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 398, 399, 383, 384,
 &end
#
#    0 AMB  10-2:1418   140 GLY  HN          5.50    (#   1418:10  Single Ambig)
 &rst
  ixpk= 1418, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2022,2007,
 &end
#
#  142 TRP  HN          140 GLY  HN          5.50    (#   1419:10  Unique         4.27, 4.34 A)
 &rst
  ixpk= 1419, nxpk= 10, iat=2083,2065, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  137 GLU  HA          140 GLY  HN          4.50    (#   1420:10  Unique         3.48, 3.53 A)
 &rst
  ixpk= 1420, nxpk= 10, iat=2009,2065, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1421   140 GLY  HN          7.00    (#   1421:10  Single Ambig)
 &rst
  ixpk= 1421, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1=1996,1997,2111,2011,2012,
 &end
#
#    0 AMB  10-2:1422   140 GLY  HN          5.50    (#   1422:10  Single Ambig)
 &rst
  ixpk= 1422, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2055,2056,2057,2059,2060,2061,2113,2114,2115,2117,
      2118,2119,2113,2114,2115,2117,2118,2119,1764,1765,
      1766,1768,1769,1770,
 &end
#
#  139 LEU  MDX         140 GLY  HN          7.00    (#   1423:10  Unique         4.46, 5.54 A)
 &rst
  ixpk= 1423, nxpk= 10, iat=  -1,2065, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=2055,2056,2057,2059,2060,2061,
 &end
#
#   33 THR  HA            3 ASP  HN          7.00    (#   1425:10  Unique         3.35, 3.49 A)
 &rst
  ixpk= 1425, nxpk= 10, iat= 462,  31, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1426     3 ASP  HN          7.00    (#   1426:10  Single Ambig)
 &rst
  ixpk= 1426, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 428, 381,
 &end
#
#    4 ILE  MD1           3 ASP  HN          7.00    (#   1427:10  Unique         5.66, 6.34 A)
 &rst
  ixpk= 1427, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=  56,  57,  58,
 &end
#
#    4 ILE  HB            3 ASP  HN          7.00    (#   1428:10  Unique         4.24, 4.31 A)
 &rst
  ixpk= 1428, nxpk= 10, iat=  47,  31, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    5 THR  HB            6 LEU  HN          7.00    (#   1429:10  Unique         3.99, 4.08 A)
 &rst
  ixpk= 1429, nxpk= 10, iat=  66,  76, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    8 SER  HA            8 SER  HN          5.50    (#   1430:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 1430, nxpk= 10, iat= 116, 114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 LEU  MDX          26 LEU  HN          4.50    (#   1432:10  Unique         1.94, 3.86 A)
 &rst
  ixpk= 1432, nxpk= 10, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 369, 370, 371, 373, 374, 375,
 &end
#
#   34 GLU  HB+          34 GLU  HN          3.50    (#   1433:10  Unique         2.52, 2.83 A)
 &rst
  ixpk= 1433, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   34 GLU  HG-          34 GLU  HN          7.00    (#   1434:10  Unique         4.42, 4.47 A)
 &rst
  ixpk= 1434, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 481, 482,
 &end
#
#    0 AMB  10-2:1435    50 TRP  HN          7.00    (#   1435:10  Single Ambig)
 &rst
  ixpk= 1435, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 686, 679,
 &end
#
#   49 ILE  HB           50 TRP  HN          7.00    (#   1436:10  Unique         3.91, 4.07 A)
 &rst
  ixpk= 1436, nxpk= 10, iat= 690, 705, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   83 VAL  MGX          50 TRP  HN          5.50    (#   1437:10  Unique         2.57, 4.45 A)
 &rst
  ixpk= 1437, nxpk= 10, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1203,1204,1205,1207,1208,1209,
 &end
#
#    5 THR  MG2          51 LEU  HN          5.50    (#   1438:10  Unique         2.34, 3.29 A)
 &rst
  ixpk= 1438, nxpk= 10, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  68,  69,  70,
 &end
#
#  109 LEU  MDY          52 VAL  HN          7.00    (#   1439:10  Unique         5.65, 7.26 A)
 &rst
  ixpk= 1439, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1592,1593,1594,1596,1597,1598,
 &end
#
#   51 LEU  HB+          52 VAL  HN          7.00    (#   1440:10  Unique         3.26, 3.85 A)
 &rst
  ixpk= 1440, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 733, 734,
 &end
#
#    0 AMB  10-2:1441    52 VAL  HN          7.00    (#   1441:10  Single Ambig)
 &rst
  ixpk= 1441, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1259,1260,1241,1242,
 &end
#
#    0 AMB  10-2:1442    52 VAL  HN          7.00    (#   1442:10  Single Ambig)
 &rst
  ixpk= 1442, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 705,  76,
 &end
#
#    0 AMB  10-2:1443    56 THR  HN          7.00    (#   1443:10  Single Ambig)
 &rst
  ixpk= 1443, nxpk= 10, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1306,1307,1308,1921,1922,1923,
 &end
#
#   90 ILE  HB           56 THR  HN          7.00    (#   1444:10  Unique         4.95, 5.18 A)
 &rst
  ixpk= 1444, nxpk= 10, iat=1304, 805, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   56 THR  HA           57 HIS  HN          3.50    (#   1446:10  Unique         2.98, 3.32 A)
 &rst
  ixpk= 1446, nxpk= 10, iat= 807, 819, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1447    57 HIS  HN          7.00    (#   1447:10  Single Ambig)
 &rst
  ixpk= 1447, nxpk= 10, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1321,1322, 809,
 &end
#
#    0 AMB  10-2:1448    57 HIS  HN          5.50    (#   1448:10  Single Ambig)
 &rst
  ixpk= 1448, nxpk= 10, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 823, 824, 823, 824,
 &end
#
#   56 THR  MG2          57 HIS  HN          5.50    (#   1449:10  Unique         3.89, 4.89 A)
 &rst
  ixpk= 1449, nxpk= 10, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 811, 812, 813,
 &end
#
#   90 ILE  HG1-         57 HIS  HN          7.00    (#   1450:10  Unique         6.35, 7.10 A)
 &rst
  ixpk= 1450, nxpk= 10, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1310,1311,
 &end
#
#   12 LEU  HB+          69 PHE  HN          7.00    (#   1451:10  Unique         4.96, 6.49 A)
 &rst
  ixpk= 1451, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 161, 162,
 &end
#
#   68 PRO  HD+          69 PHE  HN          5.50    (#   1452:10  Unique         2.65, 3.26 A)
 &rst
  ixpk= 1452, nxpk= 10, iat=  -1, 975, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 962, 963,
 &end
#
#    0 AMB  10-2:1453     0 AMB  10-1:1453   2.80    (#   1453:10  Double Ambig)
 &rst
  ixpk= 1453, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 266, 267,1081,1082,
 igr2= 262,1077,
 &end
#
#   41 LEU  MDX          76 GLN  HN          7.00    (#   1454:10  Unique         5.95, 7.39 A)
 &rst
  ixpk= 1454, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 588, 589, 590, 592, 593, 594,
 &end
#
#   73 LEU  HA           76 GLN  HN          7.00    (#   1455:10  Unique         3.75, 3.81 A)
 &rst
  ixpk= 1455, nxpk= 10, iat=1043,1092, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1456    76 GLN  HN          4.50    (#   1456:10  Single Ambig)
 &rst
  ixpk= 1456, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1033,1111,
 &end
#
#   77 LYS  HG+          77 LYS  HN          3.50    (#   1457:10  Unique         3.03, 3.23 A)
 &rst
  ixpk= 1457, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1116,1117,
 &end
#
#   77 LYS  HD+          77 LYS  HN          7.00    (#   1458:10  Unique         5.21, 5.24 A)
 &rst
  ixpk= 1458, nxpk= 10, iat=  -1,1109, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1119,1120,
 &end
#
#   84 ARG  HD+          84 ARG  HN          7.00    (#   1459:10  Unique         2.69, 4.03 A)
 &rst
  ixpk= 1459, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1223,1224,
 &end
#
#   92 SER  HB-          92 SER  HN          5.50    (#   1460:10  Unique         2.26, 3.09 A)
 &rst
  ixpk= 1460, nxpk= 10, iat=  -1,1326, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1330,1331,
 &end
#
#   97 THR  HB           97 THR  HN          7.00    (#   1461:10  Unique         3.15, 3.54 A)
 &rst
  ixpk= 1461, nxpk= 10, iat=1413,1409, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  105 LEU  MDY         105 LEU  HN          7.00    (#   1462:10  Unique         3.58, 4.94 A)
 &rst
  ixpk= 1462, nxpk= 10, iat=  -1,1524, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1533,1534,1535,1537,1538,1539,
 &end
#
#  108 GLU  HB+         108 GLU  HN          2.80    (#   1463:10  Unique         2.26, 2.93 A)
 &rst
  ixpk= 1463, nxpk= 10, iat=  -1,1568, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1572,1573,
 &end
#
#    0 AMB  10-2:1464   110 LYS  HN          7.00    (#   1464:10  Single Ambig)
 &rst
  ixpk= 1464, nxpk= 10, iat=  -1,1602, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1615,1616,1615,1616,
 &end
#
#    0 AMB  10-2:1465   112 SER  HN          7.00    (#   1465:10  Single Ambig)
 &rst
  ixpk= 1465, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1651,1652,1111,
 &end
#
#  115 LYS  HA          115 LYS  HN          3.50    (#   1466:10  Unique         2.94, 2.95 A)
 &rst
  ixpk= 1466, nxpk= 10, iat=1668,1666, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1467   141 SER  HN          2.80    (#   1467:10  Single Ambig)
 &rst
  ixpk= 1467, nxpk= 10, iat=  -1,2072, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2076,2077,2076,2077,
 &end
#
#  147 LYS  HB+         146 LEU  HN          4.50    (#   1468:10  Unique         4.09, 5.08 A)
 &rst
  ixpk= 1468, nxpk= 10, iat=  -1,2156, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2179,2180,
 &end
#
#    0 AMB  10-2:1469   147 LYS  HN          3.50    (#   1469:10  Single Ambig)
 &rst
  ixpk= 1469, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2185,2186,2160,2161,
 &end
#
#    0 AMB  10-2:1470   147 LYS  HN          3.50    (#   1470:10  Single Ambig)
 &rst
  ixpk= 1470, nxpk= 10, iat=  -1,2175, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2185,2186,2160,2161,
 &end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          H1        MET   1   3.276  -2.417   1.384
    2   2H    MET   1          H2        MET   1   2.197  -1.385   2.041
    3   3H    MET   1          H3        MET   1   1.671  -2.569   1.028
    4    HA   MET   1           HA       MET   1   2.762  -1.592  -0.829
    5   1HB   MET   1          HB2       MET   1   0.485  -0.764  -0.378
    6   2HB   MET   1          HB3       MET   1   1.122   0.467   0.719
    7   1HG   MET   1          HG2       MET   1   0.581   1.433  -1.450
    8   2HG   MET   1          HG3       MET   1   2.299   1.562  -1.130
    9   1HE   MET   1          HE1       MET   1  -0.521  -0.036  -3.287
   10   2HE   MET   1          HE2       MET   1   0.157   1.481  -3.924
   11   3HE   MET   1          HE3       MET   1   0.355  -0.031  -4.834
   12    H    ALA   2           H        ALA   2   4.582  -0.548  -1.552
   13    HA   ALA   2           HA       ALA   2   5.894   1.505   0.063
   14   1HB   ALA   2          HB1       ALA   2   6.727  -0.554   1.104
   15   2HB   ALA   2          HB2       ALA   2   7.163  -1.217  -0.494
   16   3HB   ALA   2          HB3       ALA   2   8.014   0.196   0.144
   17    H    ASP   3           H        ASP   3   7.679   2.444  -1.084
   18    HA   ASP   3           HA       ASP   3   7.690   2.090  -4.035
   19   1HB   ASP   3          HB2       ASP   3   7.499   4.372  -3.075
   20   2HB   ASP   3          HB3       ASP   3   9.023   4.136  -2.219
   21    H    ILE   4           H        ILE   4   9.448   1.210  -1.135
   22    HA   ILE   4           HA       ILE   4  11.691   0.149  -2.768
   23    HB   ILE   4           HB       ILE   4  12.105   1.374  -0.033
   24   1HG1  ILE   4          HG12      ILE   4  12.418   2.897  -2.653
   25   2HG1  ILE   4          HG13      ILE   4  11.242   3.235  -1.381
   26   1HG2  ILE   4          HG21      ILE   4  13.792  -0.214  -0.902
   27   2HG2  ILE   4          HG22      ILE   4  14.021   0.809  -2.324
   28   3HG2  ILE   4          HG23      ILE   4  14.457   1.397  -0.708
   29   1HD1  ILE   4          HD11      ILE   4  13.103   3.714   0.203
   30   2HD1  ILE   4          HD12      ILE   4  14.241   3.584  -1.163
   31   3HD1  ILE   4          HD13      ILE   4  12.986   4.829  -1.173
   32    H    THR   5           H        THR   5  12.108  -1.963  -2.299
   33    HA   THR   5           HA       THR   5  10.934  -3.175   0.153
   34    HB   THR   5           HB       THR   5  10.397  -4.364  -1.845
   35    HG1  THR   5           HG1      THR   5  11.173  -6.348  -1.237
   36   1HG2  THR   5          HG21      THR   5  12.167  -3.708  -3.400
   37   2HG2  THR   5          HG22      THR   5  13.371  -4.607  -2.445
   38   3HG2  THR   5          HG23      THR   5  12.067  -5.464  -3.289
   39    H    LEU   6           H        LEU   6  12.266  -3.900   1.783
   40    HA   LEU   6           HA       LEU   6  15.187  -3.235   1.636
   41   1HB   LEU   6          HB2       LEU   6  13.109  -3.034   3.830
   42   2HB   LEU   6          HB3       LEU   6  14.786  -3.278   4.245
   43    HG   LEU   6           HG       LEU   6  13.963  -0.961   4.457
   44   1HD1  LEU   6          HD11      LEU   6  16.366  -1.442   4.238
   45   2HD1  LEU   6          HD12      LEU   6  16.239  -1.237   2.476
   46   3HD1  LEU   6          HD13      LEU   6  15.933   0.131   3.558
   47   1HD2  LEU   6          HD21      LEU   6  13.987  -0.827   1.423
   48   2HD2  LEU   6          HD22      LEU   6  12.519  -0.892   2.422
   49   3HD2  LEU   6          HD23      LEU   6  13.629   0.485   2.559
   50    H    ILE   7           H        ILE   7  15.804  -5.251   0.859
   51    HA   ILE   7           HA       ILE   7  14.577  -7.703   1.874
   52    HB   ILE   7           HB       ILE   7  16.748  -7.244  -0.224
   53   1HG1  ILE   7          HG12      ILE   7  13.751  -7.631  -0.668
   54   2HG1  ILE   7          HG13      ILE   7  14.586  -6.087  -0.808
   55   1HG2  ILE   7          HG21      ILE   7  16.648  -9.561   0.713
   56   2HG2  ILE   7          HG22      ILE   7  14.944  -9.665   0.221
   57   3HG2  ILE   7          HG23      ILE   7  16.232  -9.509  -0.991
   58   1HD1  ILE   7          HD11      ILE   7  15.990  -6.981  -2.643
   59   2HD1  ILE   7          HD12      ILE   7  15.042  -8.488  -2.604
   60   3HD1  ILE   7          HD13      ILE   7  14.256  -6.959  -3.008
   61    H    SER   8           H        SER   8  15.316  -8.254   3.875
   62    HA   SER   8           HA       SER   8  18.098  -7.568   4.625
   63   1HB   SER   8          HB2       SER   8  15.608  -7.514   6.352
   64   2HB   SER   8          HB3       SER   8  17.164  -6.735   6.642
   65    HG   SER   8           HG       SER   8  15.161  -6.126   4.691
   66    H    GLY   9           H        GLY   9  17.949 -10.180   3.773
   67   1HA   GLY   9          HA2       GLY   9  17.788 -11.807   6.241
   68   2HA   GLY   9          HA3       GLY   9  16.614 -12.108   4.966
   69    H    SER  10           H        SER  10  20.218 -11.596   5.117
   70    HA   SER  10           HA       SER  10  21.195 -12.872   3.027
   71   1HB   SER  10          HB2       SER  10  22.246 -13.493   5.802
   72   2HB   SER  10          HB3       SER  10  23.161 -13.302   4.303
   73    HG   SER  10           HG       SER  10  23.033 -11.491   5.943
   74    H    THR  11           H        THR  11  20.367 -14.713   6.014
   75    HA   THR  11           HA       THR  11  20.484 -17.234   4.454
   76    HB   THR  11           HB       THR  11  20.844 -17.601   7.315
   77    HG1  THR  11           HG1      THR  11  22.651 -16.407   7.665
   78   1HG2  THR  11          HG21      THR  11  21.646 -19.114   5.529
   79   2HG2  THR  11          HG22      THR  11  22.769 -17.857   4.961
   80   3HG2  THR  11          HG23      THR  11  22.975 -18.585   6.572
   81    H    LEU  12           H        LEU  12  18.200 -15.803   4.279
   82    HA   LEU  12           HA       LEU  12  16.034 -15.647   4.603
   83   1HB   LEU  12          HB2       LEU  12  16.205 -18.215   4.277
   84   2HB   LEU  12          HB3       LEU  12  15.957 -18.326   6.013
   85    HG   LEU  12           HG       LEU  12  13.748 -17.121   5.723
   86   1HD1  LEU  12          HD11      LEU  12  14.124 -15.898   3.626
   87   2HD1  LEU  12          HD12      LEU  12  14.379 -17.424   2.751
   88   3HD1  LEU  12          HD13      LEU  12  12.785 -17.021   3.422
   89   1HD2  LEU  12          HD21      LEU  12  14.124 -19.649   4.063
   90   2HD2  LEU  12          HD22      LEU  12  13.899 -19.581   5.823
   91   3HD2  LEU  12          HD23      LEU  12  12.593 -19.060   4.750
   92    H    GLY  13           H        GLY  13  17.953 -14.682   6.491
   93   1HA   GLY  13          HA2       GLY  13  16.340 -13.497   8.475
   94   2HA   GLY  13          HA3       GLY  13  17.328 -14.791   9.204
   95    H    GLY  14           H        GLY  14  17.761 -11.914   9.673
   96   1HA   GLY  14          HA2       GLY  14  20.483 -11.446   9.019
   97   2HA   GLY  14          HA3       GLY  14  19.457 -10.742   7.763
   98    H    ALA  15           H        ALA  15  20.403  -8.736   8.522
   99    HA   ALA  15           HA       ALA  15  20.098  -7.781  11.204
  100   1HB   ALA  15          HB1       ALA  15  22.041  -7.296   9.725
  101   2HB   ALA  15          HB2       ALA  15  20.980  -6.328   8.670
  102   3HB   ALA  15          HB3       ALA  15  21.281  -5.825  10.348
  103    H    GLU  16           H        GLU  16  17.528  -8.300  10.641
  104    HA   GLU  16           HA       GLU  16  15.967  -6.370   9.342
  105   1HB   GLU  16          HB2       GLU  16  15.334  -8.144  11.727
  106   2HB   GLU  16          HB3       GLU  16  14.125  -7.171  10.878
  107   1HG   GLU  16          HG2       GLU  16  14.602  -8.343   8.766
  108   2HG   GLU  16          HG3       GLU  16  15.826  -9.333   9.565
  109    H    TYR  17           H        TYR  17  17.380  -6.188  12.622
  110    HA   TYR  17           HA       TYR  17  15.905  -3.943  13.575
  111   1HB   TYR  17          HB2       TYR  17  17.316  -5.335  15.010
  112   2HB   TYR  17          HB3       TYR  17  18.758  -4.867  14.124
  113    HD1  TYR  17           HD1      TYR  17  16.297  -3.836  16.668
  114    HD2  TYR  17           HD2      TYR  17  19.750  -2.601  14.388
  115    HE1  TYR  17           HE1      TYR  17  16.654  -1.947  18.230
  116    HE2  TYR  17           HE2      TYR  17  20.094  -0.697  15.922
  117    HH   TYR  17           HH       TYR  17  19.342   0.411  17.834
  118    H    VAL  18           H        VAL  18  18.998  -4.117  11.731
  119    HA   VAL  18           HA       VAL  18  19.351  -1.250  11.591
  120    HB   VAL  18           HB       VAL  18  20.557  -3.606  10.085
  121   1HG1  VAL  18          HG11      VAL  18  20.760  -1.700   8.595
  122   2HG1  VAL  18          HG12      VAL  18  21.370  -0.678   9.919
  123   3HG1  VAL  18          HG13      VAL  18  22.322  -2.060   9.325
  124   1HG2  VAL  18          HG21      VAL  18  21.690  -1.780  12.255
  125   2HG2  VAL  18          HG22      VAL  18  21.170  -3.463  12.491
  126   3HG2  VAL  18          HG23      VAL  18  22.555  -3.109  11.459
  127    H    ALA  19           H        ALA  19  17.876  -3.753   9.461
  128    HA   ALA  19           HA       ALA  19  17.329  -2.020   7.287
  129   1HB   ALA  19          HB1       ALA  19  17.211  -4.471   7.181
  130   2HB   ALA  19          HB2       ALA  19  15.748  -4.442   8.203
  131   3HB   ALA  19          HB3       ALA  19  15.725  -3.690   6.600
  132    H    GLU  20           H        GLU  20  15.410  -2.665  10.279
  133    HA   GLU  20           HA       GLU  20  13.167  -1.114   9.454
  134   1HB   GLU  20          HB2       GLU  20  13.221  -2.802  11.304
  135   2HB   GLU  20          HB3       GLU  20  14.160  -1.669  12.285
  136   1HG   GLU  20          HG2       GLU  20  12.297  -0.046  12.209
  137   2HG   GLU  20          HG3       GLU  20  11.391  -1.112  11.132
  138    H    HIS  21           H        HIS  21  16.200  -0.234  11.188
  139    HA   HIS  21           HA       HIS  21  15.470   2.490  11.686
  140   1HB   HIS  21          HB2       HIS  21  17.334   1.315  12.813
  141   2HB   HIS  21          HB3       HIS  21  18.227   1.247  11.295
  142    HD1  HIS  21           HD1      HIS  21  19.600   3.443  10.655
  143    HD2  HIS  21           HD2      HIS  21  16.950   3.833  13.906
  144    HE1  HIS  21           HE1      HIS  21  20.072   5.717  11.694
  145    H    LEU  22           H        LEU  22  17.254   0.938   8.970
  146    HA   LEU  22           HA       LEU  22  17.674   3.252   7.374
  147   1HB   LEU  22          HB2       LEU  22  17.226   0.321   6.696
  148   2HB   LEU  22          HB3       LEU  22  17.541   1.510   5.448
  149    HG   LEU  22           HG       LEU  22  19.463   1.129   7.774
  150   1HD1  LEU  22          HD11      LEU  22  19.156  -1.045   6.668
  151   2HD1  LEU  22          HD12      LEU  22  19.442  -0.303   5.080
  152   3HD1  LEU  22          HD13      LEU  22  20.735  -0.383   6.304
  153   1HD2  LEU  22          HD21      LEU  22  19.796   2.248   4.946
  154   2HD2  LEU  22          HD22      LEU  22  19.739   3.203   6.442
  155   3HD2  LEU  22          HD23      LEU  22  21.083   2.095   6.157
  156    H    ALA  23           H        ALA  23  14.933   0.928   7.430
  157    HA   ALA  23           HA       ALA  23  13.421   2.036   5.359
  158   1HB   ALA  23          HB1       ALA  23  12.946  -0.160   6.377
  159   2HB   ALA  23          HB2       ALA  23  12.476   0.624   7.897
  160   3HB   ALA  23          HB3       ALA  23  11.508   0.865   6.445
  161    H    GLU  24           H        GLU  24  13.341   2.820   8.898
  162    HA   GLU  24           HA       GLU  24  11.285   4.750   8.700
  163   1HB   GLU  24          HB2       GLU  24  12.122   3.691  10.793
  164   2HB   GLU  24          HB3       GLU  24  13.600   4.658  10.686
  165   1HG   GLU  24          HG2       GLU  24  12.275   6.735  10.859
  166   2HG   GLU  24          HG3       GLU  24  10.776   5.802  10.848
  167    H    LYS  25           H        LYS  25  14.883   5.193   8.491
  168    HA   LYS  25           HA       LYS  25  14.745   8.030   8.100
  169   1HB   LYS  25          HB2       LYS  25  16.817   5.991   7.175
  170   2HB   LYS  25          HB3       LYS  25  17.026   7.729   7.043
  171   1HG   LYS  25          HG2       LYS  25  16.740   6.151   9.634
  172   2HG   LYS  25          HG3       LYS  25  18.226   6.808   8.969
  173   1HD   LYS  25          HD2       LYS  25  15.865   8.394  10.062
  174   2HD   LYS  25          HD3       LYS  25  17.450   8.168  10.805
  175   1HE   LYS  25          HE2       LYS  25  18.482   9.317   8.786
  176   2HE   LYS  25          HE3       LYS  25  16.845   9.696   8.234
  177   1HZ   LYS  25          HZ1       LYS  25  16.526  10.929  10.326
  178   2HZ   LYS  25          HZ2       LYS  25  18.064  10.607  10.779
  179   3HZ   LYS  25          HZ3       LYS  25  17.776  11.531   9.472
  180    H    LEU  26           H        LEU  26  14.424   5.327   5.796
  181    HA   LEU  26           HA       LEU  26  14.477   7.022   3.454
  182   1HB   LEU  26          HB2       LEU  26  13.609   4.191   4.050
  183   2HB   LEU  26          HB3       LEU  26  13.341   4.894   2.455
  184    HG   LEU  26           HG       LEU  26  16.105   4.912   3.727
  185   1HD1  LEU  26          HD11      LEU  26  15.321   2.574   3.709
  186   2HD1  LEU  26          HD12      LEU  26  14.939   2.710   1.976
  187   3HD1  LEU  26          HD13      LEU  26  16.621   2.843   2.548
  188   1HD2  LEU  26          HD21      LEU  26  15.100   5.041   0.847
  189   2HD2  LEU  26          HD22      LEU  26  15.828   6.370   1.771
  190   3HD2  LEU  26          HD23      LEU  26  16.801   4.963   1.317
  191    H    GLU  27           H        GLU  27  11.815   5.907   5.644
  192    HA   GLU  27           HA       GLU  27   9.816   7.074   3.902
  193   1HB   GLU  27          HB2       GLU  27   9.610   6.416   6.864
  194   2HB   GLU  27          HB3       GLU  27   8.282   6.932   5.806
  195   1HG   GLU  27          HG2       GLU  27   9.020   4.929   4.285
  196   2HG   GLU  27          HG3       GLU  27   9.856   4.369   5.726
  197    H    GLU  28           H        GLU  28  11.720   8.279   6.693
  198    HA   GLU  28           HA       GLU  28  10.574  10.880   6.798
  199   1HB   GLU  28          HB2       GLU  28  13.356   9.839   7.449
  200   2HB   GLU  28          HB3       GLU  28  12.889  11.506   7.731
  201   1HG   GLU  28          HG2       GLU  28  11.344   9.172   8.935
  202   2HG   GLU  28          HG3       GLU  28  12.755   9.886   9.705
  203    H    ALA  29           H        ALA  29  13.037   9.508   4.605
  204    HA   ALA  29           HA       ALA  29  13.765  11.963   3.348
  205   1HB   ALA  29          HB1       ALA  29  15.116   9.906   3.177
  206   2HB   ALA  29          HB2       ALA  29  13.827   9.132   2.224
  207   3HB   ALA  29          HB3       ALA  29  14.672  10.533   1.577
  208    H    GLY  30           H        GLY  30  10.791  10.172   3.133
  209   1HA   GLY  30          HA2       GLY  30   8.977  11.476   2.252
  210   2HA   GLY  30          HA3       GLY  30   9.953  11.917   0.850
  211    H    PHE  31           H        PHE  31  10.077   8.563   1.952
  212    HA   PHE  31           HA       PHE  31   8.429   7.753  -0.410
  213   1HB   PHE  31          HB2       PHE  31  10.845   6.288   0.677
  214   2HB   PHE  31          HB3       PHE  31  10.011   6.019  -0.847
  215    HD1  PHE  31           HD1      PHE  31  12.917   7.359   0.536
  216    HD2  PHE  31           HD2      PHE  31   9.893   8.307  -2.392
  217    HE1  PHE  31           HE1      PHE  31  14.460   8.958  -0.546
  218    HE2  PHE  31           HE2      PHE  31  11.453   9.902  -3.479
  219    HZ   PHE  31           HZ       PHE  31  13.740  10.236  -2.555
  220    H    THR  32           H        THR  32   8.259   5.057  -0.007
  221    HA   THR  32           HA       THR  32   7.401   4.582   2.778
  222    HB   THR  32           HB       THR  32   5.509   3.197   1.778
  223    HG1  THR  32           HG1      THR  32   4.796   3.949  -0.284
  224   1HG2  THR  32          HG21      THR  32   5.144   5.379   2.932
  225   2HG2  THR  32          HG22      THR  32   5.300   6.216   1.373
  226   3HG2  THR  32          HG23      THR  32   3.963   5.076   1.649
  227    H    THR  33           H        THR  33   7.894   2.455   3.468
  228    HA   THR  33           HA       THR  33   9.611   0.912   1.586
  229    HB   THR  33           HB       THR  33  11.193   0.744   3.524
  230    HG1  THR  33           HG1      THR  33  10.837   2.638   5.014
  231   1HG2  THR  33          HG21      THR  33  11.260   2.549   1.597
  232   2HG2  THR  33          HG22      THR  33  10.831   3.685   2.880
  233   3HG2  THR  33          HG23      THR  33  12.314   2.700   3.002
  234    H    GLU  34           H        GLU  34  10.043  -1.296   2.211
  235    HA   GLU  34           HA       GLU  34   8.060  -2.472   4.093
  236   1HB   GLU  34          HB2       GLU  34   7.675  -2.605   1.429
  237   2HB   GLU  34          HB3       GLU  34   8.803  -3.930   1.558
  238   1HG   GLU  34          HG2       GLU  34   6.673  -4.908   1.761
  239   2HG   GLU  34          HG3       GLU  34   7.276  -4.861   3.413
  240    H    THR  35           H        THR  35   9.604  -2.684   5.740
  241    HA   THR  35           HA       THR  35  12.160  -3.918   5.457
  242    HB   THR  35           HB       THR  35  10.426  -3.988   7.943
  243    HG1  THR  35           HG1      THR  35  10.753  -1.900   8.280
  244   1HG2  THR  35          HG21      THR  35  12.703  -5.035   8.000
  245   2HG2  THR  35          HG22      THR  35  13.404  -3.478   7.506
  246   3HG2  THR  35          HG23      THR  35  12.580  -3.635   9.075
  247    H    LEU  36           H        LEU  36  12.548  -6.048   4.911
  248    HA   LEU  36           HA       LEU  36  10.601  -8.162   5.691
  249   1HB   LEU  36          HB2       LEU  36  11.606  -7.414   2.902
  250   2HB   LEU  36          HB3       LEU  36  10.832  -8.946   3.265
  251    HG   LEU  36           HG       LEU  36   9.435  -6.263   3.623
  252   1HD1  LEU  36          HD11      LEU  36  10.047  -6.559   1.299
  253   2HD1  LEU  36          HD12      LEU  36   9.379  -8.206   1.293
  254   3HD1  LEU  36          HD13      LEU  36   8.308  -6.795   1.499
  255   1HD2  LEU  36          HD21      LEU  36   8.330  -9.104   3.481
  256   2HD2  LEU  36          HD22      LEU  36   8.434  -8.106   4.950
  257   3HD2  LEU  36          HD23      LEU  36   7.383  -7.610   3.622
  258    H    HIS  37           H        HIS  37  11.627 -10.219   5.859
  259    HA   HIS  37           HA       HIS  37  14.550 -10.340   5.349
  260   1HB   HIS  37          HB2       HIS  37  14.317 -12.632   6.407
  261   2HB   HIS  37          HB3       HIS  37  14.071 -11.232   7.429
  262    HD1  HIS  37           HD1      HIS  37  11.835 -11.072   8.718
  263    HD2  HIS  37           HD2      HIS  37  11.900 -13.950   5.632
  264    HE1  HIS  37           HE1      HIS  37   9.656 -12.408   8.919
  265    H    GLY  38           H        GLY  38  12.869  -9.886   3.139
  266   1HA   GLY  38          HA2       GLY  38  12.227 -10.599   1.083
  267   2HA   GLY  38          HA3       GLY  38  13.711 -11.548   1.139
  268    HA   PRO  39           HA       PRO  39  10.631 -14.790   2.727
  269   1HB   PRO  39          HB2       PRO  39   7.965 -14.288   3.134
  270   2HB   PRO  39          HB3       PRO  39   9.229 -13.936   4.349
  271   1HG   PRO  39          HG2       PRO  39   7.990 -12.020   2.347
  272   2HG   PRO  39          HG3       PRO  39   8.215 -11.784   4.111
  273   1HD   PRO  39          HD2       PRO  39   9.980 -10.793   2.288
  274   2HD   PRO  39          HD3       PRO  39  10.531 -11.445   3.865
  275    H    LEU  40           H        LEU  40   9.707 -12.640   0.151
  276    HA   LEU  40           HA       LEU  40   8.664 -14.920  -1.478
  277   1HB   LEU  40          HB2       LEU  40   7.960 -11.954  -1.587
  278   2HB   LEU  40          HB3       LEU  40   7.403 -13.155  -2.745
  279    HG   LEU  40           HG       LEU  40   6.703 -13.175   0.218
  280   1HD1  LEU  40          HD11      LEU  40   5.700 -11.274  -0.981
  281   2HD1  LEU  40          HD12      LEU  40   5.053 -12.374  -2.217
  282   3HD1  LEU  40          HD13      LEU  40   4.470 -12.467  -0.540
  283   1HD2  LEU  40          HD21      LEU  40   5.689 -14.887  -2.101
  284   2HD2  LEU  40          HD22      LEU  40   6.639 -15.451  -0.709
  285   3HD2  LEU  40          HD23      LEU  40   4.996 -14.859  -0.465
  286    H    LEU  41           H        LEU  41  11.456 -13.635  -0.977
  287    HA   LEU  41           HA       LEU  41  13.301 -12.955  -1.959
  288   1HB   LEU  41          HB2       LEU  41  12.828 -14.871  -3.554
  289   2HB   LEU  41          HB3       LEU  41  12.115 -13.694  -4.648
  290    HG   LEU  41           HG       LEU  41  14.394 -12.442  -4.550
  291   1HD1  LEU  41          HD11      LEU  41  15.357 -13.605  -2.605
  292   2HD1  LEU  41          HD12      LEU  41  15.237 -15.163  -3.453
  293   3HD1  LEU  41          HD13      LEU  41  16.340 -13.900  -4.043
  294   1HD2  LEU  41          HD21      LEU  41  14.159 -15.183  -5.842
  295   2HD2  LEU  41          HD22      LEU  41  13.644 -13.626  -6.518
  296   3HD2  LEU  41          HD23      LEU  41  15.367 -13.943  -6.264
  297    H    GLU  42           H        GLU  42  10.450 -11.812  -3.776
  298    HA   GLU  42           HA       GLU  42  11.528  -9.063  -3.941
  299   1HB   GLU  42          HB2       GLU  42  11.020  -9.095  -6.389
  300   2HB   GLU  42          HB3       GLU  42  12.410 -10.044  -5.888
  301   1HG   GLU  42          HG2       GLU  42  11.127 -12.135  -6.105
  302   2HG   GLU  42          HG3       GLU  42   9.692 -11.243  -6.585
  303    H    ASP  43           H        ASP  43   9.867  -8.776  -2.281
  304    HA   ASP  43           HA       ASP  43   7.092  -9.284  -2.732
  305   1HB   ASP  43          HB2       ASP  43   7.930  -8.768  -0.521
  306   2HB   ASP  43          HB3       ASP  43   8.476  -7.168  -1.053
  307    H    LEU  44           H        LEU  44   9.148  -6.461  -3.516
  308    HA   LEU  44           HA       LEU  44   6.965  -5.256  -5.128
  309   1HB   LEU  44          HB2       LEU  44   9.829  -4.342  -4.604
  310   2HB   LEU  44          HB3       LEU  44   8.727  -3.556  -5.721
  311    HG   LEU  44           HG       LEU  44   8.423  -3.736  -2.702
  312   1HD1  LEU  44          HD11      LEU  44  10.024  -2.049  -3.666
  313   2HD1  LEU  44          HD12      LEU  44   8.676  -1.331  -4.559
  314   3HD1  LEU  44          HD13      LEU  44   8.664  -1.325  -2.784
  315   1HD2  LEU  44          HD21      LEU  44   6.456  -2.587  -4.729
  316   2HD2  LEU  44          HD22      LEU  44   6.163  -3.920  -3.582
  317   3HD2  LEU  44          HD23      LEU  44   6.409  -2.286  -2.979
  318    HA   PRO  45           HA       PRO  45   8.295  -7.621  -8.562
  319   1HB   PRO  45          HB2       PRO  45   7.481  -6.124 -10.720
  320   2HB   PRO  45          HB3       PRO  45   6.347  -6.889  -9.574
  321   1HG   PRO  45          HG2       PRO  45   7.355  -4.029  -9.557
  322   2HG   PRO  45          HG3       PRO  45   5.658  -4.602  -9.466
  323   1HD   PRO  45          HD2       PRO  45   7.069  -3.960  -7.234
  324   2HD   PRO  45          HD3       PRO  45   5.929  -5.337  -7.237
  325    H    ALA  46           H        ALA  46   9.418  -7.237 -10.853
  326    HA   ALA  46           HA       ALA  46  12.090  -6.308 -10.456
  327   1HB   ALA  46          HB1       ALA  46  11.479  -8.237 -11.889
  328   2HB   ALA  46          HB2       ALA  46  10.588  -7.147 -12.984
  329   3HB   ALA  46          HB3       ALA  46  12.346  -7.013 -12.826
  330    H    SER  47           H        SER  47   9.956  -4.172 -10.200
  331    HA   SER  47           HA       SER  47  11.168  -2.126 -11.896
  332   1HB   SER  47          HB2       SER  47   8.145  -2.477 -11.707
  333   2HB   SER  47          HB3       SER  47   9.019  -1.221 -12.599
  334    HG   SER  47           HG       SER  47   8.266  -2.935 -13.939
  335    H    GLY  48           H        GLY  48  11.416  -0.266 -10.609
  336   1HA   GLY  48          HA2       GLY  48  10.278   1.168  -8.864
  337   2HA   GLY  48          HA3       GLY  48  10.130  -0.303  -7.897
  338    H    ILE  49           H        ILE  49  11.521   0.033  -6.225
  339    HA   ILE  49           HA       ILE  49  14.407   0.417  -6.830
  340    HB   ILE  49           HB       ILE  49  13.006   1.482  -4.366
  341   1HG1  ILE  49          HG12      ILE  49  12.022   2.780  -6.212
  342   2HG1  ILE  49          HG13      ILE  49  12.970   3.725  -5.090
  343   1HG2  ILE  49          HG21      ILE  49  15.418   1.118  -4.137
  344   2HG2  ILE  49          HG22      ILE  49  15.735   2.095  -5.574
  345   3HG2  ILE  49          HG23      ILE  49  15.052   2.849  -4.120
  346   1HD1  ILE  49          HD11      ILE  49  14.792   3.959  -6.663
  347   2HD1  ILE  49          HD12      ILE  49  14.019   2.827  -7.799
  348   3HD1  ILE  49          HD13      ILE  49  13.277   4.401  -7.460
  349    H    TRP  50           H        TRP  50  15.646  -1.124  -5.745
  350    HA   TRP  50           HA       TRP  50  14.359  -2.745  -3.579
  351   1HB   TRP  50          HB2       TRP  50  16.390  -3.574  -5.691
  352   2HB   TRP  50          HB3       TRP  50  16.064  -4.493  -4.240
  353    HD1  TRP  50           HD1      TRP  50  12.835  -3.356  -5.806
  354    HE1  TRP  50           HE1      TRP  50  11.766  -5.253  -7.139
  355    HE3  TRP  50           HE3      TRP  50  16.730  -6.679  -5.712
  356    HZ2  TRP  50           HZ2      TRP  50  12.483  -7.921  -7.996
  357    HZ3  TRP  50           HZ3      TRP  50  16.496  -8.906  -6.775
  358    HH2  TRP  50           HH2      TRP  50  14.379  -9.540  -7.915
  359    H    LEU  51           H        LEU  51  15.846  -3.265  -1.830
  360    HA   LEU  51           HA       LEU  51  18.585  -2.188  -1.949
  361   1HB   LEU  51          HB2       LEU  51  16.557  -1.645   0.256
  362   2HB   LEU  51          HB3       LEU  51  18.296  -1.471   0.478
  363    HG   LEU  51           HG       LEU  51  16.609   0.151  -1.478
  364   1HD1  LEU  51          HD11      LEU  51  16.125   0.678   0.870
  365   2HD1  LEU  51          HD12      LEU  51  17.848   0.938   1.188
  366   3HD1  LEU  51          HD13      LEU  51  16.973   2.011   0.074
  367   1HD2  LEU  51          HD21      LEU  51  19.571   0.308  -0.766
  368   2HD2  LEU  51          HD22      LEU  51  18.845   0.051  -2.360
  369   3HD2  LEU  51          HD23      LEU  51  18.676   1.614  -1.571
  370    H    VAL  52           H        VAL  52  19.987  -3.545  -0.708
  371    HA   VAL  52           HA       VAL  52  18.739  -6.054   0.331
  372    HB   VAL  52           HB       VAL  52  21.164  -5.834  -1.502
  373   1HG1  VAL  52          HG11      VAL  52  21.337  -7.716   0.095
  374   2HG1  VAL  52          HG12      VAL  52  19.720  -8.279  -0.374
  375   3HG1  VAL  52          HG13      VAL  52  21.058  -8.310  -1.545
  376   1HG2  VAL  52          HG21      VAL  52  18.374  -6.921  -2.093
  377   2HG2  VAL  52          HG22      VAL  52  19.101  -5.467  -2.809
  378   3HG2  VAL  52          HG23      VAL  52  19.783  -7.052  -3.167
  379    H    ILE  53           H        ILE  53  19.451  -6.511   2.341
  380    HA   ILE  53           HA       ILE  53  21.701  -4.906   3.430
  381    HB   ILE  53           HB       ILE  53  19.063  -5.524   4.828
  382   1HG1  ILE  53          HG12      ILE  53  18.971  -2.852   4.636
  383   2HG1  ILE  53          HG13      ILE  53  19.904  -3.143   3.177
  384   1HG2  ILE  53          HG21      ILE  53  21.035  -5.236   6.310
  385   2HG2  ILE  53          HG22      ILE  53  21.379  -3.669   5.549
  386   3HG2  ILE  53          HG23      ILE  53  19.889  -3.910   6.489
  387   1HD1  ILE  53          HD11      ILE  53  17.990  -4.723   2.453
  388   2HD1  ILE  53          HD12      ILE  53  17.101  -4.056   3.833
  389   3HD1  ILE  53          HD13      ILE  53  17.642  -3.000   2.521
  390    H    SER  54           H        SER  54  23.264  -6.375   3.576
  391    HA   SER  54           HA       SER  54  22.908  -8.888   5.081
  392   1HB   SER  54          HB2       SER  54  24.014  -8.821   2.243
  393   2HB   SER  54          HB3       SER  54  23.728 -10.241   3.255
  394    HG   SER  54           HG       SER  54  22.100  -9.882   1.638
  395    H    SER  55           H        SER  55  25.294  -9.941   5.182
  396    HA   SER  55           HA       SER  55  27.364  -7.790   5.230
  397   1HB   SER  55          HB2       SER  55  26.754  -9.685   7.525
  398   2HB   SER  55          HB3       SER  55  28.016  -8.440   7.466
  399    HG   SER  55           HG       SER  55  26.165  -7.705   8.568
  400    H    THR  56           H        THR  56  27.913  -8.945   3.187
  401    HA   THR  56           HA       THR  56  28.516 -11.701   3.145
  402    HB   THR  56           HB       THR  56  29.491 -11.047   0.881
  403    HG1  THR  56           HG1      THR  56  29.548  -9.031   0.332
  404   1HG2  THR  56          HG21      THR  56  27.112 -11.631   1.064
  405   2HG2  THR  56          HG22      THR  56  26.707  -9.964   1.531
  406   3HG2  THR  56          HG23      THR  56  27.346 -10.312  -0.088
  407    H    HIS  57           H        HIS  57  30.566  -9.142   4.320
  408    HA   HIS  57           HA       HIS  57  33.030 -10.318   3.338
  409   1HB   HIS  57          HB2       HIS  57  33.110  -8.067   3.315
  410   2HB   HIS  57          HB3       HIS  57  32.233  -7.859   4.804
  411    HD1  HIS  57           HD1      HIS  57  34.003  -6.022   5.562
  412    HD2  HIS  57           HD2      HIS  57  35.546  -9.897   4.979
  413    HE1  HIS  57           HE1      HIS  57  36.297  -6.055   6.646
  414    H    GLY  58           H        GLY  58  33.284  -9.403   6.700
  415   1HA   GLY  58          HA2       GLY  58  34.638 -11.846   7.164
  416   2HA   GLY  58          HA3       GLY  58  34.330 -10.579   8.356
  417    H    ALA  59           H        ALA  59  31.384 -11.585   7.100
  418    HA   ALA  59           HA       ALA  59  30.979 -13.871   8.924
  419   1HB   ALA  59          HB1       ALA  59  30.181 -11.846  10.103
  420   2HB   ALA  59          HB2       ALA  59  29.163 -11.425   8.705
  421   3HB   ALA  59          HB3       ALA  59  28.826 -12.892   9.651
  422    H    GLY  60           H        GLY  60  31.283 -13.180   5.827
  423   1HA   GLY  60          HA2       GLY  60  28.751 -13.929   4.679
  424   2HA   GLY  60          HA3       GLY  60  30.324 -13.918   3.864
  425    H    ASP  61           H        ASP  61  27.905 -15.930   5.091
  426    HA   ASP  61           HA       ASP  61  29.418 -18.085   6.108
  427   1HB   ASP  61          HB2       ASP  61  26.984 -17.752   6.451
  428   2HB   ASP  61          HB3       ASP  61  26.696 -18.176   4.757
  429    H    ILE  62           H        ILE  62  29.669 -20.177   5.228
  430    HA   ILE  62           HA       ILE  62  31.615 -20.498   3.579
  431    HB   ILE  62           HB       ILE  62  29.270 -22.344   4.005
  432   1HG1  ILE  62          HG12      ILE  62  30.673 -21.662   5.974
  433   2HG1  ILE  62          HG13      ILE  62  30.519 -23.381   5.685
  434   1HG2  ILE  62          HG21      ILE  62  30.223 -23.238   1.987
  435   2HG2  ILE  62          HG22      ILE  62  31.873 -23.092   2.627
  436   3HG2  ILE  62          HG23      ILE  62  30.726 -24.255   3.334
  437   1HD1  ILE  62          HD11      ILE  62  32.792 -23.517   4.814
  438   2HD1  ILE  62          HD12      ILE  62  32.972 -21.746   4.896
  439   3HD1  ILE  62          HD13      ILE  62  32.799 -22.701   6.380
  440    HA   PRO  63           HA       PRO  63  29.686 -21.506  -0.523
  441   1HB   PRO  63          HB2       PRO  63  27.098 -20.920  -1.263
  442   2HB   PRO  63          HB3       PRO  63  27.569 -22.400  -0.374
  443   1HG   PRO  63          HG2       PRO  63  26.481 -19.808   0.784
  444   2HG   PRO  63          HG3       PRO  63  25.926 -21.482   1.103
  445   1HD   PRO  63          HD2       PRO  63  27.639 -20.265   2.786
  446   2HD   PRO  63          HD3       PRO  63  27.860 -21.987   2.360
  447    H    ASP  64           H        ASP  64  28.633 -18.390   0.790
  448    HA   ASP  64           HA       ASP  64  29.444 -16.659  -1.309
  449   1HB   ASP  64          HB2       ASP  64  27.852 -17.695  -2.810
  450   2HB   ASP  64          HB3       ASP  64  26.622 -17.795  -1.552
  451    H    ASN  65           H        ASN  65  26.738 -17.470   0.766
  452    HA   ASN  65           HA       ASN  65  26.629 -16.638   3.027
  453   1HB   ASN  65          HB2       ASN  65  27.904 -14.506   2.643
  454   2HB   ASN  65          HB3       ASN  65  26.488 -13.869   1.794
  455   1HD2  ASN  65          HD22      ASN  65  25.763 -12.268   3.286
  456   2HD2  ASN  65          HD21      ASN  65  25.465 -12.617   4.974
  457    H    LEU  66           H        LEU  66  25.055 -15.686  -0.020
  458    HA   LEU  66           HA       LEU  66  22.486 -15.368   1.383
  459   1HB   LEU  66          HB2       LEU  66  23.689 -14.225  -1.082
  460   2HB   LEU  66          HB3       LEU  66  22.000 -14.635  -1.215
  461    HG   LEU  66           HG       LEU  66  21.528 -13.394   0.904
  462   1HD1  LEU  66          HD11      LEU  66  23.745 -13.378   1.943
  463   2HD1  LEU  66          HD12      LEU  66  24.430 -12.500   0.553
  464   3HD1  LEU  66          HD13      LEU  66  23.255 -11.717   1.630
  465   1HD2  LEU  66          HD21      LEU  66  22.810 -11.605  -1.166
  466   2HD2  LEU  66          HD22      LEU  66  21.244 -12.398  -1.405
  467   3HD2  LEU  66          HD23      LEU  66  21.463 -11.233  -0.090
  468    H    SER  67           H        SER  67  22.850 -17.823   1.750
  469    HA   SER  67           HA       SER  67  22.956 -19.673  -0.158
  470   1HB   SER  67          HB2       SER  67  21.319 -20.063   2.360
  471   2HB   SER  67          HB3       SER  67  22.242 -21.270   1.453
  472    HG   SER  67           HG       SER  67  23.374 -20.469   3.284
  473    HA   PRO  68           HA       PRO  68  18.389 -20.232  -1.163
  474   1HB   PRO  68          HB2       PRO  68  16.400 -18.583  -0.272
  475   2HB   PRO  68          HB3       PRO  68  16.984 -19.997   0.654
  476   1HG   PRO  68          HG2       PRO  68  17.757 -17.086   1.018
  477   2HG   PRO  68          HG3       PRO  68  17.307 -18.283   2.266
  478   1HD   PRO  68          HD2       PRO  68  19.916 -17.703   1.674
  479   2HD   PRO  68          HD3       PRO  68  19.378 -19.340   2.158
  480    H    PHE  69           H        PHE  69  19.082 -16.729  -0.632
  481    HA   PHE  69           HA       PHE  69  17.518 -15.820  -2.810
  482   1HB   PHE  69          HB2       PHE  69  19.856 -14.554  -1.350
  483   2HB   PHE  69          HB3       PHE  69  18.888 -13.708  -2.539
  484    HD1  PHE  69           HD1      PHE  69  19.252 -12.368  -0.159
  485    HD2  PHE  69           HD2      PHE  69  16.361 -15.487  -0.921
  486    HE1  PHE  69           HE1      PHE  69  17.803 -11.462   1.618
  487    HE2  PHE  69           HE2      PHE  69  14.910 -14.554   0.845
  488    HZ   PHE  69           HZ       PHE  69  15.624 -12.547   2.124
  489    H    TYR  70           H        TYR  70  21.052 -16.563  -2.655
  490    HA   TYR  70           HA       TYR  70  21.616 -15.489  -5.237
  491   1HB   TYR  70          HB2       TYR  70  23.329 -15.878  -3.511
  492   2HB   TYR  70          HB3       TYR  70  23.064 -17.616  -3.610
  493    HD1  TYR  70           HD1      TYR  70  24.349 -18.917  -5.130
  494    HD2  TYR  70           HD2      TYR  70  24.051 -14.650  -5.710
  495    HE1  TYR  70           HE1      TYR  70  26.017 -19.050  -6.955
  496    HE2  TYR  70           HE2      TYR  70  25.719 -14.772  -7.529
  497    HH   TYR  70           HH       TYR  70  27.085 -16.171  -8.819
  498    H    GLU  71           H        GLU  71  20.827 -18.851  -4.144
  499    HA   GLU  71           HA       GLU  71  21.075 -19.996  -6.758
  500   1HB   GLU  71          HB2       GLU  71  19.450 -20.890  -4.335
  501   2HB   GLU  71          HB3       GLU  71  19.650 -21.830  -5.823
  502   1HG   GLU  71          HG2       GLU  71  22.157 -21.695  -5.490
  503   2HG   GLU  71          HG3       GLU  71  21.861 -21.003  -3.897
  504    H    ALA  72           H        ALA  72  18.268 -18.556  -5.000
  505    HA   ALA  72           HA       ALA  72  16.359 -19.080  -7.035
  506   1HB   ALA  72          HB1       ALA  72  15.775 -18.413  -4.724
  507   2HB   ALA  72          HB2       ALA  72  16.432 -16.786  -5.029
  508   3HB   ALA  72          HB3       ALA  72  15.015 -17.363  -5.933
  509    H    LEU  73           H        LEU  73  18.600 -16.283  -6.585
  510    HA   LEU  73           HA       LEU  73  17.611 -14.734  -8.762
  511   1HB   LEU  73          HB2       LEU  73  20.358 -14.936  -7.470
  512   2HB   LEU  73          HB3       LEU  73  20.064 -13.883  -8.842
  513    HG   LEU  73           HG       LEU  73  18.532 -13.666  -6.217
  514   1HD1  LEU  73          HD11      LEU  73  20.926 -13.197  -5.887
  515   2HD1  LEU  73          HD12      LEU  73  20.913 -12.067  -7.257
  516   3HD1  LEU  73          HD13      LEU  73  19.982 -11.707  -5.784
  517   1HD2  LEU  73          HD21      LEU  73  18.701 -11.812  -8.629
  518   2HD2  LEU  73          HD22      LEU  73  17.269 -12.710  -8.083
  519   3HD2  LEU  73          HD23      LEU  73  17.920 -11.424  -7.077
  520    H    GLN  74           H        GLN  74  20.279 -17.199  -8.698
  521    HA   GLN  74           HA       GLN  74  20.774 -16.954 -11.495
  522   1HB   GLN  74          HB2       GLN  74  21.310 -19.343  -9.675
  523   2HB   GLN  74          HB3       GLN  74  21.944 -19.101 -11.306
  524   1HG   GLN  74          HG2       GLN  74  22.832 -16.805 -10.295
  525   2HG   GLN  74          HG3       GLN  74  22.693 -17.657  -8.767
  526   1HE2  GLN  74          HE22      GLN  74  24.690 -17.087 -11.445
  527   2HE2  GLN  74          HE21      GLN  74  25.849 -18.390 -11.184
  528    H    GLU  75           H        GLU  75  18.403 -18.926  -9.715
  529    HA   GLU  75           HA       GLU  75  17.789 -20.731 -11.781
  530   1HB   GLU  75          HB2       GLU  75  17.233 -21.001  -9.397
  531   2HB   GLU  75          HB3       GLU  75  16.024 -19.714  -9.515
  532   1HG   GLU  75          HG2       GLU  75  14.694 -21.064 -11.069
  533   2HG   GLU  75          HG3       GLU  75  15.961 -22.295 -11.131
  534    H    GLN  76           H        GLN  76  16.617 -17.398 -11.290
  535    HA   GLN  76           HA       GLN  76  14.831 -17.761 -13.674
  536   1HB   GLN  76          HB2       GLN  76  13.406 -15.965 -12.628
  537   2HB   GLN  76          HB3       GLN  76  13.326 -17.578 -11.933
  538   1HG   GLN  76          HG2       GLN  76  14.334 -16.973  -9.955
  539   2HG   GLN  76          HG3       GLN  76  15.243 -15.641 -10.672
  540   1HE2  GLN  76          HE22      GLN  76  14.593 -14.257  -8.926
  541   2HE2  GLN  76          HE21      GLN  76  13.016 -13.493  -8.944
  542    H    LYS  77           H        LYS  77  17.281 -15.643 -12.255
  543    HA   LYS  77           HA       LYS  77  17.934 -13.516 -12.792
  544   1HB   LYS  77          HB2       LYS  77  18.348 -15.098 -15.343
  545   2HB   LYS  77          HB3       LYS  77  19.071 -13.511 -15.019
  546   1HG   LYS  77          HG2       LYS  77  20.149 -14.379 -12.978
  547   2HG   LYS  77          HG3       LYS  77  19.484 -15.985 -13.284
  548   1HD   LYS  77          HD2       LYS  77  21.306 -14.563 -15.260
  549   2HD   LYS  77          HD3       LYS  77  21.905 -15.594 -13.947
  550   1HE   LYS  77          HE2       LYS  77  20.554 -17.489 -14.830
  551   2HE   LYS  77          HE3       LYS  77  20.007 -16.469 -16.169
  552   1HZ   LYS  77          HZ1       LYS  77  22.319 -16.284 -16.888
  553   2HZ   LYS  77          HZ2       LYS  77  22.830 -17.215 -15.644
  554   3HZ   LYS  77          HZ3       LYS  77  21.886 -17.852 -16.807
  555    HA   PRO  78           HA       PRO  78  13.877 -12.381 -14.817
  556   1HB   PRO  78          HB2       PRO  78  12.936 -10.599 -12.935
  557   2HB   PRO  78          HB3       PRO  78  12.723 -12.373 -12.818
  558   1HG   PRO  78          HG2       PRO  78  14.857 -10.665 -11.509
  559   2HG   PRO  78          HG3       PRO  78  13.835 -11.922 -10.756
  560   1HD   PRO  78          HD2       PRO  78  16.374 -12.431 -11.595
  561   2HD   PRO  78          HD3       PRO  78  15.079 -13.651 -11.783
  562    H    ASP  79           H        ASP  79  13.174 -10.294 -15.724
  563    HA   ASP  79           HA       ASP  79  15.430  -8.740 -16.624
  564   1HB   ASP  79          HB2       ASP  79  13.642  -9.287 -18.157
  565   2HB   ASP  79          HB3       ASP  79  12.456  -8.453 -17.144
  566    H    LEU  80           H        LEU  80  16.117  -8.017 -14.522
  567    HA   LEU  80           HA       LEU  80  14.600  -6.034 -13.053
  568   1HB   LEU  80          HB2       LEU  80  17.435  -7.110 -12.952
  569   2HB   LEU  80          HB3       LEU  80  17.000  -5.703 -12.037
  570    HG   LEU  80           HG       LEU  80  16.316  -6.832 -10.339
  571   1HD1  LEU  80          HD11      LEU  80  14.069  -6.963 -11.135
  572   2HD1  LEU  80          HD12      LEU  80  14.424  -8.415 -12.106
  573   3HD1  LEU  80          HD13      LEU  80  14.475  -8.472 -10.330
  574   1HD2  LEU  80          HD21      LEU  80  16.879  -9.363 -11.902
  575   2HD2  LEU  80          HD22      LEU  80  18.077  -8.400 -10.995
  576   3HD2  LEU  80          HD23      LEU  80  16.764  -9.215 -10.137
  577    H    SER  81           H        SER  81  15.643  -5.565 -16.110
  578    HA   SER  81           HA       SER  81  17.330  -3.314 -15.954
  579   1HB   SER  81          HB2       SER  81  15.248  -3.821 -18.102
  580   2HB   SER  81          HB3       SER  81  16.783  -2.948 -18.253
  581    HG   SER  81           HG       SER  81  16.204  -5.670 -18.135
  582    H    ALA  82           H        ALA  82  13.974  -3.490 -15.082
  583    HA   ALA  82           HA       ALA  82  13.567  -0.573 -15.414
  584   1HB   ALA  82          HB1       ALA  82  11.849  -2.098 -16.312
  585   2HB   ALA  82          HB2       ALA  82  11.614  -2.793 -14.691
  586   3HB   ALA  82          HB3       ALA  82  11.207  -1.093 -15.002
  587    H    VAL  83           H        VAL  83  15.165  -2.223 -13.126
  588    HA   VAL  83           HA       VAL  83  14.125  -0.504 -10.957
  589    HB   VAL  83           HB       VAL  83  13.098  -2.591 -10.517
  590   1HG1  VAL  83          HG11      VAL  83  14.375  -4.166 -11.820
  591   2HG1  VAL  83          HG12      VAL  83  15.800  -3.952 -10.780
  592   3HG1  VAL  83          HG13      VAL  83  14.324  -4.717 -10.147
  593   1HG2  VAL  83          HG21      VAL  83  15.477  -2.677  -8.646
  594   2HG2  VAL  83          HG22      VAL  83  14.185  -1.470  -8.515
  595   3HG2  VAL  83          HG23      VAL  83  13.805  -3.180  -8.365
  596    H    ARG  84           H        ARG  84  15.706  -0.234  -9.246
  597    HA   ARG  84           HA       ARG  84  18.542  -0.527 -10.061
  598   1HB   ARG  84          HB2       ARG  84  19.016   1.649  -8.978
  599   2HB   ARG  84          HB3       ARG  84  18.020   1.825 -10.425
  600   1HG   ARG  84          HG2       ARG  84  15.992   2.042  -8.993
  601   2HG   ARG  84          HG3       ARG  84  16.994   1.940  -7.544
  602   1HD   ARG  84          HD2       ARG  84  17.578   4.030  -9.654
  603   2HD   ARG  84          HD3       ARG  84  16.220   4.256  -8.551
  604    HE   ARG  84           HE       ARG  84  18.280   3.663  -6.843
  605   1HH1  ARG  84          HH11      ARG  84  17.764   6.107  -9.352
  606   2HH1  ARG  84          HH12      ARG  84  18.667   7.342  -8.566
  607   1HH2  ARG  84          HH21      ARG  84  19.410   5.368  -5.696
  608   2HH2  ARG  84          HH22      ARG  84  19.607   6.907  -6.428
  609    H    PHE  85           H        PHE  85  19.903  -0.902  -8.196
  610    HA   PHE  85           HA       PHE  85  18.412  -1.331  -5.699
  611   1HB   PHE  85          HB2       PHE  85  18.942  -3.468  -5.352
  612   2HB   PHE  85          HB3       PHE  85  18.830  -3.526  -7.091
  613    HD1  PHE  85           HD1      PHE  85  21.103  -3.318  -8.432
  614    HD2  PHE  85           HD2      PHE  85  20.864  -4.213  -4.214
  615    HE1  PHE  85           HE1      PHE  85  23.369  -4.302  -8.504
  616    HE2  PHE  85           HE2      PHE  85  23.125  -5.208  -4.301
  617    HZ   PHE  85           HZ       PHE  85  24.397  -5.243  -6.440
  618    H    GLY  86           H        GLY  86  19.786  -1.533  -3.820
  619   1HA   GLY  86          HA2       GLY  86  22.474  -0.297  -4.053
  620   2HA   GLY  86          HA3       GLY  86  21.301   0.319  -2.869
  621    H    ALA  87           H        ALA  87  23.768  -1.844  -3.319
  622    HA   ALA  87           HA       ALA  87  23.016  -3.926  -1.419
  623   1HB   ALA  87          HB1       ALA  87  24.827  -4.311  -3.053
  624   2HB   ALA  87          HB2       ALA  87  25.684  -2.870  -2.479
  625   3HB   ALA  87          HB3       ALA  87  25.513  -4.277  -1.424
  626    H    ILE  88           H        ILE  88  23.349  -3.813   0.821
  627    HA   ILE  88           HA       ILE  88  24.582  -1.389   1.993
  628    HB   ILE  88           HB       ILE  88  21.951  -2.667   2.803
  629   1HG1  ILE  88          HG12      ILE  88  22.466  -0.128   1.235
  630   2HG1  ILE  88          HG13      ILE  88  21.438  -1.489   0.831
  631   1HG2  ILE  88          HG21      ILE  88  23.142  -1.873   4.728
  632   2HG2  ILE  88          HG22      ILE  88  23.439  -0.291   3.974
  633   3HG2  ILE  88          HG23      ILE  88  21.802  -0.804   4.431
  634   1HD1  ILE  88          HD11      ILE  88  19.860  -0.838   2.639
  635   2HD1  ILE  88          HD12      ILE  88  20.874   0.595   2.972
  636   3HD1  ILE  88          HD13      ILE  88  20.090   0.420   1.412
  637    H    GLY  89           H        GLY  89  26.013  -1.989   3.570
  638   1HA   GLY  89          HA2       GLY  89  26.924  -3.142   5.360
  639   2HA   GLY  89          HA3       GLY  89  25.591  -4.305   5.293
  640    H    ILE  90           H        ILE  90  26.011  -4.903   2.466
  641    HA   ILE  90           HA       ILE  90  27.780  -7.027   2.329
  642    HB   ILE  90           HB       ILE  90  26.702  -5.099   0.245
  643   1HG1  ILE  90          HG12      ILE  90  25.819  -7.809   1.294
  644   2HG1  ILE  90          HG13      ILE  90  24.959  -6.282   1.419
  645   1HG2  ILE  90          HG21      ILE  90  28.729  -6.302  -0.683
  646   2HG2  ILE  90          HG22      ILE  90  27.830  -7.823  -0.457
  647   3HG2  ILE  90          HG23      ILE  90  27.228  -6.573  -1.546
  648   1HD1  ILE  90          HD11      ILE  90  24.589  -6.328  -1.065
  649   2HD1  ILE  90          HD12      ILE  90  25.312  -7.956  -1.085
  650   3HD1  ILE  90          HD13      ILE  90  23.830  -7.652  -0.171
  651    H    GLY  91           H        GLY  91  29.945  -7.272   1.841
  652   1HA   GLY  91          HA2       GLY  91  31.608  -4.764   1.810
  653   2HA   GLY  91          HA3       GLY  91  31.980  -6.178   2.795
  654    H    SER  92           H        SER  92  30.721  -7.402  -0.055
  655    HA   SER  92           HA       SER  92  33.062  -8.555  -0.959
  656   1HB   SER  92          HB2       SER  92  30.795  -7.939  -2.850
  657   2HB   SER  92          HB3       SER  92  31.753  -9.409  -2.655
  658    HG   SER  92           HG       SER  92  29.627  -9.626  -1.842
  659    H    ARG  93           H        ARG  93  31.324  -5.779  -2.390
  660    HA   ARG  93           HA       ARG  93  32.050  -4.305  -4.020
  661   1HB   ARG  93          HB2       ARG  93  32.986  -3.667  -1.230
  662   2HB   ARG  93          HB3       ARG  93  33.454  -2.542  -2.492
  663   1HG   ARG  93          HG2       ARG  93  30.567  -3.272  -2.011
  664   2HG   ARG  93          HG3       ARG  93  31.421  -1.946  -1.221
  665   1HD   ARG  93          HD2       ARG  93  30.394  -0.867  -3.020
  666   2HD   ARG  93          HD3       ARG  93  32.048  -1.081  -3.556
  667    HE   ARG  93           HE       ARG  93  29.810  -2.950  -4.304
  668   1HH1  ARG  93          HH11      ARG  93  32.582  -0.926  -5.453
  669   2HH1  ARG  93          HH12      ARG  93  32.486  -1.597  -7.037
  670   1HH2  ARG  93          HH21      ARG  93  29.787  -3.790  -6.261
  671   2HH2  ARG  93          HH22      ARG  93  30.938  -3.342  -7.512
  672    H    GLU  94           H        GLU  94  35.009  -3.883  -2.289
  673    HA   GLU  94           HA       GLU  94  36.663  -4.324  -4.724
  674   1HB   GLU  94          HB2       GLU  94  36.257  -1.743  -3.116
  675   2HB   GLU  94          HB3       GLU  94  37.410  -1.939  -4.439
  676   1HG   GLU  94          HG2       GLU  94  35.629  -2.164  -6.067
  677   2HG   GLU  94          HG3       GLU  94  34.408  -2.234  -4.800
  678    H    TYR  95           H        TYR  95  36.287  -5.205  -1.672
  679    HA   TYR  95           HA       TYR  95  38.803  -4.161  -0.495
  680   1HB   TYR  95          HB2       TYR  95  36.688  -2.609  -0.510
  681   2HB   TYR  95          HB3       TYR  95  36.032  -3.714   0.676
  682    HD1  TYR  95           HD1      TYR  95  35.776  -2.153   2.425
  683    HD2  TYR  95           HD2      TYR  95  39.623  -2.464   0.478
  684    HE1  TYR  95           HE1      TYR  95  36.739  -0.585   4.074
  685    HE2  TYR  95           HE2      TYR  95  40.589  -0.920   2.129
  686    HH   TYR  95           HH       TYR  95  40.186   0.444   3.985
  687    H    ASP  96           H        ASP  96  36.013  -6.413  -0.285
  688    HA   ASP  96           HA       ASP  96  37.902  -8.180   1.155
  689   1HB   ASP  96          HB2       ASP  96  35.938  -7.660   2.585
  690   2HB   ASP  96          HB3       ASP  96  34.888  -8.374   1.348
  691    H    THR  97           H        THR  97  37.825  -7.571  -1.628
  692    HA   THR  97           HA       THR  97  36.870  -9.890  -3.085
  693    HB   THR  97           HB       THR  97  38.516  -8.821  -4.790
  694    HG1  THR  97           HG1      THR  97  39.820  -7.611  -3.477
  695   1HG2  THR  97          HG21      THR  97  36.036  -8.355  -4.730
  696   2HG2  THR  97          HG22      THR  97  36.386  -6.936  -3.719
  697   3HG2  THR  97          HG23      THR  97  37.028  -7.032  -5.367
  698    H    PHE  98           H        PHE  98  38.170 -10.745  -0.710
  699    HA   PHE  98           HA       PHE  98  41.042 -10.538  -1.194
  700   1HB   PHE  98          HB2       PHE  98  39.555  -9.662   0.800
  701   2HB   PHE  98          HB3       PHE  98  39.806 -11.273   1.454
  702    HD1  PHE  98           HD1      PHE  98  42.106 -11.970   2.157
  703    HD2  PHE  98           HD2      PHE  98  41.345  -8.065   0.480
  704    HE1  PHE  98           HE1      PHE  98  44.363 -11.217   2.868
  705    HE2  PHE  98           HE2      PHE  98  43.596  -7.316   1.196
  706    HZ   PHE  98           HZ       PHE  98  45.117  -8.895   2.382
  707    H    CYS  99           H        CYS  99  38.728 -13.120  -0.329
  708    HA   CYS  99           HA       CYS  99  40.908 -15.137  -0.711
  709   1HB   CYS  99          HB2       CYS  99  38.347 -15.410   0.921
  710   2HB   CYS  99          HB3       CYS  99  39.614 -16.628   0.728
  711    HG   CYS  99           HG       CYS  99  39.805 -13.618   2.089
  712    H    GLY 100           H        GLY 100  38.667 -13.667  -2.487
  713   1HA   GLY 100          HA2       GLY 100  38.192 -15.430  -4.521
  714   2HA   GLY 100          HA3       GLY 100  36.900 -15.762  -3.344
  715    H    ALA 101           H        ALA 101  35.494 -14.890  -5.088
  716    HA   ALA 101           HA       ALA 101  35.314 -11.921  -5.058
  717   1HB   ALA 101          HB1       ALA 101  36.442 -12.596  -7.128
  718   2HB   ALA 101          HB2       ALA 101  35.116 -13.725  -7.502
  719   3HB   ALA 101          HB3       ALA 101  34.816 -11.973  -7.467
  720    H    ILE 102           H        ILE 102  33.873 -13.045  -3.249
  721    HA   ILE 102           HA       ILE 102  31.316 -14.054  -3.978
  722    HB   ILE 102           HB       ILE 102  30.679 -13.588  -1.696
  723   1HG1  ILE 102          HG12      ILE 102  33.019 -11.675  -1.728
  724   2HG1  ILE 102          HG13      ILE 102  31.376 -11.478  -1.128
  725   1HG2  ILE 102          HG21      ILE 102  32.160 -15.524  -2.302
  726   2HG2  ILE 102          HG22      ILE 102  33.558 -14.586  -1.733
  727   3HG2  ILE 102          HG23      ILE 102  32.253 -15.028  -0.615
  728   1HD1  ILE 102          HD11      ILE 102  31.959 -13.056   0.759
  729   2HD1  ILE 102          HD12      ILE 102  33.649 -12.983   0.204
  730   3HD1  ILE 102          HD13      ILE 102  32.837 -11.508   0.753
  731    H    ASP 103           H        ASP 103  32.552 -11.049  -4.667
  732    HA   ASP 103           HA       ASP 103  30.343  -9.306  -4.906
  733   1HB   ASP 103          HB2       ASP 103  32.490  -8.517  -5.451
  734   2HB   ASP 103          HB3       ASP 103  32.845  -9.891  -6.491
  735    H    LYS 104           H        LYS 104  30.874 -12.439  -6.408
  736    HA   LYS 104           HA       LYS 104  29.213 -12.676  -8.545
  737   1HB   LYS 104          HB2       LYS 104  29.370 -14.286  -5.978
  738   2HB   LYS 104          HB3       LYS 104  28.279 -14.758  -7.275
  739   1HG   LYS 104          HG2       LYS 104  30.067 -15.076  -8.844
  740   2HG   LYS 104          HG3       LYS 104  31.258 -14.395  -7.733
  741   1HD   LYS 104          HD2       LYS 104  30.793 -16.250  -6.116
  742   2HD   LYS 104          HD3       LYS 104  29.646 -16.946  -7.283
  743   1HE   LYS 104          HE2       LYS 104  31.513 -17.113  -8.951
  744   2HE   LYS 104          HE3       LYS 104  32.632 -16.490  -7.732
  745   1HZ   LYS 104          HZ1       LYS 104  32.121 -18.450  -6.375
  746   2HZ   LYS 104          HZ2       LYS 104  31.106 -19.025  -7.523
  747   3HZ   LYS 104          HZ3       LYS 104  32.699 -18.896  -7.831
  748    H    LEU 105           H        LEU 105  27.974 -12.063  -5.190
  749    HA   LEU 105           HA       LEU 105  25.238 -12.383  -5.894
  750   1HB   LEU 105          HB2       LEU 105  26.100 -12.407  -3.603
  751   2HB   LEU 105          HB3       LEU 105  26.549 -10.714  -3.700
  752    HG   LEU 105           HG       LEU 105  24.517 -11.265  -2.402
  753   1HD1  LEU 105          HD11      LEU 105  24.912  -8.963  -3.331
  754   2HD1  LEU 105          HD12      LEU 105  23.752  -9.353  -4.621
  755   3HD1  LEU 105          HD13      LEU 105  23.234  -9.363  -2.937
  756   1HD2  LEU 105          HD21      LEU 105  23.171 -11.785  -5.093
  757   2HD2  LEU 105          HD22      LEU 105  23.523 -13.000  -3.838
  758   3HD2  LEU 105          HD23      LEU 105  22.363 -11.697  -3.530
  759    H    GLU 106           H        GLU 106  27.255  -9.401  -5.699
  760    HA   GLU 106           HA       GLU 106  25.177  -7.599  -6.545
  761   1HB   GLU 106          HB2       GLU 106  28.221  -7.382  -6.713
  762   2HB   GLU 106          HB3       GLU 106  27.095  -6.064  -7.034
  763   1HG   GLU 106          HG2       GLU 106  26.346  -6.065  -4.706
  764   2HG   GLU 106          HG3       GLU 106  27.325  -7.487  -4.353
  765    H    ALA 107           H        ALA 107  27.777  -9.413  -8.204
  766    HA   ALA 107           HA       ALA 107  27.470  -8.322 -10.764
  767   1HB   ALA 107          HB1       ALA 107  29.394  -9.707 -10.021
  768   2HB   ALA 107          HB2       ALA 107  28.349 -11.147 -10.030
  769   3HB   ALA 107          HB3       ALA 107  28.693 -10.293 -11.543
  770    H    GLU 108           H        GLU 108  25.817 -11.258  -9.367
  771    HA   GLU 108           HA       GLU 108  24.508 -11.842 -11.839
  772   1HB   GLU 108          HB2       GLU 108  23.900 -12.677  -8.984
  773   2HB   GLU 108          HB3       GLU 108  22.944 -13.221 -10.363
  774   1HG   GLU 108          HG2       GLU 108  25.931 -13.721 -10.025
  775   2HG   GLU 108          HG3       GLU 108  24.644 -14.869  -9.689
  776    H    LEU 109           H        LEU 109  23.504  -9.763  -9.093
  777    HA   LEU 109           HA       LEU 109  20.841  -9.270 -10.087
  778   1HB   LEU 109          HB2       LEU 109  22.755  -7.675  -8.334
  779   2HB   LEU 109          HB3       LEU 109  21.184  -7.037  -8.787
  780    HG   LEU 109           HG       LEU 109  21.522  -9.696  -7.344
  781   1HD1  LEU 109          HD11      LEU 109  22.406  -7.839  -5.966
  782   2HD1  LEU 109          HD12      LEU 109  20.879  -6.958  -6.169
  783   3HD1  LEU 109          HD13      LEU 109  20.912  -8.503  -5.288
  784   1HD2  LEU 109          HD21      LEU 109  19.103  -7.866  -7.756
  785   2HD2  LEU 109          HD22      LEU 109  19.348  -9.455  -8.506
  786   3HD2  LEU 109          HD23      LEU 109  19.127  -9.334  -6.759
  787    H    LYS 110           H        LYS 110  23.978  -7.630 -10.611
  788    HA   LYS 110           HA       LYS 110  22.938  -5.607 -12.341
  789   1HB   LYS 110          HB2       LYS 110  25.738  -6.744 -11.988
  790   2HB   LYS 110          HB3       LYS 110  25.374  -5.315 -12.966
  791   1HG   LYS 110          HG2       LYS 110  24.611  -4.056 -11.063
  792   2HG   LYS 110          HG3       LYS 110  24.499  -5.487 -10.060
  793   1HD   LYS 110          HD2       LYS 110  26.371  -4.448  -9.232
  794   2HD   LYS 110          HD3       LYS 110  27.041  -5.720 -10.257
  795   1HE   LYS 110          HE2       LYS 110  27.421  -4.050 -12.069
  796   2HE   LYS 110          HE3       LYS 110  26.676  -2.795 -11.068
  797   1HZ   LYS 110          HZ1       LYS 110  28.467  -3.118  -9.451
  798   2HZ   LYS 110          HZ2       LYS 110  29.180  -4.238 -10.418
  799   3HZ   LYS 110          HZ3       LYS 110  29.065  -2.689 -10.907
  800    H    ASN 111           H        ASN 111  24.296  -8.840 -13.033
  801    HA   ASN 111           HA       ASN 111  24.097  -8.719 -15.863
  802   1HB   ASN 111          HB2       ASN 111  25.184 -10.634 -15.509
  803   2HB   ASN 111          HB3       ASN 111  24.659 -10.749 -13.848
  804   1HD2  ASN 111          HD22      ASN 111  22.529 -11.791 -13.377
  805   2HD2  ASN 111          HD21      ASN 111  21.939 -12.988 -14.486
  806    H    SER 112           H        SER 112  21.638  -9.644 -13.386
  807    HA   SER 112           HA       SER 112  19.688 -10.424 -15.338
  808   1HB   SER 112          HB2       SER 112  19.395  -9.636 -12.417
  809   2HB   SER 112          HB3       SER 112  18.167 -10.449 -13.407
  810    HG   SER 112           HG       SER 112  20.419 -11.458 -12.216
  811    H    GLY 113           H        GLY 113  20.519  -7.313 -13.825
  812   1HA   GLY 113          HA2       GLY 113  20.262  -5.779 -15.854
  813   2HA   GLY 113          HA3       GLY 113  18.526  -5.957 -15.587
  814    H    ALA 114           H        ALA 114  19.588  -5.977 -12.460
  815    HA   ALA 114           HA       ALA 114  18.563  -3.295 -12.098
  816   1HB   ALA 114          HB1       ALA 114  18.154  -4.995 -10.348
  817   2HB   ALA 114          HB2       ALA 114  19.904  -5.197 -10.112
  818   3HB   ALA 114          HB3       ALA 114  19.107  -3.664  -9.701
  819    H    LYS 115           H        LYS 115  19.791  -1.466 -12.473
  820    HA   LYS 115           HA       LYS 115  22.690  -1.548 -12.432
  821   1HB   LYS 115          HB2       LYS 115  22.672   0.827 -12.559
  822   2HB   LYS 115          HB3       LYS 115  21.437   0.218 -13.658
  823   1HG   LYS 115          HG2       LYS 115  19.682   0.808 -11.955
  824   2HG   LYS 115          HG3       LYS 115  20.959   1.402 -10.886
  825   1HD   LYS 115          HD2       LYS 115  20.061   3.323 -11.891
  826   2HD   LYS 115          HD3       LYS 115  21.623   3.053 -12.674
  827   1HE   LYS 115          HE2       LYS 115  20.409   1.929 -14.584
  828   2HE   LYS 115          HE3       LYS 115  18.876   2.288 -13.780
  829   1HZ   LYS 115          HZ1       LYS 115  19.425   4.660 -13.984
  830   2HZ   LYS 115          HZ2       LYS 115  20.811   4.300 -14.776
  831   3HZ   LYS 115          HZ3       LYS 115  19.370   3.942 -15.444
  832    H    GLN 116           H        GLN 116  24.063  -1.160 -10.698
  833    HA   GLN 116           HA       GLN 116  22.871  -0.838  -8.000
  834   1HB   GLN 116          HB2       GLN 116  24.852  -2.344  -8.273
  835   2HB   GLN 116          HB3       GLN 116  25.792  -0.972  -8.887
  836   1HG   GLN 116          HG2       GLN 116  25.424   0.223  -6.723
  837   2HG   GLN 116          HG3       GLN 116  24.447  -1.134  -6.153
  838   1HE2  GLN 116          HE22      GLN 116  26.074  -0.971  -4.343
  839   2HE2  GLN 116          HE21      GLN 116  27.491  -1.962  -4.473
  840    H    THR 117           H        THR 117  22.537   1.296  -7.320
  841    HA   THR 117           HA       THR 117  23.841   3.457  -8.924
  842    HB   THR 117           HB       THR 117  21.451   3.732  -7.078
  843    HG1  THR 117           HG1      THR 117  20.214   3.587  -8.914
  844   1HG2  THR 117          HG21      THR 117  22.487   5.877  -7.507
  845   2HG2  THR 117          HG22      THR 117  22.728   5.492  -9.229
  846   3HG2  THR 117          HG23      THR 117  21.104   5.777  -8.600
  847    H    GLY 118           H        GLY 118  24.962   5.130  -7.834
  848   1HA   GLY 118          HA2       GLY 118  26.438   5.939  -6.267
  849   2HA   GLY 118          HA3       GLY 118  25.457   5.175  -5.004
  850    H    GLU 119           H        GLU 119  26.842   3.956  -3.834
  851    HA   GLU 119           HA       GLU 119  28.067   1.630  -5.047
  852   1HB   GLU 119          HB2       GLU 119  30.250   1.940  -4.036
  853   2HB   GLU 119          HB3       GLU 119  29.919   3.301  -5.105
  854   1HG   GLU 119          HG2       GLU 119  29.183   4.611  -3.022
  855   2HG   GLU 119          HG3       GLU 119  29.791   3.257  -2.068
  856    H    THR 120           H        THR 120  28.572   0.060  -3.193
  857    HA   THR 120           HA       THR 120  26.397  -0.374  -1.675
  858    HB   THR 120           HB       THR 120  29.248  -1.168  -1.040
  859    HG1  THR 120           HG1      THR 120  28.417  -3.041  -2.335
  860   1HG2  THR 120          HG21      THR 120  27.931  -1.879   0.814
  861   2HG2  THR 120          HG22      THR 120  26.606  -2.414  -0.229
  862   3HG2  THR 120          HG23      THR 120  28.145  -3.289  -0.239
  863    H    LEU 121           H        LEU 121  25.463   0.384   0.049
  864    HA   LEU 121           HA       LEU 121  26.534   2.619   1.562
  865   1HB   LEU 121          HB2       LEU 121  24.098   2.025   0.788
  866   2HB   LEU 121          HB3       LEU 121  24.054   0.984   2.198
  867    HG   LEU 121           HG       LEU 121  24.881   3.842   2.595
  868   1HD1  LEU 121          HD11      LEU 121  22.942   4.026   1.058
  869   2HD1  LEU 121          HD12      LEU 121  21.982   3.000   2.143
  870   3HD1  LEU 121          HD13      LEU 121  22.537   4.603   2.680
  871   1HD2  LEU 121          HD21      LEU 121  22.996   2.083   4.214
  872   2HD2  LEU 121          HD22      LEU 121  24.726   2.288   4.544
  873   3HD2  LEU 121          HD23      LEU 121  23.646   3.671   4.675
  874    H    LYS 122           H        LYS 122  27.071   2.540   3.850
  875    HA   LYS 122           HA       LYS 122  27.689  -0.202   4.882
  876   1HB   LYS 122          HB2       LYS 122  29.322   2.367   4.934
  877   2HB   LYS 122          HB3       LYS 122  29.576   1.062   6.095
  878   1HG   LYS 122          HG2       LYS 122  29.939  -0.549   4.244
  879   2HG   LYS 122          HG3       LYS 122  29.714   0.726   3.056
  880   1HD   LYS 122          HD2       LYS 122  31.835   0.965   5.223
  881   2HD   LYS 122          HD3       LYS 122  32.147   0.007   3.783
  882   1HE   LYS 122          HE2       LYS 122  31.264   2.927   3.678
  883   2HE   LYS 122          HE3       LYS 122  32.955   2.423   3.731
  884   1HZ   LYS 122          HZ1       LYS 122  32.595   1.184   1.671
  885   2HZ   LYS 122          HZ2       LYS 122  31.039   1.701   1.585
  886   3HZ   LYS 122          HZ3       LYS 122  32.280   2.764   1.471
  887    H    ILE 123           H        ILE 123  27.056  -0.600   6.985
  888    HA   ILE 123           HA       ILE 123  25.646   1.586   8.403
  889    HB   ILE 123           HB       ILE 123  23.954  -0.266   9.039
  890   1HG1  ILE 123          HG12      ILE 123  23.275  -1.743   7.162
  891   2HG1  ILE 123          HG13      ILE 123  24.768  -1.389   6.311
  892   1HG2  ILE 123          HG21      ILE 123  23.524   1.837   7.764
  893   2HG2  ILE 123          HG22      ILE 123  23.823   0.939   6.260
  894   3HG2  ILE 123          HG23      ILE 123  22.471   0.498   7.324
  895   1HD1  ILE 123          HD11      ILE 123  26.060  -2.641   7.898
  896   2HD1  ILE 123          HD12      ILE 123  24.707  -2.700   9.060
  897   3HD1  ILE 123          HD13      ILE 123  24.630  -3.607   7.537
  898    H    ASN 124           H        ASN 124  25.789   1.532  10.618
  899    HA   ASN 124           HA       ASN 124  26.672  -0.808  11.950
  900   1HB   ASN 124          HB2       ASN 124  28.834   0.729  10.939
  901   2HB   ASN 124          HB3       ASN 124  28.700   1.233  12.626
  902   1HD2  ASN 124          HD22      ASN 124  28.462  -1.769  10.639
  903   2HD2  ASN 124          HD21      ASN 124  29.249  -2.802  11.828
  904    H    ILE 125           H        ILE 125  26.859  -0.431  14.284
  905    HA   ILE 125           HA       ILE 125  25.412   1.866  15.372
  906    HB   ILE 125           HB       ILE 125  23.683   0.396  16.379
  907   1HG1  ILE 125          HG12      ILE 125  24.622  -1.785  14.458
  908   2HG1  ILE 125          HG13      ILE 125  24.937  -1.776  16.194
  909   1HG2  ILE 125          HG21      ILE 125  23.265   1.700  14.271
  910   2HG2  ILE 125          HG22      ILE 125  23.519   0.198  13.354
  911   3HG2  ILE 125          HG23      ILE 125  22.193   0.325  14.523
  912   1HD1  ILE 125          HD11      ILE 125  22.468  -1.783  16.619
  913   2HD1  ILE 125          HD12      ILE 125  22.208  -1.961  14.864
  914   3HD1  ILE 125          HD13      ILE 125  23.063  -3.220  15.764
  915    H    LEU 126           H        LEU 126  24.970   0.922  17.823
  916    HA   LEU 126           HA       LEU 126  26.357   0.806  19.791
  917   1HB   LEU 126          HB2       LEU 126  24.337  -0.477  19.695
  918   2HB   LEU 126          HB3       LEU 126  25.108  -1.763  18.773
  919    HG   LEU 126           HG       LEU 126  26.430  -2.457  20.699
  920   1HD1  LEU 126          HD11      LEU 126  26.862  -0.329  21.836
  921   2HD1  LEU 126          HD12      LEU 126  25.131  -0.131  22.187
  922   3HD1  LEU 126          HD13      LEU 126  26.066  -1.443  22.944
  923   1HD2  LEU 126          HD21      LEU 126  23.510  -2.016  21.444
  924   2HD2  LEU 126          HD22      LEU 126  24.132  -3.320  20.412
  925   3HD2  LEU 126          HD23      LEU 126  24.600  -3.250  22.117
  926    H    ASP 127           H        ASP 127  27.201  -2.184  17.891
  927    HA   ASP 127           HA       ASP 127  29.956  -2.021  19.039
  928   1HB   ASP 127          HB2       ASP 127  28.711  -3.830  20.119
  929   2HB   ASP 127          HB3       ASP 127  28.231  -4.473  18.545
  930    H    HIS 128           H        HIS 128  31.587  -2.345  17.607
  931    HA   HIS 128           HA       HIS 128  31.244  -1.976  14.829
  932   1HB   HIS 128          HB2       HIS 128  33.542  -2.315  14.613
  933   2HB   HIS 128          HB3       HIS 128  33.328  -1.512  16.157
  934    HD1  HIS 128           HD1      HIS 128  32.800  -4.199  17.977
  935    HD2  HIS 128           HD2      HIS 128  35.717  -3.655  14.966
  936    HE1  HIS 128           HE1      HIS 128  34.650  -5.867  18.451
  937    H    ASP 129           H        ASP 129  31.555  -3.523  13.057
  938    HA   ASP 129           HA       ASP 129  30.996  -6.344  13.786
  939   1HB   ASP 129          HB2       ASP 129  28.820  -5.140  13.730
  940   2HB   ASP 129          HB3       ASP 129  29.110  -4.725  12.042
  941    H    ILE 130           H        ILE 130  30.453  -4.839  10.587
  942    HA   ILE 130           HA       ILE 130  32.822  -6.355   9.599
  943    HB   ILE 130           HB       ILE 130  29.973  -6.413   8.551
  944   1HG1  ILE 130          HG12      ILE 130  30.287  -7.869  10.484
  945   2HG1  ILE 130          HG13      ILE 130  29.954  -8.751   9.016
  946   1HG2  ILE 130          HG21      ILE 130  31.414  -6.402   6.623
  947   2HG2  ILE 130          HG22      ILE 130  32.502  -7.594   7.366
  948   3HG2  ILE 130          HG23      ILE 130  30.848  -8.055   6.882
  949   1HD1  ILE 130          HD11      ILE 130  32.276  -9.439   8.842
  950   2HD1  ILE 130          HD12      ILE 130  32.732  -8.473  10.250
  951   3HD1  ILE 130          HD13      ILE 130  31.643  -9.856  10.437
  952    HA   PRO 131           HA       PRO 131  32.550  -2.689   6.691
  953   1HB   PRO 131          HB2       PRO 131  30.503  -0.938   6.533
  954   2HB   PRO 131          HB3       PRO 131  30.410  -2.556   5.763
  955   1HG   PRO 131          HG2       PRO 131  29.388  -1.724   8.497
  956   2HG   PRO 131          HG3       PRO 131  28.450  -2.524   7.185
  957   1HD   PRO 131          HD2       PRO 131  29.552  -3.980   9.175
  958   2HD   PRO 131          HD3       PRO 131  29.613  -4.554   7.479
  959    H    GLU 132           H        GLU 132  31.767  -2.383   9.983
  960    HA   GLU 132           HA       GLU 132  32.763  -1.350  11.661
  961   1HB   GLU 132          HB2       GLU 132  34.779  -1.452  10.139
  962   2HB   GLU 132          HB3       GLU 132  34.457   0.233   9.704
  963   1HG   GLU 132          HG2       GLU 132  34.677   0.890  12.090
  964   2HG   GLU 132          HG3       GLU 132  35.000  -0.792  12.519
  965    H    ASP 133           H        ASP 133  31.638   0.880   9.106
  966    HA   ASP 133           HA       ASP 133  31.259   2.996  11.187
  967   1HB   ASP 133          HB2       ASP 133  33.370   3.179   9.965
  968   2HB   ASP 133          HB3       ASP 133  32.512   3.134   8.426
  969    HA   PRO 134           HA       PRO 134  27.210   3.339   9.212
  970   1HB   PRO 134          HB2       PRO 134  26.379   5.756  10.289
  971   2HB   PRO 134          HB3       PRO 134  26.352   4.202  11.171
  972   1HG   PRO 134          HG2       PRO 134  28.481   6.361  11.249
  973   2HG   PRO 134          HG3       PRO 134  27.710   5.514  12.629
  974   1HD   PRO 134          HD2       PRO 134  30.116   4.742  11.702
  975   2HD   PRO 134          HD3       PRO 134  28.913   3.520  12.188
  976    H    ALA 135           H        ALA 135  26.124   4.646   7.624
  977    HA   ALA 135           HA       ALA 135  27.668   6.826   6.353
  978   1HB   ALA 135          HB1       ALA 135  28.303   4.605   5.329
  979   2HB   ALA 135          HB2       ALA 135  26.601   4.424   4.823
  980   3HB   ALA 135          HB3       ALA 135  27.576   5.763   4.208
  981    H    GLU 136           H        GLU 136  25.520   7.453   7.898
  982    HA   GLU 136           HA       GLU 136  23.074   7.598   6.395
  983   1HB   GLU 136          HB2       GLU 136  22.423   9.376   7.880
  984   2HB   GLU 136          HB3       GLU 136  23.158   8.057   8.791
  985   1HG   GLU 136          HG2       GLU 136  25.271   9.352   8.977
  986   2HG   GLU 136          HG3       GLU 136  24.563  10.657   8.022
  987    H    GLU 137           H        GLU 137  26.153   9.267   6.085
  988    HA   GLU 137           HA       GLU 137  25.245  11.416   4.420
  989   1HB   GLU 137          HB2       GLU 137  27.956  10.036   4.621
  990   2HB   GLU 137          HB3       GLU 137  27.630  11.506   3.689
  991   1HG   GLU 137          HG2       GLU 137  26.824  12.619   5.798
  992   2HG   GLU 137          HG3       GLU 137  27.323  11.191   6.707
  993    H    TRP 138           H        TRP 138  26.067   7.978   3.700
  994    HA   TRP 138           HA       TRP 138  25.988   8.233   0.807
  995   1HB   TRP 138          HB2       TRP 138  25.797   5.998   2.783
  996   2HB   TRP 138          HB3       TRP 138  24.848   5.785   1.351
  997    HD1  TRP 138           HD1      TRP 138  25.869   4.422  -0.365
  998    HE1  TRP 138           HE1      TRP 138  28.167   3.582  -0.940
  999    HE3  TRP 138           HE3      TRP 138  28.594   7.400   2.799
 1000    HZ2  TRP 138           HZ2      TRP 138  30.922   4.108  -0.123
 1001    HZ3  TRP 138           HZ3      TRP 138  31.058   7.163   2.913
 1002    HH2  TRP 138           HH2      TRP 138  32.233   5.523   1.465
 1003    H    LEU 139           H        LEU 139  23.578   7.613   3.400
 1004    HA   LEU 139           HA       LEU 139  21.432   7.119   1.639
 1005   1HB   LEU 139          HB2       LEU 139  21.653   6.640   4.164
 1006   2HB   LEU 139          HB3       LEU 139  21.173   8.315   4.429
 1007    HG   LEU 139           HG       LEU 139  18.999   7.898   3.350
 1008   1HD1  LEU 139          HD11      LEU 139  19.444   6.207   1.685
 1009   2HD1  LEU 139          HD12      LEU 139  20.101   5.085   2.904
 1010   3HD1  LEU 139          HD13      LEU 139  18.376   5.467   2.876
 1011   1HD2  LEU 139          HD21      LEU 139  19.721   5.769   5.423
 1012   2HD2  LEU 139          HD22      LEU 139  19.281   7.453   5.778
 1013   3HD2  LEU 139          HD23      LEU 139  18.088   6.360   5.055
 1014    H    GLY 140           H        GLY 140  22.475  10.176   3.243
 1015   1HA   GLY 140          HA2       GLY 140  20.562  11.910   2.086
 1016   2HA   GLY 140          HA3       GLY 140  22.191  12.359   2.621
 1017    H    SER 141           H        SER 141  23.839  10.947   0.812
 1018    HA   SER 141           HA       SER 141  23.736  12.531  -1.526
 1019   1HB   SER 141          HB2       SER 141  25.187   9.937  -0.936
 1020   2HB   SER 141          HB3       SER 141  25.433  10.922  -2.392
 1021    HG   SER 141           HG       SER 141  26.920  11.419  -0.692
 1022    H    TRP 142           H        TRP 142  22.925   9.041  -1.140
 1023    HA   TRP 142           HA       TRP 142  22.167   8.580  -3.809
 1024   1HB   TRP 142          HB2       TRP 142  22.820   6.893  -2.158
 1025   2HB   TRP 142          HB3       TRP 142  21.399   7.237  -1.193
 1026    HD1  TRP 142           HD1      TRP 142  22.546   5.274  -4.226
 1027    HE1  TRP 142           HE1      TRP 142  20.828   3.456  -4.708
 1028    HE3  TRP 142           HE3      TRP 142  18.807   6.897  -1.151
 1029    HZ2  TRP 142           HZ2      TRP 142  18.061   2.859  -3.966
 1030    HZ3  TRP 142           HZ3      TRP 142  16.650   5.687  -1.040
 1031    HH2  TRP 142           HH2      TRP 142  16.280   3.659  -2.416
 1032    H    VAL 143           H        VAL 143  20.162   9.606  -0.973
 1033    HA   VAL 143           HA       VAL 143  17.683   9.602  -2.393
 1034    HB   VAL 143           HB       VAL 143  18.667  11.029   0.103
 1035   1HG1  VAL 143          HG11      VAL 143  16.915  12.477  -0.853
 1036   2HG1  VAL 143          HG12      VAL 143  15.834  11.070  -1.011
 1037   3HG1  VAL 143          HG13      VAL 143  16.350  11.660   0.593
 1038   1HG2  VAL 143          HG21      VAL 143  16.679   8.747  -0.378
 1039   2HG2  VAL 143          HG22      VAL 143  18.302   8.566   0.277
 1040   3HG2  VAL 143          HG23      VAL 143  17.092   9.439   1.210
 1041    H    ASN 144           H        ASN 144  19.988  12.417  -1.754
 1042    HA   ASN 144           HA       ASN 144  18.209  14.060  -3.300
 1043   1HB   ASN 144          HB2       ASN 144  19.500  15.862  -2.894
 1044   2HB   ASN 144          HB3       ASN 144  19.859  14.866  -1.497
 1045   1HD2  ASN 144          HD22      ASN 144  22.010  13.909  -1.362
 1046   2HD2  ASN 144          HD21      ASN 144  23.321  14.560  -2.336
 1047    H    LEU 145           H        LEU 145  20.846  11.964  -4.290
 1048    HA   LEU 145           HA       LEU 145  21.070  12.980  -6.987
 1049   1HB   LEU 145          HB2       LEU 145  21.875  10.486  -5.521
 1050   2HB   LEU 145          HB3       LEU 145  21.584  10.314  -7.240
 1051    HG   LEU 145           HG       LEU 145  23.190  12.046  -7.796
 1052   1HD1  LEU 145          HD11      LEU 145  23.077  13.483  -5.766
 1053   2HD1  LEU 145          HD12      LEU 145  23.880  12.206  -4.831
 1054   3HD1  LEU 145          HD13      LEU 145  24.732  13.011  -6.161
 1055   1HD2  LEU 145          HD21      LEU 145  24.322   9.942  -5.899
 1056   2HD2  LEU 145          HD22      LEU 145  23.917   9.697  -7.612
 1057   3HD2  LEU 145          HD23      LEU 145  25.225  10.803  -7.167
 1058    H    LEU 146           H        LEU 146  18.927  10.473  -5.450
 1059    HA   LEU 146           HA       LEU 146  17.736   9.879  -8.014
 1060   1HB   LEU 146          HB2       LEU 146  16.632   8.166  -7.043
 1061   2HB   LEU 146          HB3       LEU 146  18.041   8.326  -6.026
 1062    HG   LEU 146           HG       LEU 146  16.381   9.713  -4.458
 1063   1HD1  LEU 146          HD11      LEU 146  14.378   9.738  -5.852
 1064   2HD1  LEU 146          HD12      LEU 146  14.477   7.981  -6.094
 1065   3HD1  LEU 146          HD13      LEU 146  14.098   8.650  -4.502
 1066   1HD2  LEU 146          HD21      LEU 146  16.278   6.683  -4.738
 1067   2HD2  LEU 146          HD22      LEU 146  17.523   7.607  -3.878
 1068   3HD2  LEU 146          HD23      LEU 146  15.862   7.619  -3.284
 1069    H    LYS 147           H        LYS 147  17.035  12.250  -5.568
 1070    HA   LYS 147           HA       LYS 147  14.397  12.946  -6.646
 1071   1HB   LYS 147          HB2       LYS 147  16.283  14.372  -4.720
 1072   2HB   LYS 147          HB3       LYS 147  14.696  14.975  -5.217
 1073   1HG   LYS 147          HG2       LYS 147  13.642  12.895  -4.305
 1074   2HG   LYS 147          HG3       LYS 147  15.220  12.395  -3.676
 1075   1HD   LYS 147          HD2       LYS 147  15.331  14.498  -2.325
 1076   2HD   LYS 147          HD3       LYS 147  13.747  14.970  -2.978
 1077   1HE   LYS 147          HE2       LYS 147  12.943  12.645  -2.060
 1078   2HE   LYS 147          HE3       LYS 147  14.425  12.682  -1.101
 1079   1HZ   LYS 147          HZ1       LYS 147  13.639  14.821  -0.176
 1080   2HZ   LYS 147          HZ2       LYS 147  12.235  14.669  -1.009
 1081   3HZ   LYS 147          HZ3       LYS 147  12.627  13.573   0.144
  Start of MODEL    2
    1   1H    MET   1          H1        MET   1   1.495  -2.237   0.586
    2   2H    MET   1          H2        MET   1   3.054  -2.100   1.101
    3   3H    MET   1          H3        MET   1   1.903  -1.107   1.711
    4    HA   MET   1           HA       MET   1   2.830  -1.166  -1.068
    5   1HB   MET   1          HB2       MET   1   0.452  -0.489  -0.874
    6   2HB   MET   1          HB3       MET   1   0.894   0.776   0.275
    7   1HG   MET   1          HG2       MET   1   0.561   1.661  -2.000
    8   2HG   MET   1          HG3       MET   1   2.190   1.944  -1.411
    9   1HE   MET   1          HE1       MET   1   1.004  -0.986  -4.811
   10   2HE   MET   1          HE2       MET   1   0.494  -1.288  -3.139
   11   3HE   MET   1          HE3       MET   1  -0.094   0.153  -4.002
   12    H    ALA   2           H        ALA   2   4.641   0.025  -1.506
   13    HA   ALA   2           HA       ALA   2   5.616   2.125   0.260
   14   1HB   ALA   2          HB1       ALA   2   6.450   0.092   1.429
   15   2HB   ALA   2          HB2       ALA   2   7.108  -0.521  -0.109
   16   3HB   ALA   2          HB3       ALA   2   7.784   0.936   0.623
   17    H    ASP   3           H        ASP   3   7.723   2.992  -0.724
   18    HA   ASP   3           HA       ASP   3   7.595   2.946  -3.664
   19   1HB   ASP   3          HB2       ASP   3   7.840   5.091  -2.315
   20   2HB   ASP   3          HB3       ASP   3   9.408   4.516  -1.790
   21    H    ILE   4           H        ILE   4   9.447   1.680  -0.976
   22    HA   ILE   4           HA       ILE   4  11.476   0.477  -2.802
   23    HB   ILE   4           HB       ILE   4  11.994   1.803  -0.104
   24   1HG1  ILE   4          HG12      ILE   4  12.754   2.857  -2.853
   25   2HG1  ILE   4          HG13      ILE   4  11.470   3.519  -1.845
   26   1HG2  ILE   4          HG21      ILE   4  13.526  -0.043  -0.591
   27   2HG2  ILE   4          HG22      ILE   4  13.900   0.657  -2.180
   28   3HG2  ILE   4          HG23      ILE   4  14.377   1.487  -0.679
   29   1HD1  ILE   4          HD11      ILE   4  13.168   4.083  -0.115
   30   2HD1  ILE   4          HD12      ILE   4  14.427   3.651  -1.309
   31   3HD1  ILE   4          HD13      ILE   4  13.302   4.967  -1.644
   32    H    THR   5           H        THR   5  11.714  -1.695  -2.434
   33    HA   THR   5           HA       THR   5  10.534  -2.910  -0.004
   34    HB   THR   5           HB       THR   5   9.997  -3.966  -2.192
   35    HG1  THR   5           HG1      THR   5  10.152  -5.364  -0.510
   36   1HG2  THR   5          HG21      THR   5  11.917  -3.381  -3.568
   37   2HG2  THR   5          HG22      THR   5  12.961  -4.441  -2.594
   38   3HG2  THR   5          HG23      THR   5  11.640  -5.125  -3.552
   39    H    LEU   6           H        LEU   6  11.900  -3.626   1.662
   40    HA   LEU   6           HA       LEU   6  14.860  -3.410   1.241
   41   1HB   LEU   6          HB2       LEU   6  13.126  -2.971   3.681
   42   2HB   LEU   6          HB3       LEU   6  14.775  -3.505   3.846
   43    HG   LEU   6           HG       LEU   6  15.383  -1.450   2.317
   44   1HD1  LEU   6          HD11      LEU   6  13.851   0.466   2.632
   45   2HD1  LEU   6          HD12      LEU   6  13.059  -0.836   1.734
   46   3HD1  LEU   6          HD13      LEU   6  12.689  -0.607   3.454
   47   1HD2  LEU   6          HD21      LEU   6  16.123  -1.648   4.619
   48   2HD2  LEU   6          HD22      LEU   6  15.534  -0.003   4.342
   49   3HD2  LEU   6          HD23      LEU   6  14.526  -1.179   5.219
   50    H    ILE   7           H        ILE   7  15.450  -5.361   0.646
   51    HA   ILE   7           HA       ILE   7  13.957  -7.719   1.558
   52    HB   ILE   7           HB       ILE   7  16.144  -7.521  -0.550
   53   1HG1  ILE   7          HG12      ILE   7  13.182  -7.457  -1.249
   54   2HG1  ILE   7          HG13      ILE   7  14.075  -5.963  -1.034
   55   1HG2  ILE   7          HG21      ILE   7  15.444  -9.801   0.359
   56   2HG2  ILE   7          HG22      ILE   7  13.820  -9.486  -0.274
   57   3HG2  ILE   7          HG23      ILE   7  15.196  -9.610  -1.376
   58   1HD1  ILE   7          HD11      ILE   7  15.625  -6.476  -2.795
   59   2HD1  ILE   7          HD12      ILE   7  14.911  -8.080  -3.037
   60   3HD1  ILE   7          HD13      ILE   7  13.964  -6.627  -3.395
   61    H    SER   8           H        SER   8  14.708  -8.212   3.630
   62    HA   SER   8           HA       SER   8  17.617  -8.234   4.145
   63   1HB   SER   8          HB2       SER   8  15.455  -8.688   6.200
   64   2HB   SER   8          HB3       SER   8  17.068  -8.003   6.409
   65    HG   SER   8           HG       SER   8  14.745  -6.874   5.269
   66    H    GLY   9           H        GLY   9  16.116 -10.355   2.557
   67   1HA   GLY   9          HA2       GLY   9  15.732 -12.623   4.286
   68   2HA   GLY   9          HA3       GLY   9  15.511 -12.570   2.538
   69    H    SER  10           H        SER  10  18.550 -11.856   4.362
   70    HA   SER  10           HA       SER  10  20.249 -12.955   2.577
   71   1HB   SER  10          HB2       SER  10  20.706 -13.074   5.579
   72   2HB   SER  10          HB3       SER  10  21.902 -12.765   4.307
   73    HG   SER  10           HG       SER  10  20.884 -10.927   5.600
   74    H    THR  11           H        THR  11  19.105 -14.688   5.516
   75    HA   THR  11           HA       THR  11  19.254 -17.280   4.054
   76    HB   THR  11           HB       THR  11  19.818 -18.294   6.270
   77    HG1  THR  11           HG1      THR  11  19.207 -16.602   7.640
   78   1HG2  THR  11          HG21      THR  11  22.181 -17.741   6.242
   79   2HG2  THR  11          HG22      THR  11  21.604 -17.764   4.573
   80   3HG2  THR  11          HG23      THR  11  21.879 -16.215   5.387
   81    H    LEU  12           H        LEU  12  17.153 -15.783   3.648
   82    HA   LEU  12           HA       LEU  12  14.994 -15.422   3.800
   83   1HB   LEU  12          HB2       LEU  12  14.893 -17.928   3.891
   84   2HB   LEU  12          HB3       LEU  12  14.732 -17.820   5.641
   85    HG   LEU  12           HG       LEU  12  12.559 -16.715   5.434
   86   1HD1  LEU  12          HD11      LEU  12  11.478 -16.455   3.189
   87   2HD1  LEU  12          HD12      LEU  12  12.810 -15.331   3.445
   88   3HD1  LEU  12          HD13      LEU  12  13.049 -16.769   2.424
   89   1HD2  LEU  12          HD21      LEU  12  11.300 -18.536   4.416
   90   2HD2  LEU  12          HD22      LEU  12  12.756 -19.109   3.571
   91   3HD2  LEU  12          HD23      LEU  12  12.664 -19.172   5.345
   92    H    GLY  13           H        GLY  13  16.993 -14.452   5.797
   93   1HA   GLY  13          HA2       GLY  13  15.733 -12.365   7.004
   94   2HA   GLY  13          HA3       GLY  13  15.711 -13.666   8.222
   95    H    GLY  14           H        GLY  14  17.310 -11.578   8.904
   96   1HA   GLY  14          HA2       GLY  14  19.498 -12.597   9.902
   97   2HA   GLY  14          HA3       GLY  14  20.100 -12.417   8.252
   98    H    ALA  15           H        ALA  15  18.042  -9.775   8.698
   99    HA   ALA  15           HA       ALA  15  20.159  -8.083   9.911
  100   1HB   ALA  15          HB1       ALA  15  19.201  -7.672   7.047
  101   2HB   ALA  15          HB2       ALA  15  20.353  -6.662   7.944
  102   3HB   ALA  15          HB3       ALA  15  20.788  -8.323   7.513
  103    H    GLU  16           H        GLU  16  16.913  -8.749   9.737
  104    HA   GLU  16           HA       GLU  16  15.594  -6.421   9.248
  105   1HB   GLU  16          HB2       GLU  16  14.845  -8.399  11.430
  106   2HB   GLU  16          HB3       GLU  16  13.794  -7.194  10.691
  107   1HG   GLU  16          HG2       GLU  16  13.158  -9.052   9.520
  108   2HG   GLU  16          HG3       GLU  16  14.363  -8.387   8.425
  109    H    TYR  17           H        TYR  17  17.252  -7.232  12.276
  110    HA   TYR  17           HA       TYR  17  16.282  -5.253  13.979
  111   1HB   TYR  17          HB2       TYR  17  17.687  -7.154  14.646
  112   2HB   TYR  17          HB3       TYR  17  19.059  -6.478  13.777
  113    HD1  TYR  17           HD1      TYR  17  16.587  -5.456  16.454
  114    HD2  TYR  17           HD2      TYR  17  20.676  -5.363  15.066
  115    HE1  TYR  17           HE1      TYR  17  17.253  -4.262  18.514
  116    HE2  TYR  17           HE2      TYR  17  21.353  -4.189  17.136
  117    HH   TYR  17           HH       TYR  17  19.009  -3.307  19.716
  118    H    VAL  18           H        VAL  18  18.650  -4.877  11.337
  119    HA   VAL  18           HA       VAL  18  19.010  -2.015  12.107
  120    HB   VAL  18           HB       VAL  18  20.751  -3.722  10.300
  121   1HG1  VAL  18          HG11      VAL  18  20.977  -1.315   9.842
  122   2HG1  VAL  18          HG12      VAL  18  21.154  -0.968  11.575
  123   3HG1  VAL  18          HG13      VAL  18  22.413  -1.870  10.715
  124   1HG2  VAL  18          HG21      VAL  18  20.966  -4.631  12.563
  125   2HG2  VAL  18          HG22      VAL  18  22.408  -3.698  12.180
  126   3HG2  VAL  18          HG23      VAL  18  21.163  -2.997  13.238
  127    H    ALA  19           H        ALA  19  17.803  -4.255   9.608
  128    HA   ALA  19           HA       ALA  19  17.466  -2.359   7.532
  129   1HB   ALA  19          HB1       ALA  19  15.928  -3.886   6.563
  130   2HB   ALA  19          HB2       ALA  19  17.205  -4.853   7.320
  131   3HB   ALA  19          HB3       ALA  19  15.617  -4.672   8.113
  132    H    GLU  20           H        GLU  20  15.437  -3.007  10.465
  133    HA   GLU  20           HA       GLU  20  13.301  -1.284   9.717
  134   1HB   GLU  20          HB2       GLU  20  14.438  -2.242  12.375
  135   2HB   GLU  20          HB3       GLU  20  13.083  -1.122  12.288
  136   1HG   GLU  20          HG2       GLU  20  11.821  -2.751  10.879
  137   2HG   GLU  20          HG3       GLU  20  13.127  -3.914  11.082
  138    H    HIS  21           H        HIS  21  16.470  -0.583  11.267
  139    HA   HIS  21           HA       HIS  21  15.829   2.180  11.865
  140   1HB   HIS  21          HB2       HIS  21  17.618   0.850  13.007
  141   2HB   HIS  21          HB3       HIS  21  18.552   0.856  11.511
  142    HD1  HIS  21           HD1      HIS  21  17.773   3.050  14.498
  143    HD2  HIS  21           HD2      HIS  21  19.472   3.333  10.657
  144    HE1  HIS  21           HE1      HIS  21  19.040   5.257  14.437
  145    H    LEU  22           H        LEU  22  17.549   0.486   9.224
  146    HA   LEU  22           HA       LEU  22  18.221   2.676   7.576
  147   1HB   LEU  22          HB2       LEU  22  17.521  -0.230   7.129
  148   2HB   LEU  22          HB3       LEU  22  17.706   0.797   5.737
  149    HG   LEU  22           HG       LEU  22  19.872   0.652   7.876
  150   1HD1  LEU  22          HD11      LEU  22  20.984  -1.086   6.508
  151   2HD1  LEU  22          HD12      LEU  22  19.469  -1.647   7.180
  152   3HD1  LEU  22          HD13      LEU  22  19.543  -1.179   5.464
  153   1HD2  LEU  22          HD21      LEU  22  19.879   1.373   4.904
  154   2HD2  LEU  22          HD22      LEU  22  20.056   2.497   6.266
  155   3HD2  LEU  22          HD23      LEU  22  21.317   1.313   5.938
  156    H    ALA  23           H        ALA  23  15.260   0.651   7.508
  157    HA   ALA  23           HA       ALA  23  13.823   2.039   5.578
  158   1HB   ALA  23          HB1       ALA  23  12.789   0.641   8.084
  159   2HB   ALA  23          HB2       ALA  23  11.791   1.119   6.709
  160   3HB   ALA  23          HB3       ALA  23  13.058  -0.094   6.493
  161    H    GLU  24           H        GLU  24  13.847   2.691   9.152
  162    HA   GLU  24           HA       GLU  24  11.964   4.761   9.129
  163   1HB   GLU  24          HB2       GLU  24  13.074   3.558  11.102
  164   2HB   GLU  24          HB3       GLU  24  14.419   4.666  10.947
  165   1HG   GLU  24          HG2       GLU  24  12.895   6.571  11.274
  166   2HG   GLU  24          HG3       GLU  24  11.512   5.481  11.380
  167    H    LYS  25           H        LYS  25  15.536   5.062   9.056
  168    HA   LYS  25           HA       LYS  25  15.745   7.819   8.580
  169   1HB   LYS  25          HB2       LYS  25  17.457   5.472   7.645
  170   2HB   LYS  25          HB3       LYS  25  17.956   7.142   7.496
  171   1HG   LYS  25          HG2       LYS  25  17.305   5.687  10.114
  172   2HG   LYS  25          HG3       LYS  25  18.901   6.028   9.504
  173   1HD   LYS  25          HD2       LYS  25  16.841   8.017  10.442
  174   2HD   LYS  25          HD3       LYS  25  18.331   7.574  11.274
  175   1HE   LYS  25          HE2       LYS  25  19.691   8.538   9.466
  176   2HE   LYS  25          HE3       LYS  25  18.233   8.940   8.540
  177   1HZ   LYS  25          HZ1       LYS  25  17.619  10.539  10.111
  178   2HZ   LYS  25          HZ2       LYS  25  18.770  10.073  11.205
  179   3HZ   LYS  25          HZ3       LYS  25  19.235  10.780   9.805
  180    H    LEU  26           H        LEU  26  15.356   5.204   6.144
  181    HA   LEU  26           HA       LEU  26  15.559   6.961   3.957
  182   1HB   LEU  26          HB2       LEU  26  15.931   4.477   4.076
  183   2HB   LEU  26          HB3       LEU  26  14.200   4.241   4.153
  184    HG   LEU  26           HG       LEU  26  13.906   4.976   1.906
  185   1HD1  LEU  26          HD11      LEU  26  16.799   5.928   1.919
  186   2HD1  LEU  26          HD12      LEU  26  15.728   5.874   0.488
  187   3HD1  LEU  26          HD13      LEU  26  15.355   6.955   1.810
  188   1HD2  LEU  26          HD21      LEU  26  15.413   3.418   0.714
  189   2HD2  LEU  26          HD22      LEU  26  16.483   3.375   2.126
  190   3HD2  LEU  26          HD23      LEU  26  14.839   2.720   2.237
  191    H    GLU  27           H        GLU  27  12.662   5.940   5.887
  192    HA   GLU  27           HA       GLU  27  10.792   7.042   4.040
  193   1HB   GLU  27          HB2       GLU  27  10.652   6.462   7.032
  194   2HB   GLU  27          HB3       GLU  27   9.326   7.136   6.091
  195   1HG   GLU  27          HG2       GLU  27   9.693   5.136   4.479
  196   2HG   GLU  27          HG3       GLU  27  10.599   4.430   5.810
  197    H    GLU  28           H        GLU  28  12.456   8.449   6.948
  198    HA   GLU  28           HA       GLU  28  11.171  10.988   6.564
  199   1HB   GLU  28          HB2       GLU  28  12.673  11.901   8.193
  200   2HB   GLU  28          HB3       GLU  28  12.026  10.352   8.734
  201   1HG   GLU  28          HG2       GLU  28  14.129   9.247   8.249
  202   2HG   GLU  28          HG3       GLU  28  14.793  10.707   7.507
  203    H    ALA  29           H        ALA  29  13.697   9.515   4.751
  204    HA   ALA  29           HA       ALA  29  14.880  11.964   3.756
  205   1HB   ALA  29          HB1       ALA  29  15.965   9.677   3.631
  206   2HB   ALA  29          HB2       ALA  29  14.804   9.278   2.338
  207   3HB   ALA  29          HB3       ALA  29  15.951  10.603   2.122
  208    H    GLY  30           H        GLY  30  11.808  10.382   3.189
  209   1HA   GLY  30          HA2       GLY  30  10.329  12.188   2.266
  210   2HA   GLY  30          HA3       GLY  30  11.342  12.144   0.823
  211    H    PHE  31           H        PHE  31  10.558   9.047   2.314
  212    HA   PHE  31           HA       PHE  31   8.614   8.500   0.117
  213   1HB   PHE  31          HB2       PHE  31  10.933   6.638   0.589
  214   2HB   PHE  31          HB3       PHE  31   9.834   6.703  -0.767
  215    HD1  PHE  31           HD1      PHE  31  12.938   7.999   0.655
  216    HD2  PHE  31           HD2      PHE  31  10.029   8.543  -2.486
  217    HE1  PHE  31           HE1      PHE  31  14.525   9.445  -0.566
  218    HE2  PHE  31           HE2      PHE  31  11.631   9.985  -3.716
  219    HZ   PHE  31           HZ       PHE  31  13.884  10.427  -2.774
  220    H    THR  32           H        THR  32   8.258   5.821   0.359
  221    HA   THR  32           HA       THR  32   7.900   5.202   3.224
  222    HB   THR  32           HB       THR  32   5.907   3.817   2.435
  223    HG1  THR  32           HG1      THR  32   4.824   4.700   0.617
  224   1HG2  THR  32          HG21      THR  32   5.667   6.861   2.451
  225   2HG2  THR  32          HG22      THR  32   4.354   5.699   2.772
  226   3HG2  THR  32          HG23      THR  32   5.737   5.799   3.877
  227    H    THR  33           H        THR  33   8.339   3.054   3.722
  228    HA   THR  33           HA       THR  33   9.662   1.453   1.578
  229    HB   THR  33           HB       THR  33  11.610   1.238   2.953
  230    HG1  THR  33           HG1      THR  33  11.663   2.792   4.830
  231   1HG2  THR  33          HG21      THR  33  10.987   4.214   2.885
  232   2HG2  THR  33          HG22      THR  33  12.564   3.402   2.795
  233   3HG2  THR  33          HG23      THR  33  11.424   3.280   1.449
  234    H    GLU  34           H        GLU  34   9.887  -0.876   2.131
  235    HA   GLU  34           HA       GLU  34   8.174  -1.708   4.393
  236   1HB   GLU  34          HB2       GLU  34   7.698  -1.890   1.604
  237   2HB   GLU  34          HB3       GLU  34   8.276  -3.467   2.045
  238   1HG   GLU  34          HG2       GLU  34   6.630  -3.455   3.936
  239   2HG   GLU  34          HG3       GLU  34   6.057  -1.873   3.434
  240    H    THR  35           H        THR  35   9.751  -2.212   5.866
  241    HA   THR  35           HA       THR  35  12.098  -3.720   5.284
  242    HB   THR  35           HB       THR  35  10.691  -3.855   7.945
  243    HG1  THR  35           HG1      THR  35  11.066  -1.818   8.406
  244   1HG2  THR  35          HG21      THR  35  13.579  -3.334   7.112
  245   2HG2  THR  35          HG22      THR  35  13.000  -3.736   8.746
  246   3HG2  THR  35          HG23      THR  35  12.919  -4.947   7.451
  247    H    LEU  36           H        LEU  36  12.199  -5.809   4.684
  248    HA   LEU  36           HA       LEU  36  10.150  -7.738   5.686
  249   1HB   LEU  36          HB2       LEU  36  11.127  -7.364   2.819
  250   2HB   LEU  36          HB3       LEU  36  10.141  -8.713   3.368
  251    HG   LEU  36           HG       LEU  36   9.232  -5.812   3.476
  252   1HD1  LEU  36          HD11      LEU  36   8.629  -7.980   1.434
  253   2HD1  LEU  36          HD12      LEU  36   7.901  -6.353   1.486
  254   3HD1  LEU  36          HD13      LEU  36   9.635  -6.537   1.173
  255   1HD2  LEU  36          HD21      LEU  36   8.012  -7.293   5.065
  256   2HD2  LEU  36          HD22      LEU  36   6.974  -6.797   3.728
  257   3HD2  LEU  36          HD23      LEU  36   7.671  -8.432   3.746
  258    H    HIS  37           H        HIS  37  10.903  -9.904   5.734
  259    HA   HIS  37           HA       HIS  37  13.837 -10.209   5.720
  260   1HB   HIS  37          HB2       HIS  37  13.468 -12.230   6.956
  261   2HB   HIS  37          HB3       HIS  37  12.508 -10.959   7.688
  262    HD1  HIS  37           HD1      HIS  37  12.223 -14.352   6.153
  263    HD2  HIS  37           HD2      HIS  37   9.735 -11.177   7.345
  264    HE1  HIS  37           HE1      HIS  37   9.837 -15.290   6.223
  265    H    GLY  38           H        GLY  38  12.516  -9.757   3.250
  266   1HA   GLY  38          HA2       GLY  38  12.247 -10.503   1.122
  267   2HA   GLY  38          HA3       GLY  38  13.659 -11.514   1.452
  268    HA   PRO  39           HA       PRO  39  10.229 -14.571   2.588
  269   1HB   PRO  39          HB2       PRO  39   7.551 -13.939   2.549
  270   2HB   PRO  39          HB3       PRO  39   8.614 -13.671   3.962
  271   1HG   PRO  39          HG2       PRO  39   7.816 -11.673   1.823
  272   2HG   PRO  39          HG3       PRO  39   7.785 -11.460   3.603
  273   1HD   PRO  39          HD2       PRO  39   9.858 -10.555   2.092
  274   2HD   PRO  39          HD3       PRO  39  10.127 -11.268   3.716
  275    H    LEU  40           H        LEU  40   9.591 -12.367  -0.101
  276    HA   LEU  40           HA       LEU  40   8.854 -14.630  -1.867
  277   1HB   LEU  40          HB2       LEU  40   8.046 -11.681  -1.738
  278   2HB   LEU  40          HB3       LEU  40   7.721 -12.705  -3.106
  279    HG   LEU  40           HG       LEU  40   6.625 -13.171  -0.306
  280   1HD1  LEU  40          HD11      LEU  40   5.689 -11.165  -1.388
  281   2HD1  LEU  40          HD12      LEU  40   5.262 -12.122  -2.823
  282   3HD1  LEU  40          HD13      LEU  40   4.477 -12.447  -1.260
  283   1HD2  LEU  40          HD21      LEU  40   6.025 -14.608  -2.933
  284   2HD2  LEU  40          HD22      LEU  40   6.792 -15.310  -1.490
  285   3HD2  LEU  40          HD23      LEU  40   5.105 -14.804  -1.425
  286    H    LEU  41           H        LEU  41  11.518 -13.133  -0.997
  287    HA   LEU  41           HA       LEU  41  13.388 -12.235  -1.795
  288   1HB   LEU  41          HB2       LEU  41  13.159 -14.333  -3.251
  289   2HB   LEU  41          HB3       LEU  41  12.629 -13.248  -4.532
  290    HG   LEU  41           HG       LEU  41  14.858 -11.981  -4.185
  291   1HD1  LEU  41          HD11      LEU  41  15.516 -12.902  -1.999
  292   2HD1  LEU  41          HD12      LEU  41  15.547 -14.544  -2.687
  293   3HD1  LEU  41          HD13      LEU  41  16.696 -13.308  -3.246
  294   1HD2  LEU  41          HD21      LEU  41  16.096 -13.627  -5.560
  295   2HD2  LEU  41          HD22      LEU  41  14.858 -14.851  -5.177
  296   3HD2  LEU  41          HD23      LEU  41  14.426 -13.403  -6.107
  297    H    GLU  42           H        GLU  42  10.443 -11.146  -3.301
  298    HA   GLU  42           HA       GLU  42  11.452  -8.450  -3.832
  299   1HB   GLU  42          HB2       GLU  42  10.920  -8.674  -6.297
  300   2HB   GLU  42          HB3       GLU  42  12.402  -9.431  -5.752
  301   1HG   GLU  42          HG2       GLU  42  11.292 -11.665  -5.791
  302   2HG   GLU  42          HG3       GLU  42   9.831 -10.920  -6.428
  303    H    ASP  43           H        ASP  43   9.797  -7.905  -2.353
  304    HA   ASP  43           HA       ASP  43   7.033  -8.673  -2.842
  305   1HB   ASP  43          HB2       ASP  43   7.655  -7.982  -0.637
  306   2HB   ASP  43          HB3       ASP  43   8.245  -6.414  -1.223
  307    H    LEU  44           H        LEU  44   9.103  -5.821  -3.677
  308    HA   LEU  44           HA       LEU  44   6.914  -4.794  -5.395
  309   1HB   LEU  44          HB2       LEU  44   9.760  -3.810  -5.100
  310   2HB   LEU  44          HB3       LEU  44   8.615  -3.094  -6.156
  311    HG   LEU  44           HG       LEU  44   8.279  -3.197  -3.139
  312   1HD1  LEU  44          HD11      LEU  44  10.060  -1.646  -4.000
  313   2HD1  LEU  44          HD12      LEU  44   8.842  -0.843  -4.999
  314   3HD1  LEU  44          HD13      LEU  44   8.704  -0.797  -3.230
  315   1HD2  LEU  44          HD21      LEU  44   6.403  -1.593  -3.540
  316   2HD2  LEU  44          HD22      LEU  44   6.532  -1.911  -5.282
  317   3HD2  LEU  44          HD23      LEU  44   6.067  -3.208  -4.154
  318    HA   PRO  45           HA       PRO  45   8.108  -7.192  -8.876
  319   1HB   PRO  45          HB2       PRO  45   7.479  -5.487 -11.002
  320   2HB   PRO  45          HB3       PRO  45   6.328  -6.405 -10.034
  321   1HG   PRO  45          HG2       PRO  45   7.184  -3.508  -9.790
  322   2HG   PRO  45          HG3       PRO  45   5.536  -4.176  -9.649
  323   1HD   PRO  45          HD2       PRO  45   7.115  -3.527  -7.467
  324   2HD   PRO  45          HD3       PRO  45   5.880  -4.828  -7.438
  325    H    ALA  46           H        ALA  46   9.143  -6.791 -11.138
  326    HA   ALA  46           HA       ALA  46  11.902  -5.938 -10.780
  327   1HB   ALA  46          HB1       ALA  46  12.182  -6.772 -13.101
  328   2HB   ALA  46          HB2       ALA  46  11.329  -7.962 -12.105
  329   3HB   ALA  46          HB3       ALA  46  10.425  -6.950 -13.260
  330    H    SER  47           H        SER  47  10.128  -3.781 -10.366
  331    HA   SER  47           HA       SER  47  11.148  -1.774 -12.113
  332   1HB   SER  47          HB2       SER  47   8.172  -2.319 -12.157
  333   2HB   SER  47          HB3       SER  47   8.944  -0.868 -12.819
  334    HG   SER  47           HG       SER  47  10.051  -3.216 -13.703
  335    H    GLY  48           H        GLY  48  11.406  -0.001 -10.735
  336   1HA   GLY  48          HA2       GLY  48  10.108   1.362  -8.939
  337   2HA   GLY  48          HA3       GLY  48  10.094  -0.172  -8.065
  338    H    ILE  49           H        ILE  49  11.424   0.409  -6.404
  339    HA   ILE  49           HA       ILE  49  14.316   0.715  -7.031
  340    HB   ILE  49           HB       ILE  49  12.816   1.798  -4.643
  341   1HG1  ILE  49          HG12      ILE  49  12.080   3.171  -6.521
  342   2HG1  ILE  49          HG13      ILE  49  13.030   4.069  -5.361
  343   1HG2  ILE  49          HG21      ILE  49  14.930   3.090  -4.212
  344   2HG2  ILE  49          HG22      ILE  49  15.145   1.339  -4.119
  345   3HG2  ILE  49          HG23      ILE  49  15.694   2.216  -5.554
  346   1HD1  ILE  49          HD11      ILE  49  13.554   4.687  -7.692
  347   2HD1  ILE  49          HD12      ILE  49  14.974   4.065  -6.839
  348   3HD1  ILE  49          HD13      ILE  49  14.110   3.035  -8.010
  349    H    TRP  50           H        TRP  50  15.564  -0.794  -5.843
  350    HA   TRP  50           HA       TRP  50  14.144  -2.606  -3.929
  351   1HB   TRP  50          HB2       TRP  50  16.119  -3.138  -6.179
  352   2HB   TRP  50          HB3       TRP  50  16.089  -4.164  -4.779
  353    HD1  TRP  50           HD1      TRP  50  12.702  -3.088  -6.249
  354    HE1  TRP  50           HE1      TRP  50  11.610  -5.044  -7.456
  355    HE3  TRP  50           HE3      TRP  50  16.578  -6.419  -5.970
  356    HZ2  TRP  50           HZ2      TRP  50  12.321  -7.756  -8.181
  357    HZ3  TRP  50           HZ3      TRP  50  16.340  -8.687  -6.939
  358    HH2  TRP  50           HH2      TRP  50  14.219  -9.367  -8.041
  359    H    LEU  51           H        LEU  51  15.420  -3.180  -2.108
  360    HA   LEU  51           HA       LEU  51  18.214  -2.218  -1.991
  361   1HB   LEU  51          HB2       LEU  51  16.024  -1.701   0.061
  362   2HB   LEU  51          HB3       LEU  51  17.725  -1.771   0.504
  363    HG   LEU  51           HG       LEU  51  16.456   0.258  -1.396
  364   1HD1  LEU  51          HD11      LEU  51  17.138   1.828   0.396
  365   2HD1  LEU  51          HD12      LEU  51  15.944   0.640   0.954
  366   3HD1  LEU  51          HD13      LEU  51  17.646   0.465   1.408
  367   1HD2  LEU  51          HD21      LEU  51  18.650  -0.008  -2.258
  368   2HD2  LEU  51          HD22      LEU  51  18.822   1.331  -1.129
  369   3HD2  LEU  51          HD23      LEU  51  19.364  -0.291  -0.664
  370    H    VAL  52           H        VAL  52  19.528  -3.654  -0.921
  371    HA   VAL  52           HA       VAL  52  18.263  -6.204   0.006
  372    HB   VAL  52           HB       VAL  52  20.733  -5.814  -1.756
  373   1HG1  VAL  52          HG11      VAL  52  21.083  -7.697  -0.272
  374   2HG1  VAL  52          HG12      VAL  52  19.460  -8.316  -0.588
  375   3HG1  VAL  52          HG13      VAL  52  20.690  -8.328  -1.876
  376   1HG2  VAL  52          HG21      VAL  52  18.732  -5.494  -3.104
  377   2HG2  VAL  52          HG22      VAL  52  19.400  -7.086  -3.458
  378   3HG2  VAL  52          HG23      VAL  52  17.978  -6.940  -2.404
  379    H    ILE  53           H        ILE  53  18.939  -6.743   2.045
  380    HA   ILE  53           HA       ILE  53  21.261  -5.248   3.165
  381    HB   ILE  53           HB       ILE  53  18.675  -5.792   4.673
  382   1HG1  ILE  53          HG12      ILE  53  18.511  -3.162   4.513
  383   2HG1  ILE  53          HG13      ILE  53  19.421  -3.356   3.020
  384   1HG2  ILE  53          HG21      ILE  53  19.624  -4.221   6.280
  385   2HG2  ILE  53          HG22      ILE  53  20.816  -5.482   5.955
  386   3HG2  ILE  53          HG23      ILE  53  21.002  -3.887   5.209
  387   1HD1  ILE  53          HD11      ILE  53  17.569  -4.764   2.111
  388   2HD1  ILE  53          HD12      ILE  53  16.745  -4.656   3.675
  389   3HD1  ILE  53          HD13      ILE  53  16.988  -3.201   2.677
  390    H    SER  54           H        SER  54  22.778  -6.750   3.408
  391    HA   SER  54           HA       SER  54  22.248  -9.203   4.920
  392   1HB   SER  54          HB2       SER  54  23.312  -9.251   2.052
  393   2HB   SER  54          HB3       SER  54  23.228 -10.638   3.148
  394    HG   SER  54           HG       SER  54  20.976 -10.335   3.224
  395    H    SER  55           H        SER  55  24.629 -10.428   4.881
  396    HA   SER  55           HA       SER  55  26.861  -8.529   4.738
  397   1HB   SER  55          HB2       SER  55  26.014  -9.803   7.365
  398   2HB   SER  55          HB3       SER  55  27.561  -8.977   7.083
  399    HG   SER  55           HG       SER  55  25.445  -7.493   6.255
  400    H    THR  56           H        THR  56  26.879 -10.130   2.944
  401    HA   THR  56           HA       THR  56  27.254 -12.870   3.042
  402    HB   THR  56           HB       THR  56  28.537 -12.413   0.889
  403    HG1  THR  56           HG1      THR  56  29.335 -10.603   0.636
  404   1HG2  THR  56          HG21      THR  56  26.149 -12.520   0.619
  405   2HG2  THR  56          HG22      THR  56  25.931 -10.854   1.210
  406   3HG2  THR  56          HG23      THR  56  26.757 -11.169  -0.330
  407    H    HIS  57           H        HIS  57  29.575 -10.348   3.797
  408    HA   HIS  57           HA       HIS  57  31.410 -12.318   4.986
  409   1HB   HIS  57          HB2       HIS  57  32.428 -11.595   2.848
  410   2HB   HIS  57          HB3       HIS  57  32.163  -9.907   3.258
  411    HD1  HIS  57           HD1      HIS  57  34.581  -8.922   3.703
  412    HD2  HIS  57           HD2      HIS  57  33.902 -12.791   5.284
  413    HE1  HIS  57           HE1      HIS  57  36.674  -9.573   4.947
  414    H    GLY  58           H        GLY  58  31.651 -11.678   7.133
  415   1HA   GLY  58          HA2       GLY  58  31.721  -9.851   8.817
  416   2HA   GLY  58          HA3       GLY  58  30.351  -9.111   7.976
  417    H    ALA  59           H        ALA  59  28.807 -11.434   7.412
  418    HA   ALA  59           HA       ALA  59  28.459 -12.922   9.945
  419   1HB   ALA  59          HB1       ALA  59  26.135 -11.712   8.389
  420   2HB   ALA  59          HB2       ALA  59  26.051 -12.652   9.887
  421   3HB   ALA  59          HB3       ALA  59  26.782 -11.036   9.908
  422    H    GLY  60           H        GLY  60  29.904 -13.638   7.682
  423   1HA   GLY  60          HA2       GLY  60  28.749 -16.032   6.663
  424   2HA   GLY  60          HA3       GLY  60  28.656 -14.768   5.454
  425    H    ASP  61           H        ASP  61  30.246 -15.452   4.109
  426    HA   ASP  61           HA       ASP  61  33.055 -15.495   4.964
  427   1HB   ASP  61          HB2       ASP  61  32.318 -17.794   5.484
  428   2HB   ASP  61          HB3       ASP  61  31.655 -17.974   3.862
  429    H    ILE  62           H        ILE  62  30.684 -16.276   2.408
  430    HA   ILE  62           HA       ILE  62  31.903 -14.530   0.432
  431    HB   ILE  62           HB       ILE  62  31.899 -16.369  -1.280
  432   1HG1  ILE  62          HG12      ILE  62  31.724 -18.333   1.042
  433   2HG1  ILE  62          HG13      ILE  62  30.375 -17.933  -0.012
  434   1HG2  ILE  62          HG21      ILE  62  34.065 -17.200  -0.834
  435   2HG2  ILE  62          HG22      ILE  62  33.989 -15.617  -0.060
  436   3HG2  ILE  62          HG23      ILE  62  33.848 -17.080   0.921
  437   1HD1  ILE  62          HD11      ILE  62  31.668 -18.750  -1.981
  438   2HD1  ILE  62          HD12      ILE  62  32.982 -19.243  -0.884
  439   3HD1  ILE  62          HD13      ILE  62  31.392 -20.003  -0.755
  440    HA   PRO  63           HA       PRO  63  27.622 -13.931  -0.731
  441   1HB   PRO  63          HB2       PRO  63  28.248 -15.295  -3.370
  442   2HB   PRO  63          HB3       PRO  63  27.185 -13.887  -3.075
  443   1HG   PRO  63          HG2       PRO  63  29.715 -13.444  -3.861
  444   2HG   PRO  63          HG3       PRO  63  29.101 -12.515  -2.454
  445   1HD   PRO  63          HD2       PRO  63  30.834 -14.984  -2.486
  446   2HD   PRO  63          HD3       PRO  63  31.016 -13.508  -1.494
  447    H    ASP  64           H        ASP  64  28.779 -17.244  -1.489
  448    HA   ASP  64           HA       ASP  64  26.286 -18.557  -1.508
  449   1HB   ASP  64          HB2       ASP  64  28.452 -19.506  -2.281
  450   2HB   ASP  64          HB3       ASP  64  28.970 -19.640  -0.598
  451    H    ASN  65           H        ASN  65  27.765 -17.017   1.174
  452    HA   ASN  65           HA       ASN  65  26.910 -18.451   3.447
  453   1HB   ASN  65          HB2       ASN  65  28.210 -16.447   3.624
  454   2HB   ASN  65          HB3       ASN  65  26.904 -15.487   2.925
  455   1HD2  ASN  65          HD22      ASN  65  25.883 -14.309   4.598
  456   2HD2  ASN  65          HD21      ASN  65  25.761 -14.895   6.234
  457    H    LEU  66           H        LEU  66  25.147 -16.414   1.094
  458    HA   LEU  66           HA       LEU  66  22.642 -16.323   2.628
  459   1HB   LEU  66          HB2       LEU  66  23.585 -15.285  -0.078
  460   2HB   LEU  66          HB3       LEU  66  21.892 -15.260   0.380
  461    HG   LEU  66           HG       LEU  66  22.205 -13.697   2.102
  462   1HD1  LEU  66          HD11      LEU  66  24.142 -14.409   3.266
  463   2HD1  LEU  66          HD12      LEU  66  25.192 -14.078   1.865
  464   3HD1  LEU  66          HD13      LEU  66  24.420 -12.741   2.757
  465   1HD2  LEU  66          HD21      LEU  66  23.960 -12.905  -0.243
  466   2HD2  LEU  66          HD22      LEU  66  22.195 -12.730  -0.130
  467   3HD2  LEU  66          HD23      LEU  66  23.233 -11.779   0.923
  468    H    SER  67           H        SER  67  21.078 -17.977   2.437
  469    HA   SER  67           HA       SER  67  21.890 -20.217   0.763
  470   1HB   SER  67          HB2       SER  67  19.654 -21.047   2.084
  471   2HB   SER  67          HB3       SER  67  21.313 -21.177   2.673
  472    HG   SER  67           HG       SER  67  19.973 -20.268   4.236
  473    HA   PRO  68           HA       PRO  68  17.714 -19.554  -1.307
  474   1HB   PRO  68          HB2       PRO  68  15.977 -17.551  -0.658
  475   2HB   PRO  68          HB3       PRO  68  16.095 -19.068   0.280
  476   1HG   PRO  68          HG2       PRO  68  17.356 -16.393   0.935
  477   2HG   PRO  68          HG3       PRO  68  16.483 -17.506   2.029
  478   1HD   PRO  68          HD2       PRO  68  19.177 -17.465   1.881
  479   2HD   PRO  68          HD3       PRO  68  18.242 -18.948   2.221
  480    H    PHE  69           H        PHE  69  19.014 -16.372  -0.331
  481    HA   PHE  69           HA       PHE  69  18.142 -14.889  -2.498
  482   1HB   PHE  69          HB2       PHE  69  19.599 -14.408  -0.184
  483   2HB   PHE  69          HB3       PHE  69  20.782 -14.037  -1.391
  484    HD1  PHE  69           HD1      PHE  69  18.611 -12.437   0.629
  485    HD2  PHE  69           HD2      PHE  69  19.566 -12.703  -3.566
  486    HE1  PHE  69           HE1      PHE  69  17.673 -10.174   0.263
  487    HE2  PHE  69           HE2      PHE  69  18.559 -10.468  -3.940
  488    HZ   PHE  69           HZ       PHE  69  17.581  -9.216  -2.032
  489    H    TYR  70           H        TYR  70  21.471 -15.948  -2.013
  490    HA   TYR  70           HA       TYR  70  22.426 -15.039  -4.455
  491   1HB   TYR  70          HB2       TYR  70  23.869 -15.558  -2.557
  492   2HB   TYR  70          HB3       TYR  70  23.495 -17.266  -2.729
  493    HD1  TYR  70           HD1      TYR  70  24.664 -14.508  -5.055
  494    HD2  TYR  70           HD2      TYR  70  25.243 -18.534  -3.610
  495    HE1  TYR  70           HE1      TYR  70  26.539 -14.803  -6.641
  496    HE2  TYR  70           HE2      TYR  70  27.138 -18.825  -5.164
  497    HH   TYR  70           HH       TYR  70  28.389 -17.878  -6.859
  498    H    GLU  71           H        GLU  71  21.248 -18.356  -3.706
  499    HA   GLU  71           HA       GLU  71  21.820 -19.336  -6.340
  500   1HB   GLU  71          HB2       GLU  71  19.848 -20.395  -4.267
  501   2HB   GLU  71          HB3       GLU  71  20.444 -21.249  -5.700
  502   1HG   GLU  71          HG2       GLU  71  22.810 -20.748  -4.682
  503   2HG   GLU  71          HG3       GLU  71  21.950 -20.475  -3.182
  504    H    ALA  72           H        ALA  72  18.780 -18.028  -4.826
  505    HA   ALA  72           HA       ALA  72  17.142 -18.602  -7.066
  506   1HB   ALA  72          HB1       ALA  72  16.852 -16.383  -4.999
  507   2HB   ALA  72          HB2       ALA  72  15.589 -16.942  -6.118
  508   3HB   ALA  72          HB3       ALA  72  16.205 -18.040  -4.866
  509    H    LEU  73           H        LEU  73  19.268 -15.786  -6.373
  510    HA   LEU  73           HA       LEU  73  18.317 -14.039  -8.358
  511   1HB   LEU  73          HB2       LEU  73  21.052 -14.581  -7.141
  512   2HB   LEU  73          HB3       LEU  73  20.877 -13.424  -8.431
  513    HG   LEU  73           HG       LEU  73  19.417 -13.283  -5.769
  514   1HD1  LEU  73          HD11      LEU  73  20.994 -11.444  -5.257
  515   2HD1  LEU  73          HD12      LEU  73  21.826 -12.982  -5.534
  516   3HD1  LEU  73          HD13      LEU  73  21.835 -11.736  -6.797
  517   1HD2  LEU  73          HD21      LEU  73  18.908 -10.936  -6.426
  518   2HD2  LEU  73          HD22      LEU  73  19.590 -11.247  -8.039
  519   3HD2  LEU  73          HD23      LEU  73  18.124 -12.092  -7.491
  520    H    GLN  74           H        GLN  74  20.985 -16.439  -8.631
  521    HA   GLN  74           HA       GLN  74  21.203 -16.004 -11.468
  522   1HB   GLN  74          HB2       GLN  74  22.932 -17.799 -11.321
  523   2HB   GLN  74          HB3       GLN  74  23.153 -16.437 -10.247
  524   1HG   GLN  74          HG2       GLN  74  22.198 -17.793  -8.371
  525   2HG   GLN  74          HG3       GLN  74  22.088 -19.158  -9.443
  526   1HE2  GLN  74          HE22      GLN  74  24.280 -16.771  -7.925
  527   2HE2  GLN  74          HE21      GLN  74  25.776 -17.621  -8.203
  528    H    GLU  75           H        GLU  75  19.108 -18.025  -9.586
  529    HA   GLU  75           HA       GLU  75  18.740 -20.020 -11.604
  530   1HB   GLU  75          HB2       GLU  75  18.235 -20.352  -9.209
  531   2HB   GLU  75          HB3       GLU  75  16.903 -19.197  -9.348
  532   1HG   GLU  75          HG2       GLU  75  15.745 -20.675 -10.931
  533   2HG   GLU  75          HG3       GLU  75  17.123 -21.780 -10.943
  534    H    GLN  76           H        GLN  76  17.115 -16.897 -10.891
  535    HA   GLN  76           HA       GLN  76  15.400 -17.350 -13.294
  536   1HB   GLN  76          HB2       GLN  76  13.888 -15.637 -12.260
  537   2HB   GLN  76          HB3       GLN  76  13.934 -17.229 -11.517
  538   1HG   GLN  76          HG2       GLN  76  14.936 -16.498  -9.582
  539   2HG   GLN  76          HG3       GLN  76  15.740 -15.132 -10.355
  540   1HE2  GLN  76          HE22      GLN  76  14.992 -13.914  -8.447
  541   2HE2  GLN  76          HE21      GLN  76  13.403 -13.169  -8.519
  542    H    LYS  77           H        LYS  77  17.759 -15.107 -11.974
  543    HA   LYS  77           HA       LYS  77  18.349 -12.997 -12.565
  544   1HB   LYS  77          HB2       LYS  77  18.729 -14.555 -15.120
  545   2HB   LYS  77          HB3       LYS  77  19.513 -13.008 -14.760
  546   1HG   LYS  77          HG2       LYS  77  20.595 -13.970 -12.814
  547   2HG   LYS  77          HG3       LYS  77  19.794 -15.523 -13.072
  548   1HD   LYS  77          HD2       LYS  77  21.730 -14.310 -15.066
  549   2HD   LYS  77          HD3       LYS  77  22.196 -15.436 -13.773
  550   1HE   LYS  77          HE2       LYS  77  20.607 -17.094 -14.685
  551   2HE   LYS  77          HE3       LYS  77  20.169 -15.990 -15.994
  552   1HZ   LYS  77          HZ1       LYS  77  22.471 -16.108 -16.767
  553   2HZ   LYS  77          HZ2       LYS  77  22.871 -17.136 -15.558
  554   3HZ   LYS  77          HZ3       LYS  77  21.819 -17.597 -16.711
  555    HA   PRO  78           HA       PRO  78  14.284 -12.036 -14.615
  556   1HB   PRO  78          HB2       PRO  78  13.294 -10.188 -12.768
  557   2HB   PRO  78          HB3       PRO  78  12.999 -11.937 -12.776
  558   1HG   PRO  78          HG2       PRO  78  14.987 -10.351 -11.166
  559   2HG   PRO  78          HG3       PRO  78  14.013 -11.747 -10.639
  560   1HD   PRO  78          HD2       PRO  78  16.675 -11.933 -11.346
  561   2HD   PRO  78          HD3       PRO  78  15.515 -13.262 -11.604
  562    H    ASP  79           H        ASP  79  13.336 -10.010 -15.350
  563    HA   ASP  79           HA       ASP  79  15.430  -8.412 -16.583
  564   1HB   ASP  79          HB2       ASP  79  13.556  -9.287 -17.897
  565   2HB   ASP  79          HB3       ASP  79  12.409  -8.360 -16.922
  566    H    LEU  80           H        LEU  80  16.013  -7.679 -14.361
  567    HA   LEU  80           HA       LEU  80  14.463  -5.590 -13.093
  568   1HB   LEU  80          HB2       LEU  80  17.295  -6.592 -12.843
  569   2HB   LEU  80          HB3       LEU  80  16.767  -5.237 -11.936
  570    HG   LEU  80           HG       LEU  80  16.049  -6.374 -10.268
  571   1HD1  LEU  80          HD11      LEU  80  13.864  -6.584 -11.179
  572   2HD1  LEU  80          HD12      LEU  80  14.309  -8.044 -12.107
  573   3HD1  LEU  80          HD13      LEU  80  14.268  -8.065 -10.331
  574   1HD2  LEU  80          HD21      LEU  80  16.813  -8.882 -11.780
  575   2HD2  LEU  80          HD22      LEU  80  17.910  -7.856 -10.815
  576   3HD2  LEU  80          HD23      LEU  80  16.594  -8.730 -10.023
  577    H    SER  81           H        SER  81  15.742  -5.288 -16.062
  578    HA   SER  81           HA       SER  81  17.471  -3.147 -16.122
  579   1HB   SER  81          HB2       SER  81  15.346  -3.952 -18.146
  580   2HB   SER  81          HB3       SER  81  16.983  -3.356 -18.415
  581    HG   SER  81           HG       SER  81  16.089  -5.863 -18.169
  582    H    ALA  82           H        ALA  82  14.303  -3.182 -15.030
  583    HA   ALA  82           HA       ALA  82  13.806  -0.313 -15.706
  584   1HB   ALA  82          HB1       ALA  82  11.402  -0.826 -15.476
  585   2HB   ALA  82          HB2       ALA  82  12.152  -1.799 -16.754
  586   3HB   ALA  82          HB3       ALA  82  11.792  -2.532 -15.176
  587    H    VAL  83           H        VAL  83  15.128  -2.085 -13.307
  588    HA   VAL  83           HA       VAL  83  14.118  -0.167 -11.297
  589    HB   VAL  83           HB       VAL  83  12.904  -2.014 -10.686
  590   1HG1  VAL  83          HG11      VAL  83  13.741  -4.314 -10.364
  591   2HG1  VAL  83          HG12      VAL  83  13.850  -3.777 -12.042
  592   3HG1  VAL  83          HG13      VAL  83  15.311  -3.807 -11.020
  593   1HG2  VAL  83          HG21      VAL  83  13.577  -2.758  -8.574
  594   2HG2  VAL  83          HG22      VAL  83  15.299  -2.507  -8.903
  595   3HG2  VAL  83          HG23      VAL  83  14.206  -1.126  -8.707
  596    H    ARG  84           H        ARG  84  15.605   0.029  -9.420
  597    HA   ARG  84           HA       ARG  84  18.456  -0.396 -10.128
  598   1HB   ARG  84          HB2       ARG  84  18.979   1.719  -8.940
  599   2HB   ARG  84          HB3       ARG  84  18.094   1.966 -10.451
  600   1HG   ARG  84          HG2       ARG  84  16.028   2.378  -9.270
  601   2HG   ARG  84          HG3       ARG  84  16.773   2.038  -7.700
  602   1HD   ARG  84          HD2       ARG  84  17.957   4.149  -9.515
  603   2HD   ARG  84          HD3       ARG  84  16.488   4.506  -8.604
  604    HE   ARG  84           HE       ARG  84  18.376   3.440  -6.766
  605   1HH1  ARG  84          HH11      ARG  84  18.262   6.165  -8.991
  606   2HH1  ARG  84          HH12      ARG  84  18.921   7.315  -7.889
  607   1HH2  ARG  84          HH21      ARG  84  19.137   4.992  -5.193
  608   2HH2  ARG  84          HH22      ARG  84  19.396   6.634  -5.629
  609    H    PHE  85           H        PHE  85  19.748  -0.846  -8.287
  610    HA   PHE  85           HA       PHE  85  18.176  -1.545  -5.853
  611   1HB   PHE  85          HB2       PHE  85  19.075  -3.597  -5.577
  612   2HB   PHE  85          HB3       PHE  85  18.744  -3.564  -7.289
  613    HD1  PHE  85           HD1      PHE  85  20.806  -2.941  -8.857
  614    HD2  PHE  85           HD2      PHE  85  21.205  -4.235  -4.764
  615    HE1  PHE  85           HE1      PHE  85  23.049  -3.810  -9.355
  616    HE2  PHE  85           HE2      PHE  85  23.502  -5.031  -5.254
  617    HZ   PHE  85           HZ       PHE  85  24.423  -4.854  -7.556
  618    H    GLY  86           H        GLY  86  19.534  -1.760  -3.926
  619   1HA   GLY  86          HA2       GLY  86  22.227  -0.527  -4.042
  620   2HA   GLY  86          HA3       GLY  86  21.040   0.118  -2.891
  621    H    ALA  87           H        ALA  87  23.477  -2.127  -3.269
  622    HA   ALA  87           HA       ALA  87  22.501  -4.200  -1.423
  623   1HB   ALA  87          HB1       ALA  87  25.245  -3.492  -2.567
  624   2HB   ALA  87          HB2       ALA  87  24.952  -4.834  -1.456
  625   3HB   ALA  87          HB3       ALA  87  24.195  -4.844  -3.060
  626    H    ILE  88           H        ILE  88  22.968  -4.210   0.782
  627    HA   ILE  88           HA       ILE  88  24.358  -1.871   1.963
  628    HB   ILE  88           HB       ILE  88  21.675  -3.005   2.865
  629   1HG1  ILE  88          HG12      ILE  88  22.224  -0.585   1.135
  630   2HG1  ILE  88          HG13      ILE  88  21.095  -1.898   0.895
  631   1HG2  ILE  88          HG21      ILE  88  22.895  -2.240   4.733
  632   2HG2  ILE  88          HG22      ILE  88  23.430  -0.763   3.913
  633   3HG2  ILE  88          HG23      ILE  88  21.739  -0.981   4.395
  634   1HD1  ILE  88          HD11      ILE  88  19.905   0.123   1.439
  635   2HD1  ILE  88          HD12      ILE  88  19.698  -1.028   2.774
  636   3HD1  ILE  88          HD13      ILE  88  20.815   0.355   2.913
  637    H    GLY  89           H        GLY  89  25.760  -2.521   3.542
  638   1HA   GLY  89          HA2       GLY  89  26.658  -3.742   5.274
  639   2HA   GLY  89          HA3       GLY  89  25.240  -4.800   5.257
  640    H    ILE  90           H        ILE  90  25.669  -5.400   2.351
  641    HA   ILE  90           HA       ILE  90  27.058  -7.773   2.396
  642    HB   ILE  90           HB       ILE  90  26.455  -5.816   0.154
  643   1HG1  ILE  90          HG12      ILE  90  25.157  -8.273   1.331
  644   2HG1  ILE  90          HG13      ILE  90  24.482  -6.660   1.177
  645   1HG2  ILE  90          HG21      ILE  90  28.369  -7.235  -0.583
  646   2HG2  ILE  90          HG22      ILE  90  27.383  -8.681  -0.250
  647   3HG2  ILE  90          HG23      ILE  90  26.900  -7.511  -1.498
  648   1HD1  ILE  90          HD11      ILE  90  23.372  -8.151  -0.349
  649   2HD1  ILE  90          HD12      ILE  90  24.332  -7.009  -1.306
  650   3HD1  ILE  90          HD13      ILE  90  24.902  -8.676  -1.052
  651    H    GLY  91           H        GLY  91  29.113  -8.411   2.386
  652   1HA   GLY  91          HA2       GLY  91  31.144  -6.265   2.715
  653   2HA   GLY  91          HA3       GLY  91  31.204  -7.889   3.393
  654    H    SER  92           H        SER  92  30.346  -9.081   0.762
  655    HA   SER  92           HA       SER  92  32.879  -9.585  -0.403
  656   1HB   SER  92          HB2       SER  92  30.166  -9.993  -1.667
  657   2HB   SER  92          HB3       SER  92  31.654 -10.903  -1.947
  658    HG   SER  92           HG       SER  92  31.507 -11.692   0.193
  659    H    ARG  93           H        ARG  93  34.043  -8.070  -1.433
  660    HA   ARG  93           HA       ARG  93  32.806  -6.154  -3.318
  661   1HB   ARG  93          HB2       ARG  93  34.330  -5.477  -0.761
  662   2HB   ARG  93          HB3       ARG  93  34.209  -4.341  -2.094
  663   1HG   ARG  93          HG2       ARG  93  31.879  -4.090  -1.905
  664   2HG   ARG  93          HG3       ARG  93  31.704  -5.458  -0.796
  665   1HD   ARG  93          HD2       ARG  93  33.189  -2.884  -0.147
  666   2HD   ARG  93          HD3       ARG  93  31.555  -3.315   0.405
  667    HE   ARG  93           HE       ARG  93  33.263  -5.437   1.126
  668   1HH1  ARG  93          HH11      ARG  93  32.724  -2.076   2.088
  669   2HH1  ARG  93          HH12      ARG  93  33.254  -2.295   3.724
  670   1HH2  ARG  93          HH22      ARG  93  34.165  -5.726   3.199
  671   2HH2  ARG  93          HH21      ARG  93  34.055  -4.431   4.367
  672    H    GLU  94           H        GLU  94  34.437  -5.099  -4.550
  673    HA   GLU  94           HA       GLU  94  36.356  -6.785  -5.622
  674   1HB   GLU  94          HB2       GLU  94  36.340  -3.776  -5.776
  675   2HB   GLU  94          HB3       GLU  94  36.994  -4.901  -6.971
  676   1HG   GLU  94          HG2       GLU  94  34.629  -5.780  -7.296
  677   2HG   GLU  94          HG3       GLU  94  34.051  -4.491  -6.234
  678    H    TYR  95           H        TYR  95  36.707  -4.594  -2.909
  679    HA   TYR  95           HA       TYR  95  39.643  -4.868  -2.864
  680   1HB   TYR  95          HB2       TYR  95  37.708  -2.804  -1.727
  681   2HB   TYR  95          HB3       TYR  95  39.445  -2.757  -1.589
  682    HD1  TYR  95           HD1      TYR  95  36.661  -1.722  -3.579
  683    HD2  TYR  95           HD2      TYR  95  40.846  -2.754  -3.816
  684    HE1  TYR  95           HE1      TYR  95  36.828  -0.532  -5.743
  685    HE2  TYR  95           HE2      TYR  95  41.024  -1.566  -5.978
  686    HH   TYR  95           HH       TYR  95  39.901  -0.329  -7.604
  687    H    ASP  96           H        ASP  96  37.303  -6.667  -1.635
  688    HA   ASP  96           HA       ASP  96  38.505  -6.847   1.082
  689   1HB   ASP  96          HB2       ASP  96  36.316  -5.556   1.069
  690   2HB   ASP  96          HB3       ASP  96  35.534  -7.036   0.508
  691    H    THR  97           H        THR  97  38.835  -8.347  -1.499
  692    HA   THR  97           HA       THR  97  37.364 -10.773  -1.374
  693    HB   THR  97           HB       THR  97  38.986 -11.329  -3.305
  694    HG1  THR  97           HG1      THR  97  40.403  -9.729  -3.904
  695   1HG2  THR  97          HG21      THR  97  37.997  -9.810  -4.855
  696   2HG2  THR  97          HG22      THR  97  36.776 -10.043  -3.590
  697   3HG2  THR  97          HG23      THR  97  37.761  -8.566  -3.618
  698    H    PHE  98           H        PHE  98  39.253 -10.132   0.918
  699    HA   PHE  98           HA       PHE  98  41.579 -11.719   0.798
  700   1HB   PHE  98          HB2       PHE  98  40.036 -10.844   3.267
  701   2HB   PHE  98          HB3       PHE  98  41.715 -11.367   3.229
  702    HD1  PHE  98           HD1      PHE  98  43.323 -10.031   1.586
  703    HD2  PHE  98           HD2      PHE  98  39.578  -8.522   3.109
  704    HE1  PHE  98           HE1      PHE  98  44.055  -7.711   1.097
  705    HE2  PHE  98           HE2      PHE  98  40.318  -6.205   2.622
  706    HZ   PHE  98           HZ       PHE  98  42.552  -5.793   1.610
  707    H    CYS  99           H        CYS  99  38.312 -12.732   1.572
  708    HA   CYS  99           HA       CYS  99  39.317 -15.458   2.264
  709   1HB   CYS  99          HB2       CYS  99  36.672 -14.129   3.010
  710   2HB   CYS  99          HB3       CYS  99  37.198 -15.751   3.478
  711    HG   CYS  99           HG       CYS  99  39.349 -15.016   4.774
  712    H    GLY 100           H        GLY 100  38.914 -14.279  -0.475
  713   1HA   GLY 100          HA2       GLY 100  38.115 -15.017  -2.498
  714   2HA   GLY 100          HA3       GLY 100  37.359 -16.409  -1.700
  715    H    ALA 101           H        ALA 101  36.667 -13.207  -0.497
  716    HA   ALA 101           HA       ALA 101  33.831 -13.503  -0.970
  717   1HB   ALA 101          HB1       ALA 101  34.784 -12.658   1.163
  718   2HB   ALA 101          HB2       ALA 101  35.411 -11.229   0.308
  719   3HB   ALA 101          HB3       ALA 101  33.666 -11.504   0.432
  720    H    ILE 102           H        ILE 102  34.644 -13.544  -3.428
  721    HA   ILE 102           HA       ILE 102  34.903 -11.055  -4.838
  722    HB   ILE 102           HB       ILE 102  33.682 -13.686  -5.777
  723   1HG1  ILE 102          HG12      ILE 102  35.835 -14.315  -4.986
  724   2HG1  ILE 102          HG13      ILE 102  35.896 -14.261  -6.729
  725   1HG2  ILE 102          HG21      ILE 102  34.939 -11.397  -7.355
  726   2HG2  ILE 102          HG22      ILE 102  34.445 -12.960  -8.038
  727   3HG2  ILE 102          HG23      ILE 102  33.232 -11.882  -7.356
  728   1HD1  ILE 102          HD11      ILE 102  37.944 -13.349  -5.811
  729   2HD1  ILE 102          HD12      ILE 102  37.058 -12.028  -6.593
  730   3HD1  ILE 102          HD13      ILE 102  37.051 -12.192  -4.818
  731    H    ASP 103           H        ASP 103  33.268  -9.795  -5.773
  732    HA   ASP 103           HA       ASP 103  30.940  -9.361  -4.214
  733   1HB   ASP 103          HB2       ASP 103  30.698  -7.418  -5.459
  734   2HB   ASP 103          HB3       ASP 103  32.434  -7.668  -5.406
  735    H    LYS 104           H        LYS 104  30.785 -12.011  -5.593
  736    HA   LYS 104           HA       LYS 104  29.293 -11.876  -7.947
  737   1HB   LYS 104          HB2       LYS 104  29.223 -14.173  -5.969
  738   2HB   LYS 104          HB3       LYS 104  28.763 -14.215  -7.669
  739   1HG   LYS 104          HG2       LYS 104  31.133 -13.500  -8.205
  740   2HG   LYS 104          HG3       LYS 104  31.521 -13.704  -6.498
  741   1HD   LYS 104          HD2       LYS 104  32.255 -15.664  -7.629
  742   2HD   LYS 104          HD3       LYS 104  30.837 -16.114  -6.667
  743   1HE   LYS 104          HE2       LYS 104  29.413 -16.012  -8.682
  744   2HE   LYS 104          HE3       LYS 104  30.776 -15.429  -9.647
  745   1HZ   LYS 104          HZ1       LYS 104  30.414 -17.798  -9.944
  746   2HZ   LYS 104          HZ2       LYS 104  31.876 -17.552  -9.274
  747   3HZ   LYS 104          HZ3       LYS 104  30.634 -18.094  -8.358
  748    H    LEU 105           H        LEU 105  28.026 -11.499  -4.666
  749    HA   LEU 105           HA       LEU 105  25.310 -12.124  -5.292
  750   1HB   LEU 105          HB2       LEU 105  26.402 -11.809  -2.969
  751   2HB   LEU 105          HB3       LEU 105  26.304 -10.088  -3.225
  752    HG   LEU 105           HG       LEU 105  24.540 -10.945  -1.801
  753   1HD1  LEU 105          HD11      LEU 105  22.629  -9.862  -2.688
  754   2HD1  LEU 105          HD12      LEU 105  24.022  -8.972  -3.326
  755   3HD1  LEU 105          HD13      LEU 105  23.134 -10.116  -4.360
  756   1HD2  LEU 105          HD21      LEU 105  23.543 -12.525  -4.191
  757   2HD2  LEU 105          HD22      LEU 105  24.367 -13.206  -2.771
  758   3HD2  LEU 105          HD23      LEU 105  22.776 -12.434  -2.597
  759    H    GLU 106           H        GLU 106  27.049  -9.010  -5.076
  760    HA   GLU 106           HA       GLU 106  24.979  -7.367  -6.176
  761   1HB   GLU 106          HB2       GLU 106  27.999  -6.956  -6.343
  762   2HB   GLU 106          HB3       GLU 106  26.755  -5.726  -6.566
  763   1HG   GLU 106          HG2       GLU 106  26.069  -6.030  -4.183
  764   2HG   GLU 106          HG3       GLU 106  27.400  -7.171  -3.962
  765    H    ALA 107           H        ALA 107  27.669  -9.240  -7.623
  766    HA   ALA 107           HA       ALA 107  27.504  -8.155 -10.215
  767   1HB   ALA 107          HB1       ALA 107  28.802 -10.019 -10.954
  768   2HB   ALA 107          HB2       ALA 107  29.371  -9.623  -9.320
  769   3HB   ALA 107          HB3       ALA 107  28.288 -11.020  -9.596
  770    H    GLU 108           H        GLU 108  25.801 -11.078  -8.819
  771    HA   GLU 108           HA       GLU 108  24.503 -11.714 -11.270
  772   1HB   GLU 108          HB2       GLU 108  23.963 -12.337  -8.367
  773   2HB   GLU 108          HB3       GLU 108  22.814 -12.781  -9.610
  774   1HG   GLU 108          HG2       GLU 108  25.664 -13.780  -9.345
  775   2HG   GLU 108          HG3       GLU 108  24.168 -14.691  -9.181
  776    H    LEU 109           H        LEU 109  23.601  -9.430  -8.664
  777    HA   LEU 109           HA       LEU 109  20.938  -8.947  -9.633
  778   1HB   LEU 109          HB2       LEU 109  22.879  -7.469  -7.839
  779   2HB   LEU 109          HB3       LEU 109  21.413  -6.660  -8.360
  780    HG   LEU 109           HG       LEU 109  21.262  -9.421  -7.120
  781   1HD1  LEU 109          HD11      LEU 109  20.951  -8.452  -4.920
  782   2HD1  LEU 109          HD12      LEU 109  22.536  -7.979  -5.547
  783   3HD1  LEU 109          HD13      LEU 109  21.195  -6.813  -5.560
  784   1HD2  LEU 109          HD21      LEU 109  19.219  -8.553  -8.207
  785   2HD2  LEU 109          HD22      LEU 109  19.000  -8.592  -6.451
  786   3HD2  LEU 109          HD23      LEU 109  19.333  -7.053  -7.263
  787    H    LYS 110           H        LYS 110  24.058  -7.234 -10.269
  788    HA   LYS 110           HA       LYS 110  22.717  -5.434 -12.043
  789   1HB   LYS 110          HB2       LYS 110  24.787  -4.397 -12.642
  790   2HB   LYS 110          HB3       LYS 110  24.449  -4.463 -10.913
  791   1HG   LYS 110          HG2       LYS 110  25.704  -6.774 -11.308
  792   2HG   LYS 110          HG3       LYS 110  26.602  -5.801 -12.471
  793   1HD   LYS 110          HD2       LYS 110  26.260  -5.228  -9.478
  794   2HD   LYS 110          HD3       LYS 110  27.729  -5.836 -10.251
  795   1HE   LYS 110          HE2       LYS 110  27.913  -3.729 -11.553
  796   2HE   LYS 110          HE3       LYS 110  26.443  -3.120 -10.781
  797   1HZ   LYS 110          HZ1       LYS 110  28.434  -2.292  -9.687
  798   2HZ   LYS 110          HZ2       LYS 110  27.600  -3.225  -8.631
  799   3HZ   LYS 110          HZ3       LYS 110  28.956  -3.797  -9.359
  800    H    ASN 111           H        ASN 111  24.291  -8.510 -12.528
  801    HA   ASN 111           HA       ASN 111  24.259  -8.482 -15.399
  802   1HB   ASN 111          HB2       ASN 111  25.495 -10.227 -14.706
  803   2HB   ASN 111          HB3       ASN 111  24.669 -10.404 -13.192
  804   1HD2  ASN 111          HD21      ASN 111  22.792 -11.630 -12.921
  805   2HD2  ASN 111          HD22      ASN 111  22.621 -13.020 -13.930
  806    H    SER 112           H        SER 112  21.816  -9.269 -12.892
  807    HA   SER 112           HA       SER 112  19.920 -10.366 -14.729
  808   1HB   SER 112          HB2       SER 112  19.442  -9.097 -12.032
  809   2HB   SER 112          HB3       SER 112  18.305 -10.115 -12.933
  810    HG   SER 112           HG       SER 112  20.819 -10.847 -11.833
  811    H    GLY 113           H        GLY 113  20.525  -7.059 -13.491
  812   1HA   GLY 113          HA2       GLY 113  20.172  -5.705 -15.742
  813   2HA   GLY 113          HA3       GLY 113  18.477  -5.939 -15.324
  814    H    ALA 114           H        ALA 114  19.361  -5.653 -12.276
  815    HA   ALA 114           HA       ALA 114  18.418  -2.964 -12.262
  816   1HB   ALA 114          HB1       ALA 114  19.579  -4.625  -9.983
  817   2HB   ALA 114          HB2       ALA 114  18.777  -3.037  -9.815
  818   3HB   ALA 114          HB3       ALA 114  17.854  -4.418 -10.356
  819    H    LYS 115           H        LYS 115  19.545  -0.988 -11.804
  820    HA   LYS 115           HA       LYS 115  22.463  -1.171 -12.328
  821   1HB   LYS 115          HB2       LYS 115  22.430   1.275 -12.433
  822   2HB   LYS 115          HB3       LYS 115  21.379   0.516 -13.625
  823   1HG   LYS 115          HG2       LYS 115  19.390   1.073 -12.258
  824   2HG   LYS 115          HG3       LYS 115  20.441   1.768 -11.014
  825   1HD   LYS 115          HD2       LYS 115  19.490   3.554 -12.300
  826   2HD   LYS 115          HD3       LYS 115  21.228   3.480 -12.621
  827   1HE   LYS 115          HE2       LYS 115  20.778   2.271 -14.753
  828   2HE   LYS 115          HE3       LYS 115  19.044   2.305 -14.411
  829   1HZ   LYS 115          HZ1       LYS 115  20.742   4.696 -14.847
  830   2HZ   LYS 115          HZ2       LYS 115  19.691   4.071 -15.921
  831   3HZ   LYS 115          HZ3       LYS 115  19.136   4.728 -14.540
  832    H    GLN 116           H        GLN 116  23.932  -0.898 -10.681
  833    HA   GLN 116           HA       GLN 116  22.881  -0.686  -7.935
  834   1HB   GLN 116          HB2       GLN 116  24.743  -2.274  -8.514
  835   2HB   GLN 116          HB3       GLN 116  25.765  -0.876  -8.836
  836   1HG   GLN 116          HG2       GLN 116  25.530  -0.089  -6.541
  837   2HG   GLN 116          HG3       GLN 116  24.262  -1.275  -6.216
  838   1HE2  GLN 116          HE22      GLN 116  25.972  -1.416  -4.355
  839   2HE2  GLN 116          HE21      GLN 116  27.028  -2.806  -4.509
  840    H    THR 117           H        THR 117  22.163   1.410  -7.601
  841    HA   THR 117           HA       THR 117  23.630   3.666  -8.821
  842    HB   THR 117           HB       THR 117  21.262   3.616  -6.892
  843    HG1  THR 117           HG1      THR 117  21.000   2.840  -9.075
  844   1HG2  THR 117          HG21      THR 117  22.684   5.877  -8.376
  845   2HG2  THR 117          HG22      THR 117  21.093   6.044  -7.635
  846   3HG2  THR 117          HG23      THR 117  22.487   5.716  -6.609
  847    H    GLY 118           H        GLY 118  25.010   5.074  -7.669
  848   1HA   GLY 118          HA2       GLY 118  26.521   5.716  -6.070
  849   2HA   GLY 118          HA3       GLY 118  25.481   4.961  -4.853
  850    H    GLU 119           H        GLU 119  26.457   3.368  -3.778
  851    HA   GLU 119           HA       GLU 119  27.945   1.258  -5.051
  852   1HB   GLU 119          HB2       GLU 119  30.050   1.519  -3.939
  853   2HB   GLU 119          HB3       GLU 119  29.716   3.021  -4.790
  854   1HG   GLU 119          HG2       GLU 119  28.903   4.006  -2.606
  855   2HG   GLU 119          HG3       GLU 119  29.469   2.528  -1.816
  856    H    THR 120           H        THR 120  28.755  -0.276  -3.112
  857    HA   THR 120           HA       THR 120  26.604  -1.185  -1.658
  858    HB   THR 120           HB       THR 120  29.463  -1.405  -0.687
  859    HG1  THR 120           HG1      THR 120  28.530  -3.008  -2.807
  860   1HG2  THR 120          HG21      THR 120  27.165  -3.395  -0.879
  861   2HG2  THR 120          HG22      THR 120  28.815  -3.784  -0.351
  862   3HG2  THR 120          HG23      THR 120  27.825  -2.656   0.596
  863    H    LEU 121           H        LEU 121  25.547  -0.473   0.100
  864    HA   LEU 121           HA       LEU 121  26.470   1.928   1.522
  865   1HB   LEU 121          HB2       LEU 121  24.100   1.348   0.598
  866   2HB   LEU 121          HB3       LEU 121  23.948   0.318   2.006
  867    HG   LEU 121           HG       LEU 121  24.794   3.126   2.527
  868   1HD1  LEU 121          HD11      LEU 121  23.097   3.423   0.737
  869   2HD1  LEU 121          HD12      LEU 121  21.938   2.474   1.690
  870   3HD1  LEU 121          HD13      LEU 121  22.540   4.036   2.294
  871   1HD2  LEU 121          HD21      LEU 121  23.318   3.006   4.428
  872   2HD2  LEU 121          HD22      LEU 121  22.611   1.489   3.852
  873   3HD2  LEU 121          HD23      LEU 121  24.292   1.536   4.405
  874    H    LYS 122           H        LYS 122  26.625   1.885   3.921
  875    HA   LYS 122           HA       LYS 122  27.462  -0.792   4.949
  876   1HB   LYS 122          HB2       LYS 122  28.827   1.910   5.237
  877   2HB   LYS 122          HB3       LYS 122  29.336   0.459   6.077
  878   1HG   LYS 122          HG2       LYS 122  30.120  -0.565   4.086
  879   2HG   LYS 122          HG3       LYS 122  29.234   0.536   3.027
  880   1HD   LYS 122          HD2       LYS 122  30.622   2.437   3.730
  881   2HD   LYS 122          HD3       LYS 122  31.524   1.381   4.832
  882   1HE   LYS 122          HE2       LYS 122  32.183  -0.030   2.872
  883   2HE   LYS 122          HE3       LYS 122  31.380   1.129   1.798
  884   1HZ   LYS 122          HZ1       LYS 122  33.702   1.703   3.561
  885   2HZ   LYS 122          HZ2       LYS 122  33.743   1.580   1.937
  886   3HZ   LYS 122          HZ3       LYS 122  32.951   2.822   2.633
  887    H    ILE 123           H        ILE 123  26.977  -1.118   7.113
  888    HA   ILE 123           HA       ILE 123  25.914   1.046   8.768
  889    HB   ILE 123           HB       ILE 123  23.929  -0.090   9.435
  890   1HG1  ILE 123          HG12      ILE 123  24.326  -2.413   9.293
  891   2HG1  ILE 123          HG13      ILE 123  22.939  -2.037   8.291
  892   1HG2  ILE 123          HG21      ILE 123  23.788   0.054   6.416
  893   2HG2  ILE 123          HG22      ILE 123  22.479   0.223   7.607
  894   3HG2  ILE 123          HG23      ILE 123  23.744   1.442   7.525
  895   1HD1  ILE 123          HD11      ILE 123  24.528  -2.139   6.273
  896   2HD1  ILE 123          HD12      ILE 123  25.713  -2.848   7.390
  897   3HD1  ILE 123          HD13      ILE 123  24.169  -3.661   7.114
  898    H    ASN 124           H        ASN 124  25.755   0.334  11.054
  899    HA   ASN 124           HA       ASN 124  26.376  -2.251  11.919
  900   1HB   ASN 124          HB2       ASN 124  28.730  -0.666  11.445
  901   2HB   ASN 124          HB3       ASN 124  28.484  -0.674  13.177
  902   1HD2  ASN 124          HD22      ASN 124  28.366  -2.823  10.334
  903   2HD2  ASN 124          HD21      ASN 124  29.016  -4.266  11.099
  904    H    ILE 125           H        ILE 125  26.731  -2.038  14.503
  905    HA   ILE 125           HA       ILE 125  25.606   0.339  15.681
  906    HB   ILE 125           HB       ILE 125  23.541  -0.694  14.925
  907   1HG1  ILE 125          HG12      ILE 125  23.792  -1.108  17.926
  908   2HG1  ILE 125          HG13      ILE 125  23.676   0.468  17.135
  909   1HG2  ILE 125          HG21      ILE 125  24.227  -3.200  16.513
  910   2HG2  ILE 125          HG22      ILE 125  22.752  -2.892  15.573
  911   3HG2  ILE 125          HG23      ILE 125  24.287  -3.070  14.743
  912   1HD1  ILE 125          HD11      ILE 125  21.551  -1.709  17.114
  913   2HD1  ILE 125          HD12      ILE 125  21.496  -0.152  17.950
  914   3HD1  ILE 125          HD13      ILE 125  21.463  -0.199  16.176
  915    H    LEU 126           H        LEU 126  26.118   0.403  17.865
  916    HA   LEU 126           HA       LEU 126  27.198   0.119  19.747
  917   1HB   LEU 126          HB2       LEU 126  25.618  -1.763  19.976
  918   2HB   LEU 126          HB3       LEU 126  26.823  -2.855  19.298
  919    HG   LEU 126           HG       LEU 126  28.304  -2.488  21.234
  920   1HD1  LEU 126          HD11      LEU 126  27.713  -0.193  21.905
  921   2HD1  LEU 126          HD12      LEU 126  26.055  -0.707  22.292
  922   3HD1  LEU 126          HD13      LEU 126  27.432  -1.296  23.250
  923   1HD2  LEU 126          HD21      LEU 126  25.453  -3.210  22.016
  924   2HD2  LEU 126          HD22      LEU 126  26.641  -4.298  21.268
  925   3HD2  LEU 126          HD23      LEU 126  26.933  -3.660  22.892
  926    H    ASP 127           H        ASP 127  28.614  -1.425  16.998
  927    HA   ASP 127           HA       ASP 127  31.351  -0.849  17.883
  928   1HB   ASP 127          HB2       ASP 127  30.721  -3.218  18.619
  929   2HB   ASP 127          HB3       ASP 127  30.476  -3.611  16.919
  930    H    HIS 128           H        HIS 128  32.618  -1.919  15.633
  931    HA   HIS 128           HA       HIS 128  31.031  -1.173  13.223
  932   1HB   HIS 128          HB2       HIS 128  33.959  -0.511  13.728
  933   2HB   HIS 128          HB3       HIS 128  33.116  -0.331  12.194
  934    HD1  HIS 128           HD1      HIS 128  30.677   0.940  14.568
  935    HD2  HIS 128           HD2      HIS 128  34.326   2.266  12.939
  936    HE1  HIS 128           HE1      HIS 128  30.721   3.477  14.870
  937    H    ASP 129           H        ASP 129  31.810  -2.436  11.300
  938    HA   ASP 129           HA       ASP 129  33.440  -4.755  11.777
  939   1HB   ASP 129          HB2       ASP 129  31.985  -6.214  12.411
  940   2HB   ASP 129          HB3       ASP 129  30.714  -4.991  12.518
  941    H    ILE 130           H        ILE 130  32.715  -6.297   9.664
  942    HA   ILE 130           HA       ILE 130  34.388  -5.463   7.755
  943    HB   ILE 130           HB       ILE 130  31.895  -7.152   7.492
  944   1HG1  ILE 130          HG12      ILE 130  33.588  -8.114   8.932
  945   2HG1  ILE 130          HG13      ILE 130  33.478  -9.028   7.439
  946   1HG2  ILE 130          HG21      ILE 130  33.985  -6.721   5.345
  947   2HG2  ILE 130          HG22      ILE 130  32.825  -8.062   5.367
  948   3HG2  ILE 130          HG23      ILE 130  32.236  -6.408   5.237
  949   1HD1  ILE 130          HD11      ILE 130  35.560  -7.855   6.616
  950   2HD1  ILE 130          HD12      ILE 130  35.705  -7.111   8.227
  951   3HD1  ILE 130          HD13      ILE 130  35.785  -8.867   8.052
  952    HA   PRO 131           HA       PRO 131  31.362  -3.284   4.760
  953   1HB   PRO 131          HB2       PRO 131  29.202  -1.926   5.857
  954   2HB   PRO 131          HB3       PRO 131  29.127  -3.553   5.122
  955   1HG   PRO 131          HG2       PRO 131  29.447  -2.831   8.058
  956   2HG   PRO 131          HG3       PRO 131  28.301  -3.985   7.336
  957   1HD   PRO 131          HD2       PRO 131  30.567  -4.867   8.406
  958   2HD   PRO 131          HD3       PRO 131  30.062  -5.536   6.831
  959    H    GLU 132           H        GLU 132  31.102  -1.931   7.980
  960    HA   GLU 132           HA       GLU 132  33.050  -0.755   8.813
  961   1HB   GLU 132          HB2       GLU 132  33.763   0.378   6.759
  962   2HB   GLU 132          HB3       GLU 132  32.346   1.448   6.860
  963   1HG   GLU 132          HG2       GLU 132  33.167   2.332   9.005
  964   2HG   GLU 132          HG3       GLU 132  34.456   1.132   9.038
  965    H    ASP 133           H        ASP 133  30.861   1.917   8.140
  966    HA   ASP 133           HA       ASP 133  28.795   1.167   9.970
  967   1HB   ASP 133          HB2       ASP 133  30.377   1.472  11.715
  968   2HB   ASP 133          HB3       ASP 133  30.966   2.986  11.050
  969    HA   PRO 134           HA       PRO 134  28.344   5.888   8.830
  970   1HB   PRO 134          HB2       PRO 134  29.934   5.890   6.257
  971   2HB   PRO 134          HB3       PRO 134  29.613   7.244   7.385
  972   1HG   PRO 134          HG2       PRO 134  31.990   5.963   7.456
  973   2HG   PRO 134          HG3       PRO 134  31.150   6.359   8.992
  974   1HD   PRO 134          HD2       PRO 134  31.217   3.723   7.511
  975   2HD   PRO 134          HD3       PRO 134  31.426   4.045   9.256
  976    H    ALA 135           H        ALA 135  26.351   6.246   7.942
  977    HA   ALA 135           HA       ALA 135  25.470   4.541   5.646
  978   1HB   ALA 135          HB1       ALA 135  23.982   4.966   8.276
  979   2HB   ALA 135          HB2       ALA 135  23.474   3.959   6.904
  980   3HB   ALA 135          HB3       ALA 135  24.906   3.513   7.855
  981    H    GLU 136           H        GLU 136  24.668   7.427   7.704
  982    HA   GLU 136           HA       GLU 136  22.386   8.136   6.197
  983   1HB   GLU 136          HB2       GLU 136  22.848   8.901   8.493
  984   2HB   GLU 136          HB3       GLU 136  24.190   9.898   7.908
  985   1HG   GLU 136          HG2       GLU 136  22.641  11.278   6.597
  986   2HG   GLU 136          HG3       GLU 136  21.297  10.199   6.987
  987    H    GLU 137           H        GLU 137  25.820   8.990   5.769
  988    HA   GLU 137           HA       GLU 137  25.470  11.018   3.782
  989   1HB   GLU 137          HB2       GLU 137  27.790   9.060   4.199
  990   2HB   GLU 137          HB3       GLU 137  27.822  10.520   3.225
  991   1HG   GLU 137          HG2       GLU 137  28.908  11.094   5.212
  992   2HG   GLU 137          HG3       GLU 137  27.331  11.872   5.286
  993    H    TRP 138           H        TRP 138  25.831   7.451   3.559
  994    HA   TRP 138           HA       TRP 138  25.866   7.353   0.692
  995   1HB   TRP 138          HB2       TRP 138  25.514   5.371   2.927
  996   2HB   TRP 138          HB3       TRP 138  24.893   4.965   1.337
  997    HD1  TRP 138           HD1      TRP 138  26.355   3.771  -0.218
  998    HE1  TRP 138           HE1      TRP 138  28.801   3.155  -0.362
  999    HE3  TRP 138           HE3      TRP 138  28.137   6.711   3.592
 1000    HZ2  TRP 138           HZ2      TRP 138  31.309   4.036   0.836
 1001    HZ3  TRP 138           HZ3      TRP 138  30.570   6.826   4.039
 1002    HH2  TRP 138           HH2      TRP 138  32.166   5.504   2.671
 1003    H    LEU 139           H        LEU 139  23.247   6.837   3.160
 1004    HA   LEU 139           HA       LEU 139  21.134   6.289   1.365
 1005   1HB   LEU 139          HB2       LEU 139  21.285   7.637   4.100
 1006   2HB   LEU 139          HB3       LEU 139  19.767   7.412   3.270
 1007    HG   LEU 139           HG       LEU 139  21.599   5.128   4.093
 1008   1HD1  LEU 139          HD11      LEU 139  19.919   4.745   5.874
 1009   2HD1  LEU 139          HD12      LEU 139  20.688   6.326   6.040
 1010   3HD1  LEU 139          HD13      LEU 139  19.045   6.204   5.369
 1011   1HD2  LEU 139          HD21      LEU 139  19.626   3.699   3.661
 1012   2HD2  LEU 139          HD22      LEU 139  18.709   5.109   3.095
 1013   3HD2  LEU 139          HD23      LEU 139  20.113   4.524   2.181
 1014    H    GLY 140           H        GLY 140  22.203   9.430   2.772
 1015   1HA   GLY 140          HA2       GLY 140  20.344  11.094   1.514
 1016   2HA   GLY 140          HA3       GLY 140  21.973  11.567   2.042
 1017    H    SER 141           H        SER 141  23.704  10.246   0.374
 1018    HA   SER 141           HA       SER 141  23.494  11.799  -1.976
 1019   1HB   SER 141          HB2       SER 141  25.578  10.918  -0.846
 1020   2HB   SER 141          HB3       SER 141  25.223   9.322  -1.530
 1021    HG   SER 141           HG       SER 141  26.693  10.575  -2.793
 1022    H    TRP 142           H        TRP 142  22.884   8.281  -1.440
 1023    HA   TRP 142           HA       TRP 142  22.326   7.579  -4.128
 1024   1HB   TRP 142          HB2       TRP 142  22.933   6.010  -2.386
 1025   2HB   TRP 142          HB3       TRP 142  21.513   6.443  -1.453
 1026    HD1  TRP 142           HD1      TRP 142  22.501   4.426  -4.554
 1027    HE1  TRP 142           HE1      TRP 142  20.700   2.657  -4.997
 1028    HE3  TRP 142           HE3      TRP 142  19.222   5.769  -0.909
 1029    HZ2  TRP 142           HZ2      TRP 142  17.985   2.116  -4.092
 1030    HZ3  TRP 142           HZ3      TRP 142  17.035   4.582  -0.691
 1031    HH2  TRP 142           HH2      TRP 142  16.404   2.790  -2.284
 1032    H    VAL 143           H        VAL 143  20.187   8.778  -1.516
 1033    HA   VAL 143           HA       VAL 143  17.754   8.773  -3.029
 1034    HB   VAL 143           HB       VAL 143  18.748  10.132  -0.510
 1035   1HG1  VAL 143          HG11      VAL 143  16.433  10.998  -0.143
 1036   2HG1  VAL 143          HG12      VAL 143  17.352  11.848  -1.381
 1037   3HG1  VAL 143          HG13      VAL 143  16.101  10.674  -1.866
 1038   1HG2  VAL 143          HG21      VAL 143  18.075   7.738  -0.436
 1039   2HG2  VAL 143          HG22      VAL 143  16.992   8.746   0.521
 1040   3HG2  VAL 143          HG23      VAL 143  16.483   8.161  -1.082
 1041    H    ASN 144           H        ASN 144  20.247  11.358  -2.485
 1042    HA   ASN 144           HA       ASN 144  18.898  13.359  -3.931
 1043   1HB   ASN 144          HB2       ASN 144  21.896  12.933  -3.628
 1044   2HB   ASN 144          HB3       ASN 144  21.159  14.395  -4.260
 1045   1HD2  ASN 144          HD22      ASN 144  22.868  14.055  -1.855
 1046   2HD2  ASN 144          HD21      ASN 144  21.915  14.574  -0.497
 1047    H    LEU 145           H        LEU 145  20.661  10.583  -5.082
 1048    HA   LEU 145           HA       LEU 145  20.944  11.586  -7.814
 1049   1HB   LEU 145          HB2       LEU 145  21.710   9.106  -6.320
 1050   2HB   LEU 145          HB3       LEU 145  21.274   8.854  -8.003
 1051    HG   LEU 145           HG       LEU 145  22.911  10.531  -8.742
 1052   1HD1  LEU 145          HD11      LEU 145  23.834  10.629  -5.839
 1053   2HD1  LEU 145          HD12      LEU 145  24.640  11.388  -7.225
 1054   3HD1  LEU 145          HD13      LEU 145  23.050  11.961  -6.712
 1055   1HD2  LEU 145          HD21      LEU 145  24.053   8.336  -6.960
 1056   2HD2  LEU 145          HD22      LEU 145  23.527   8.162  -8.650
 1057   3HD2  LEU 145          HD23      LEU 145  24.924   9.173  -8.266
 1058    H    LEU 146           H        LEU 146  18.467   9.815  -6.025
 1059    HA   LEU 146           HA       LEU 146  17.104   8.969  -8.483
 1060   1HB   LEU 146          HB2       LEU 146  16.042   7.542  -7.215
 1061   2HB   LEU 146          HB3       LEU 146  17.412   7.763  -6.171
 1062    HG   LEU 146           HG       LEU 146  15.854   9.349  -4.803
 1063   1HD1  LEU 146          HD11      LEU 146  13.820   7.721  -6.402
 1064   2HD1  LEU 146          HD12      LEU 146  13.469   8.575  -4.892
 1065   3HD1  LEU 146          HD13      LEU 146  13.920   9.492  -6.325
 1066   1HD2  LEU 146          HD21      LEU 146  15.123   7.375  -3.536
 1067   2HD2  LEU 146          HD22      LEU 146  15.406   6.334  -4.954
 1068   3HD2  LEU 146          HD23      LEU 146  16.769   7.110  -4.145
 1069    H    LYS 147           H        LYS 147  16.844  11.301  -5.930
 1070    HA   LYS 147           HA       LYS 147  14.357  12.527  -6.543
 1071   1HB   LYS 147          HB2       LYS 147  16.921  13.408  -5.173
 1072   2HB   LYS 147          HB3       LYS 147  15.617  14.565  -5.485
 1073   1HG   LYS 147          HG2       LYS 147  14.003  13.055  -4.309
 1074   2HG   LYS 147          HG3       LYS 147  15.347  11.979  -3.897
 1075   1HD   LYS 147          HD2       LYS 147  16.401  13.779  -2.582
 1076   2HD   LYS 147          HD3       LYS 147  15.115  14.908  -3.056
 1077   1HE   LYS 147          HE2       LYS 147  13.462  13.468  -1.963
 1078   2HE   LYS 147          HE3       LYS 147  14.703  12.302  -1.517
 1079   1HZ   LYS 147          HZ1       LYS 147  14.249  13.654   0.349
 1080   2HZ   LYS 147          HZ2       LYS 147  15.730  14.106  -0.170
 1081   3HZ   LYS 147          HZ3       LYS 147  14.435  15.059  -0.481
  Start of MODEL    3
    1   1H    MET   1          H1        MET   1   2.160  -1.445   2.198
    2   2H    MET   1          H2        MET   1   1.524  -2.567   1.172
    3   3H    MET   1          H3        MET   1   3.152  -2.509   1.451
    4    HA   MET   1           HA       MET   1   2.620  -1.601  -0.691
    5   1HB   MET   1          HB2       MET   1   0.392  -0.705  -0.165
    6   2HB   MET   1          HB3       MET   1   1.099   0.486   0.937
    7   1HG   MET   1          HG2       MET   1   0.527   1.454  -1.258
    8   2HG   MET   1          HG3       MET   1   2.244   1.590  -0.903
    9   1HE   MET   1          HE1       MET   1   2.346   1.304  -4.767
   10   2HE   MET   1          HE2       MET   1   1.197   2.201  -3.749
   11   3HE   MET   1          HE3       MET   1   2.927   2.174  -3.330
   12    H    ALA   2           H        ALA   2   4.461  -0.639  -1.433
   13    HA   ALA   2           HA       ALA   2   5.964   1.254   0.226
   14   1HB   ALA   2          HB1       ALA   2   6.976  -1.530  -0.540
   15   2HB   ALA   2          HB2       ALA   2   7.985  -0.232   0.112
   16   3HB   ALA   2          HB3       ALA   2   6.696  -0.937   1.108
   17    H    ASP   3           H        ASP   3   7.776   2.123  -0.960
   18    HA   ASP   3           HA       ASP   3   7.549   2.060  -3.909
   19   1HB   ASP   3          HB2       ASP   3   7.611   4.268  -2.630
   20   2HB   ASP   3          HB3       ASP   3   9.208   3.829  -2.065
   21    H    ILE   4           H        ILE   4   9.500   1.054  -1.171
   22    HA   ILE   4           HA       ILE   4  11.565  -0.074  -2.987
   23    HB   ILE   4           HB       ILE   4  12.134   1.154  -0.275
   24   1HG1  ILE   4          HG12      ILE   4  12.561   2.558  -2.941
   25   2HG1  ILE   4          HG13      ILE   4  11.373   3.015  -1.715
   26   1HG2  ILE   4          HG21      ILE   4  14.462   1.007  -0.995
   27   2HG2  ILE   4          HG22      ILE   4  13.721  -0.562  -1.221
   28   3HG2  ILE   4          HG23      ILE   4  13.972   0.488  -2.623
   29   1HD1  ILE   4          HD11      ILE   4  13.217   4.506  -1.535
   30   2HD1  ILE   4          HD12      ILE   4  13.217   3.460  -0.101
   31   3HD1  ILE   4          HD13      ILE   4  14.382   3.185  -1.421
   32    H    THR   5           H        THR   5  11.925  -2.205  -2.590
   33    HA   THR   5           HA       THR   5  10.828  -3.473  -0.152
   34    HB   THR   5           HB       THR   5  10.366  -4.566  -2.286
   35    HG1  THR   5           HG1      THR   5  10.629  -5.951  -0.608
   36   1HG2  THR   5          HG21      THR   5  12.051  -5.607  -3.678
   37   2HG2  THR   5          HG22      THR   5  12.174  -3.848  -3.701
   38   3HG2  THR   5          HG23      THR   5  13.340  -4.804  -2.761
   39    H    LEU   6           H        LEU   6  12.178  -3.837   1.587
   40    HA   LEU   6           HA       LEU   6  15.109  -3.268   1.312
   41   1HB   LEU   6          HB2       LEU   6  13.102  -2.993   3.543
   42   2HB   LEU   6          HB3       LEU   6  14.767  -3.302   3.947
   43    HG   LEU   6           HG       LEU   6  13.975  -0.923   4.038
   44   1HD1  LEU   6          HD11      LEU   6  16.075   0.034   3.177
   45   2HD1  LEU   6          HD12      LEU   6  16.343  -1.449   4.097
   46   3HD1  LEU   6          HD13      LEU   6  16.417  -1.486   2.324
   47   1HD2  LEU   6          HD21      LEU   6  13.864   0.441   2.051
   48   2HD2  LEU   6          HD22      LEU   6  14.278  -0.941   1.018
   49   3HD2  LEU   6          HD23      LEU   6  12.723  -0.906   1.864
   50    H    ILE   7           H        ILE   7  15.817  -5.183   0.686
   51    HA   ILE   7           HA       ILE   7  14.629  -7.680   1.716
   52    HB   ILE   7           HB       ILE   7  16.619  -7.277  -0.556
   53   1HG1  ILE   7          HG12      ILE   7  13.589  -7.583  -0.749
   54   2HG1  ILE   7          HG13      ILE   7  14.480  -6.088  -1.037
   55   1HG2  ILE   7          HG21      ILE   7  16.039  -9.553  -1.206
   56   2HG2  ILE   7          HG22      ILE   7  16.494  -9.594   0.485
   57   3HG2  ILE   7          HG23      ILE   7  14.777  -9.637   0.040
   58   1HD1  ILE   7          HD11      ILE   7  14.693  -8.614  -2.715
   59   2HD1  ILE   7          HD12      ILE   7  13.942  -7.087  -3.164
   60   3HD1  ILE   7          HD13      ILE   7  15.697  -7.157  -2.921
   61    H    SER   8           H        SER   8  15.561  -7.838   3.840
   62    HA   SER   8           HA       SER   8  18.500  -7.940   4.065
   63   1HB   SER   8          HB2       SER   8  16.263  -8.743   5.954
   64   2HB   SER   8          HB3       SER   8  17.995  -8.818   6.329
   65    HG   SER   8           HG       SER   8  17.058  -6.967   7.131
   66    H    GLY   9           H        GLY   9  19.668  -9.929   3.909
   67   1HA   GLY   9          HA2       GLY   9  18.150 -12.456   3.745
   68   2HA   GLY   9          HA3       GLY   9  18.828 -11.862   2.225
   69    H    SER  10           H        SER  10  21.059 -11.047   4.713
   70    HA   SER  10           HA       SER  10  22.998 -12.895   3.827
   71   1HB   SER  10          HB2       SER  10  23.965 -12.198   6.219
   72   2HB   SER  10          HB3       SER  10  23.995 -11.140   4.810
   73    HG   SER  10           HG       SER  10  23.181 -10.179   6.806
   74    H    THR  11           H        THR  11  23.079 -15.000   4.117
   75    HA   THR  11           HA       THR  11  22.404 -17.056   4.632
   76    HB   THR  11           HB       THR  11  23.096 -16.296   7.476
   77    HG1  THR  11           HG1      THR  11  24.658 -16.247   5.148
   78   1HG2  THR  11          HG21      THR  11  22.619 -18.692   7.093
   79   2HG2  THR  11          HG22      THR  11  23.757 -18.719   5.735
   80   3HG2  THR  11          HG23      THR  11  24.343 -18.450   7.394
   81    H    LEU  12           H        LEU  12  20.170 -15.478   4.336
   82    HA   LEU  12           HA       LEU  12  18.026 -15.167   4.772
   83   1HB   LEU  12          HB2       LEU  12  17.974 -17.484   4.080
   84   2HB   LEU  12          HB3       LEU  12  18.107 -18.028   5.753
   85    HG   LEU  12           HG       LEU  12  15.895 -16.947   6.257
   86   1HD1  LEU  12          HD11      LEU  12  15.807 -15.166   4.577
   87   2HD1  LEU  12          HD12      LEU  12  15.815 -16.369   3.264
   88   3HD1  LEU  12          HD13      LEU  12  14.437 -16.249   4.373
   89   1HD2  LEU  12          HD21      LEU  12  14.520 -18.585   5.070
   90   2HD2  LEU  12          HD22      LEU  12  15.843 -18.903   3.929
   91   3HD2  LEU  12          HD23      LEU  12  16.024 -19.319   5.643
   92    H    GLY  13           H        GLY  13  18.828 -13.608   6.254
   93   1HA   GLY  13          HA2       GLY  13  17.604 -13.899   8.937
   94   2HA   GLY  13          HA3       GLY  13  19.260 -13.276   8.798
   95    H    GLY  14           H        GLY  14  17.187 -11.741   9.881
   96   1HA   GLY  14          HA2       GLY  14  16.254  -9.923   7.719
   97   2HA   GLY  14          HA3       GLY  14  15.487 -10.218   9.266
   98    H    ALA  15           H        ALA  15  17.993  -9.927  10.826
   99    HA   ALA  15           HA       ALA  15  18.719  -8.293  12.199
  100   1HB   ALA  15          HB1       ALA  15  20.450  -8.364  10.407
  101   2HB   ALA  15          HB2       ALA  15  19.626  -7.013   9.590
  102   3HB   ALA  15          HB3       ALA  15  20.338  -6.788  11.203
  103    H    GLU  16           H        GLU  16  16.015  -8.066  11.845
  104    HA   GLU  16           HA       GLU  16  14.911  -5.883  10.712
  105   1HB   GLU  16          HB2       GLU  16  14.071  -7.387  13.219
  106   2HB   GLU  16          HB3       GLU  16  13.123  -6.077  12.540
  107   1HG   GLU  16          HG2       GLU  16  12.110  -7.916  11.634
  108   2HG   GLU  16          HG3       GLU  16  13.101  -7.305  10.318
  109    H    TYR  17           H        TYR  17  16.579  -5.759  13.880
  110    HA   TYR  17           HA       TYR  17  15.533  -3.267  14.724
  111   1HB   TYR  17          HB2       TYR  17  16.795  -4.743  16.195
  112   2HB   TYR  17          HB3       TYR  17  18.243  -4.557  15.212
  113    HD1  TYR  17           HD1      TYR  17  19.855  -2.980  15.894
  114    HD2  TYR  17           HD2      TYR  17  15.753  -2.464  17.136
  115    HE1  TYR  17           HE1      TYR  17  20.520  -1.026  17.264
  116    HE2  TYR  17           HE2      TYR  17  16.405  -0.511  18.504
  117    HH   TYR  17           HH       TYR  17  18.154   0.865  19.203
  118    H    VAL  18           H        VAL  18  18.524  -3.922  12.756
  119    HA   VAL  18           HA       VAL  18  18.919  -1.042  12.456
  120    HB   VAL  18           HB       VAL  18  20.757  -2.574  12.886
  121   1HG1  VAL  18          HG11      VAL  18  20.162  -4.534  11.585
  122   2HG1  VAL  18          HG12      VAL  18  20.401  -3.641  10.065
  123   3HG1  VAL  18          HG13      VAL  18  21.769  -3.959  11.156
  124   1HG2  VAL  18          HG21      VAL  18  22.368  -1.574  11.381
  125   2HG2  VAL  18          HG22      VAL  18  21.077  -1.120  10.240
  126   3HG2  VAL  18          HG23      VAL  18  21.156  -0.372  11.850
  127    H    ALA  19           H        ALA  19  17.528  -3.720  10.575
  128    HA   ALA  19           HA       ALA  19  17.348  -2.306   8.094
  129   1HB   ALA  19          HB1       ALA  19  16.999  -4.770   8.387
  130   2HB   ALA  19          HB2       ALA  19  15.444  -4.415   9.178
  131   3HB   ALA  19          HB3       ALA  19  15.706  -3.966   7.482
  132    H    GLU  20           H        GLU  20  15.179  -2.387  10.988
  133    HA   GLU  20           HA       GLU  20  13.193  -0.667   9.825
  134   1HB   GLU  20          HB2       GLU  20  12.812  -2.230  11.722
  135   2HB   GLU  20          HB3       GLU  20  13.810  -1.188  12.756
  136   1HG   GLU  20          HG2       GLU  20  12.215   0.686  12.331
  137   2HG   GLU  20          HG3       GLU  20  11.255  -0.370  11.296
  138    H    HIS  21           H        HIS  21  16.142  -0.067  11.824
  139    HA   HIS  21           HA       HIS  21  15.764   2.718  12.167
  140   1HB   HIS  21          HB2       HIS  21  17.483   1.412  13.350
  141   2HB   HIS  21          HB3       HIS  21  18.349   1.141  11.836
  142    HD1  HIS  21           HD1      HIS  21  20.043   3.035  11.110
  143    HD2  HIS  21           HD2      HIS  21  17.406   4.074  14.225
  144    HE1  HIS  21           HE1      HIS  21  20.818   5.297  11.978
  145    H    LEU  22           H        LEU  22  17.317   0.906   9.476
  146    HA   LEU  22           HA       LEU  22  17.920   3.138   7.798
  147   1HB   LEU  22          HB2       LEU  22  17.298   0.206   7.339
  148   2HB   LEU  22          HB3       LEU  22  17.449   1.273   5.964
  149    HG   LEU  22           HG       LEU  22  19.632   1.081   8.075
  150   1HD1  LEU  22          HD11      LEU  22  19.180  -1.182   7.217
  151   2HD1  LEU  22          HD12      LEU  22  19.334  -0.597   5.545
  152   3HD1  LEU  22          HD13      LEU  22  20.730  -0.582   6.652
  153   1HD2  LEU  22          HD21      LEU  22  21.058   1.859   6.170
  154   2HD2  LEU  22          HD22      LEU  22  19.617   1.958   5.143
  155   3HD2  LEU  22          HD23      LEU  22  19.786   3.021   6.553
  156    H    ALA  23           H        ALA  23  15.063   0.951   7.776
  157    HA   ALA  23           HA       ALA  23  13.633   2.174   5.762
  158   1HB   ALA  23          HB1       ALA  23  13.026   0.024   6.764
  159   2HB   ALA  23          HB2       ALA  23  12.533   0.844   8.268
  160   3HB   ALA  23          HB3       ALA  23  11.637   1.129   6.776
  161    H    GLU  24           H        GLU  24  13.608   3.103   9.246
  162    HA   GLU  24           HA       GLU  24  11.598   5.039   9.184
  163   1HB   GLU  24          HB2       GLU  24  13.008   4.178  11.150
  164   2HB   GLU  24          HB3       GLU  24  14.238   5.334  10.696
  165   1HG   GLU  24          HG2       GLU  24  12.625   7.172  10.960
  166   2HG   GLU  24          HG3       GLU  24  11.346   6.029  11.370
  167    H    LYS  25           H        LYS  25  15.118   5.536   8.650
  168    HA   LYS  25           HA       LYS  25  14.929   8.246   7.874
  169   1HB   LYS  25          HB2       LYS  25  16.957   6.081   7.149
  170   2HB   LYS  25          HB3       LYS  25  17.179   7.781   6.853
  171   1HG   LYS  25          HG2       LYS  25  16.844   6.405   9.564
  172   2HG   LYS  25          HG3       LYS  25  18.318   7.037   8.915
  173   1HD   LYS  25          HD2       LYS  25  15.926   8.471  10.038
  174   2HD   LYS  25          HD3       LYS  25  17.586   8.557  10.589
  175   1HE   LYS  25          HE2       LYS  25  16.465   9.790   8.026
  176   2HE   LYS  25          HE3       LYS  25  16.817  10.626   9.534
  177   1HZ   LYS  25          HZ1       LYS  25  18.603  10.931   7.972
  178   2HZ   LYS  25          HZ2       LYS  25  19.176  10.071   9.239
  179   3HZ   LYS  25          HZ3       LYS  25  18.849   9.324   7.816
  180    H    LEU  26           H        LEU  26  14.853   5.315   5.823
  181    HA   LEU  26           HA       LEU  26  14.783   6.679   3.310
  182   1HB   LEU  26          HB2       LEU  26  13.609   4.009   4.195
  183   2HB   LEU  26          HB3       LEU  26  13.272   4.681   2.616
  184    HG   LEU  26           HG       LEU  26  14.896   3.066   2.300
  185   1HD1  LEU  26          HD11      LEU  26  16.670   4.246   1.208
  186   2HD1  LEU  26          HD12      LEU  26  15.161   5.142   0.978
  187   3HD1  LEU  26          HD13      LEU  26  16.374   5.717   2.152
  188   1HD2  LEU  26          HD21      LEU  26  16.664   4.399   4.372
  189   2HD2  LEU  26          HD22      LEU  26  15.858   2.814   4.486
  190   3HD2  LEU  26          HD23      LEU  26  17.139   3.064   3.299
  191    H    GLU  27           H        GLU  27  12.044   5.757   5.524
  192    HA   GLU  27           HA       GLU  27  10.118   6.869   3.738
  193   1HB   GLU  27          HB2       GLU  27  10.000   6.075   6.676
  194   2HB   GLU  27          HB3       GLU  27   8.617   6.620   5.722
  195   1HG   GLU  27          HG2       GLU  27   9.212   4.806   4.021
  196   2HG   GLU  27          HG3       GLU  27  10.308   4.151   5.207
  197    H    GLU  28           H        GLU  28  11.908   8.258   6.537
  198    HA   GLU  28           HA       GLU  28  10.573  10.768   6.555
  199   1HB   GLU  28          HB2       GLU  28  13.337   9.804   7.365
  200   2HB   GLU  28          HB3       GLU  28  12.887  11.486   7.510
  201   1HG   GLU  28          HG2       GLU  28  11.336   9.226   8.834
  202   2HG   GLU  28          HG3       GLU  28  12.630  10.133   9.607
  203    H    ALA  29           H        ALA  29  13.094   9.464   4.384
  204    HA   ALA  29           HA       ALA  29  13.750  12.009   3.193
  205   1HB   ALA  29          HB1       ALA  29  14.829  10.680   1.448
  206   2HB   ALA  29          HB2       ALA  29  15.257  10.055   3.054
  207   3HB   ALA  29          HB3       ALA  29  14.063   9.207   2.047
  208    H    GLY  30           H        GLY  30  10.966   9.952   2.922
  209   1HA   GLY  30          HA2       GLY  30   9.120  11.364   2.079
  210   2HA   GLY  30          HA3       GLY  30  10.015  11.527   0.565
  211    H    PHE  31           H        PHE  31  10.552   8.315   1.511
  212    HA   PHE  31           HA       PHE  31   8.545   7.527  -0.530
  213   1HB   PHE  31          HB2       PHE  31  10.699   5.665   0.358
  214   2HB   PHE  31          HB3       PHE  31  10.014   5.928  -1.227
  215    HD1  PHE  31           HD1      PHE  31  12.951   6.245   0.589
  216    HD2  PHE  31           HD2      PHE  31  10.500   8.516  -2.139
  217    HE1  PHE  31           HE1      PHE  31  14.895   7.676   0.035
  218    HE2  PHE  31           HE2      PHE  31  12.442   9.965  -2.669
  219    HZ   PHE  31           HZ       PHE  31  14.639   9.561  -1.569
  220    H    THR  32           H        THR  32   8.316   4.830  -0.066
  221    HA   THR  32           HA       THR  32   7.559   4.437   2.753
  222    HB   THR  32           HB       THR  32   5.709   2.925   1.871
  223    HG1  THR  32           HG1      THR  32   5.827   4.772  -0.295
  224   1HG2  THR  32          HG21      THR  32   5.339   5.947   1.776
  225   2HG2  THR  32          HG22      THR  32   4.045   4.737   1.970
  226   3HG2  THR  32          HG23      THR  32   5.296   4.905   3.217
  227    H    THR  33           H        THR  33   8.046   2.315   3.424
  228    HA   THR  33           HA       THR  33   9.534   0.690   1.402
  229    HB   THR  33           HB       THR  33  11.364   0.483   2.906
  230    HG1  THR  33           HG1      THR  33  10.303   0.822   4.907
  231   1HG2  THR  33          HG21      THR  33  11.249   2.492   1.318
  232   2HG2  THR  33          HG22      THR  33  10.768   3.468   2.717
  233   3HG2  THR  33          HG23      THR  33  12.344   2.631   2.697
  234    H    GLU  34           H        GLU  34   9.712  -1.509   1.730
  235    HA   GLU  34           HA       GLU  34   7.990  -2.694   3.818
  236   1HB   GLU  34          HB2       GLU  34   8.025  -2.934   1.021
  237   2HB   GLU  34          HB3       GLU  34   8.884  -4.352   1.554
  238   1HG   GLU  34          HG2       GLU  34   6.654  -4.872   1.407
  239   2HG   GLU  34          HG3       GLU  34   7.032  -4.854   3.122
  240    H    THR  35           H        THR  35   9.542  -2.662   5.533
  241    HA   THR  35           HA       THR  35  12.187  -3.726   5.252
  242    HB   THR  35           HB       THR  35  10.638  -3.735   7.843
  243    HG1  THR  35           HG1      THR  35  10.836  -1.585   8.029
  244   1HG2  THR  35          HG21      THR  35  13.479  -2.874   7.137
  245   2HG2  THR  35          HG22      THR  35  12.827  -3.241   8.756
  246   3HG2  THR  35          HG23      THR  35  13.048  -4.541   7.558
  247    H    LEU  36           H        LEU  36  12.656  -5.819   4.835
  248    HA   LEU  36           HA       LEU  36  10.891  -7.993   5.886
  249   1HB   LEU  36          HB2       LEU  36  11.738  -7.461   3.001
  250   2HB   LEU  36          HB3       LEU  36  10.959  -8.933   3.541
  251    HG   LEU  36           HG       LEU  36   9.668  -6.197   3.703
  252   1HD1  LEU  36          HD11      LEU  36   8.382  -6.905   1.720
  253   2HD1  LEU  36          HD12      LEU  36  10.117  -6.797   1.385
  254   3HD1  LEU  36          HD13      LEU  36   9.363  -8.390   1.621
  255   1HD2  LEU  36          HD21      LEU  36   8.443  -8.984   3.932
  256   2HD2  LEU  36          HD22      LEU  36   8.679  -7.850   5.278
  257   3HD2  LEU  36          HD23      LEU  36   7.566  -7.438   3.971
  258    H    HIS  37           H        HIS  37  11.836 -10.049   5.927
  259    HA   HIS  37           HA       HIS  37  14.765 -10.240   5.473
  260   1HB   HIS  37          HB2       HIS  37  14.409 -12.515   6.610
  261   2HB   HIS  37          HB3       HIS  37  14.253 -11.065   7.574
  262    HD1  HIS  37           HD1      HIS  37  12.277 -11.027   9.158
  263    HD2  HIS  37           HD2      HIS  37  11.698 -13.405   5.713
  264    HE1  HIS  37           HE1      HIS  37   9.957 -12.078   9.376
  265    H    GLY  38           H        GLY  38  13.316  -9.757   3.245
  266   1HA   GLY  38          HA2       GLY  38  12.383 -10.468   1.274
  267   2HA   GLY  38          HA3       GLY  38  13.859 -11.427   1.248
  268    HA   PRO  39           HA       PRO  39  10.814 -14.632   2.956
  269   1HB   PRO  39          HB2       PRO  39   8.140 -14.110   3.353
  270   2HB   PRO  39          HB3       PRO  39   9.408 -13.785   4.576
  271   1HG   PRO  39          HG2       PRO  39   8.168 -11.848   2.600
  272   2HG   PRO  39          HG3       PRO  39   8.447 -11.615   4.356
  273   1HD   PRO  39          HD2       PRO  39  10.162 -10.654   2.464
  274   2HD   PRO  39          HD3       PRO  39  10.753 -11.282   4.039
  275    H    LEU  40           H        LEU  40   9.683 -12.504   0.373
  276    HA   LEU  40           HA       LEU  40   8.630 -14.806  -1.169
  277   1HB   LEU  40          HB2       LEU  40   8.153 -11.784  -1.239
  278   2HB   LEU  40          HB3       LEU  40   7.569 -12.890  -2.452
  279    HG   LEU  40           HG       LEU  40   6.754 -12.936   0.479
  280   1HD1  LEU  40          HD11      LEU  40   4.590 -12.106  -0.346
  281   2HD1  LEU  40          HD12      LEU  40   5.895 -10.982  -0.747
  282   3HD1  LEU  40          HD13      LEU  40   5.227 -12.046  -2.005
  283   1HD2  LEU  40          HD21      LEU  40   6.590 -15.202  -0.430
  284   2HD2  LEU  40          HD22      LEU  40   4.974 -14.517  -0.276
  285   3HD2  LEU  40          HD23      LEU  40   5.746 -14.598  -1.875
  286    H    LEU  41           H        LEU  41  11.485 -13.483  -0.643
  287    HA   LEU  41           HA       LEU  41  13.332 -12.842  -1.625
  288   1HB   LEU  41          HB2       LEU  41  13.001 -15.023  -2.697
  289   2HB   LEU  41          HB3       LEU  41  12.264 -14.252  -4.091
  290    HG   LEU  41           HG       LEU  41  14.929 -13.118  -3.399
  291   1HD1  LEU  41          HD11      LEU  41  14.675 -16.025  -4.225
  292   2HD1  LEU  41          HD12      LEU  41  16.170 -15.057  -4.283
  293   3HD1  LEU  41          HD13      LEU  41  15.385 -15.398  -2.721
  294   1HD2  LEU  41          HD21      LEU  41  15.341 -13.432  -5.805
  295   2HD2  LEU  41          HD22      LEU  41  13.842 -14.371  -5.962
  296   3HD2  LEU  41          HD23      LEU  41  13.775 -12.642  -5.561
  297    H    GLU  42           H        GLU  42  10.425 -11.648  -2.981
  298    HA   GLU  42           HA       GLU  42  11.521  -9.107  -3.863
  299   1HB   GLU  42          HB2       GLU  42  10.789  -9.492  -6.265
  300   2HB   GLU  42          HB3       GLU  42  12.295 -10.236  -5.776
  301   1HG   GLU  42          HG2       GLU  42  11.213 -12.445  -5.600
  302   2HG   GLU  42          HG3       GLU  42   9.667 -11.748  -6.067
  303    H    ASP  43           H        ASP  43   9.969  -8.632  -2.150
  304    HA   ASP  43           HA       ASP  43   7.172  -9.299  -2.423
  305   1HB   ASP  43          HB2       ASP  43   8.044  -8.593  -0.288
  306   2HB   ASP  43          HB3       ASP  43   8.538  -7.022  -0.951
  307    H    LEU  44           H        LEU  44   9.203  -6.490  -3.453
  308    HA   LEU  44           HA       LEU  44   6.926  -5.554  -5.132
  309   1HB   LEU  44          HB2       LEU  44   9.687  -4.340  -4.854
  310   2HB   LEU  44          HB3       LEU  44   8.397  -3.689  -5.796
  311    HG   LEU  44           HG       LEU  44   8.373  -3.923  -2.767
  312   1HD1  LEU  44          HD11      LEU  44   9.820  -2.128  -3.804
  313   2HD1  LEU  44          HD12      LEU  44   8.377  -1.467  -4.582
  314   3HD1  LEU  44          HD13      LEU  44   8.490  -1.496  -2.810
  315   1HD2  LEU  44          HD21      LEU  44   6.080  -4.211  -3.544
  316   2HD2  LEU  44          HD22      LEU  44   6.266  -2.584  -2.894
  317   3HD2  LEU  44          HD23      LEU  44   6.238  -2.827  -4.654
  318    HA   PRO  45           HA       PRO  45   8.383  -7.997  -8.444
  319   1HB   PRO  45          HB2       PRO  45   7.655  -6.494 -10.686
  320   2HB   PRO  45          HB3       PRO  45   6.560  -7.415  -9.658
  321   1HG   PRO  45          HG2       PRO  45   7.227  -4.458  -9.609
  322   2HG   PRO  45          HG3       PRO  45   5.620  -5.218  -9.446
  323   1HD   PRO  45          HD2       PRO  45   7.112  -4.325  -7.294
  324   2HD   PRO  45          HD3       PRO  45   5.974  -5.707  -7.189
  325    H    ALA  46           H        ALA  46   9.406  -7.692 -10.711
  326    HA   ALA  46           HA       ALA  46  12.110  -6.623 -10.461
  327   1HB   ALA  46          HB1       ALA  46  11.654  -8.757 -11.645
  328   2HB   ALA  46          HB2       ALA  46  10.629  -7.895 -12.821
  329   3HB   ALA  46          HB3       ALA  46  12.368  -7.574 -12.752
  330    H    SER  47           H        SER  47  10.212  -4.564 -10.114
  331    HA   SER  47           HA       SER  47  10.947  -2.618 -12.065
  332   1HB   SER  47          HB2       SER  47   8.016  -3.332 -11.809
  333   2HB   SER  47          HB3       SER  47   8.668  -1.957 -12.715
  334    HG   SER  47           HG       SER  47   9.849  -4.288 -13.436
  335    H    GLY  48           H        GLY  48  11.233  -0.779 -10.780
  336   1HA   GLY  48          HA2       GLY  48   9.967   0.649  -9.024
  337   2HA   GLY  48          HA3       GLY  48  10.044  -0.823  -8.045
  338    H    ILE  49           H        ILE  49  11.424   0.010  -6.476
  339    HA   ILE  49           HA       ILE  49  14.276   0.252  -7.284
  340    HB   ILE  49           HB       ILE  49  12.940   1.619  -4.925
  341   1HG1  ILE  49          HG12      ILE  49  12.111   2.751  -6.921
  342   2HG1  ILE  49          HG13      ILE  49  13.168   3.773  -5.971
  343   1HG2  ILE  49          HG21      ILE  49  15.097   2.894  -4.782
  344   2HG2  ILE  49          HG22      ILE  49  15.284   1.167  -4.487
  345   3HG2  ILE  49          HG23      ILE  49  15.766   1.841  -6.050
  346   1HD1  ILE  49          HD11      ILE  49  13.576   4.058  -8.375
  347   2HD1  ILE  49          HD12      ILE  49  15.014   3.417  -7.564
  348   3HD1  ILE  49          HD13      ILE  49  13.995   2.345  -8.536
  349    H    TRP  50           H        TRP  50  15.621  -1.059  -6.013
  350    HA   TRP  50           HA       TRP  50  14.355  -2.733  -3.872
  351   1HB   TRP  50          HB2       TRP  50  16.270  -3.424  -6.133
  352   2HB   TRP  50          HB3       TRP  50  16.253  -4.343  -4.659
  353    HD1  TRP  50           HD1      TRP  50  12.838  -3.369  -6.123
  354    HE1  TRP  50           HE1      TRP  50  11.729  -5.409  -7.194
  355    HE3  TRP  50           HE3      TRP  50  16.726  -6.681  -5.734
  356    HZ2  TRP  50           HZ2      TRP  50  12.399  -8.164  -7.704
  357    HZ3  TRP  50           HZ3      TRP  50  16.454  -9.015  -6.522
  358    HH2  TRP  50           HH2      TRP  50  14.298  -9.770  -7.503
  359    H    LEU  51           H        LEU  51  15.721  -3.098  -2.057
  360    HA   LEU  51           HA       LEU  51  18.486  -2.029  -2.139
  361   1HB   LEU  51          HB2       LEU  51  16.385  -1.448  -0.015
  362   2HB   LEU  51          HB3       LEU  51  18.113  -1.333   0.298
  363    HG   LEU  51           HG       LEU  51  16.574   0.364  -1.715
  364   1HD1  LEU  51          HD11      LEU  51  16.098   0.887   0.679
  365   2HD1  LEU  51          HD12      LEU  51  17.832   1.107   0.967
  366   3HD1  LEU  51          HD13      LEU  51  16.965   2.193  -0.140
  367   1HD2  LEU  51          HD21      LEU  51  19.512   0.438  -0.884
  368   2HD2  LEU  51          HD22      LEU  51  18.853   0.119  -2.507
  369   3HD2  LEU  51          HD23      LEU  51  18.682   1.719  -1.797
  370    H    VAL  52           H        VAL  52  19.883  -3.460  -1.135
  371    HA   VAL  52           HA       VAL  52  18.642  -5.898   0.054
  372    HB   VAL  52           HB       VAL  52  21.101  -5.768  -1.734
  373   1HG1  VAL  52          HG11      VAL  52  21.034  -7.714  -0.189
  374   2HG1  VAL  52          HG12      VAL  52  19.406  -8.120  -0.765
  375   3HG1  VAL  52          HG13      VAL  52  20.800  -8.223  -1.863
  376   1HG2  VAL  52          HG21      VAL  52  19.673  -6.852  -3.481
  377   2HG2  VAL  52          HG22      VAL  52  18.241  -6.540  -2.474
  378   3HG2  VAL  52          HG23      VAL  52  19.191  -5.192  -3.144
  379    H    ILE  53           H        ILE  53  19.531  -6.603   1.936
  380    HA   ILE  53           HA       ILE  53  21.859  -5.104   3.029
  381    HB   ILE  53           HB       ILE  53  19.496  -6.028   4.714
  382   1HG1  ILE  53          HG12      ILE  53  19.128  -3.410   4.875
  383   2HG1  ILE  53          HG13      ILE  53  19.833  -3.394   3.262
  384   1HG2  ILE  53          HG21      ILE  53  20.500  -4.529   6.371
  385   2HG2  ILE  53          HG22      ILE  53  21.686  -5.716   5.829
  386   3HG2  ILE  53          HG23      ILE  53  21.762  -4.050   5.216
  387   1HD1  ILE  53          HD11      ILE  53  17.368  -4.981   4.127
  388   2HD1  ILE  53          HD12      ILE  53  17.358  -3.445   3.252
  389   3HD1  ILE  53          HD13      ILE  53  17.994  -4.881   2.466
  390    H    SER  54           H        SER  54  23.495  -6.512   3.241
  391    HA   SER  54           HA       SER  54  23.146  -9.157   4.308
  392   1HB   SER  54          HB2       SER  54  23.872  -8.853   1.362
  393   2HB   SER  54          HB3       SER  54  24.105 -10.337   2.299
  394    HG   SER  54           HG       SER  54  21.590  -9.198   2.469
  395    H    SER  55           H        SER  55  25.585 -10.292   3.854
  396    HA   SER  55           HA       SER  55  27.633  -8.237   4.274
  397   1HB   SER  55          HB2       SER  55  28.068  -9.406   6.593
  398   2HB   SER  55          HB3       SER  55  26.753  -8.231   6.472
  399    HG   SER  55           HG       SER  55  26.129 -10.153   7.560
  400    H    THR  56           H        THR  56  27.954  -9.454   2.185
  401    HA   THR  56           HA       THR  56  29.082 -12.085   2.301
  402    HB   THR  56           HB       THR  56  30.011 -11.360   0.044
  403    HG1  THR  56           HG1      THR  56  29.146  -9.421  -0.751
  404   1HG2  THR  56          HG21      THR  56  27.749 -11.037  -1.066
  405   2HG2  THR  56          HG22      THR  56  27.979 -12.498  -0.122
  406   3HG2  THR  56          HG23      THR  56  27.032 -11.140   0.557
  407    H    HIS  57           H        HIS  57  30.308  -9.101   3.452
  408    HA   HIS  57           HA       HIS  57  33.083  -9.338   2.924
  409   1HB   HIS  57          HB2       HIS  57  33.311  -7.729   4.760
  410   2HB   HIS  57          HB3       HIS  57  32.050  -7.251   3.653
  411    HD1  HIS  57           HD1      HIS  57  29.839  -6.470   4.853
  412    HD2  HIS  57           HD2      HIS  57  32.278  -9.056   7.136
  413    HE1  HIS  57           HE1      HIS  57  28.795  -6.612   7.150
  414    H    GLY  58           H        GLY  58  34.752  -9.670   4.632
  415   1HA   GLY  58          HA2       GLY  58  35.745 -10.684   6.425
  416   2HA   GLY  58          HA3       GLY  58  34.167 -11.246   6.986
  417    H    ALA  59           H        ALA  59  33.162 -12.976   5.454
  418    HA   ALA  59           HA       ALA  59  35.119 -14.827   4.243
  419   1HB   ALA  59          HB1       ALA  59  35.170 -15.382   6.667
  420   2HB   ALA  59          HB2       ALA  59  33.406 -15.619   6.645
  421   3HB   ALA  59          HB3       ALA  59  34.466 -16.697   5.714
  422    H    GLY  60           H        GLY  60  31.937 -13.488   4.246
  423   1HA   GLY  60          HA2       GLY  60  29.985 -14.074   3.190
  424   2HA   GLY  60          HA3       GLY  60  30.961 -15.086   2.119
  425    H    ASP  61           H        ASP  61  29.527 -16.828   2.077
  426    HA   ASP  61           HA       ASP  61  29.806 -18.668   4.324
  427   1HB   ASP  61          HB2       ASP  61  27.568 -17.561   4.731
  428   2HB   ASP  61          HB3       ASP  61  27.050 -18.145   3.143
  429    H    ILE  62           H        ILE  62  29.024 -20.901   3.497
  430    HA   ILE  62           HA       ILE  62  30.587 -21.671   1.391
  431    HB   ILE  62           HB       ILE  62  28.128 -23.032   2.532
  432   1HG1  ILE  62          HG12      ILE  62  31.110 -23.398   3.084
  433   2HG1  ILE  62          HG13      ILE  62  29.991 -22.520   4.122
  434   1HG2  ILE  62          HG21      ILE  62  30.318 -24.264   0.798
  435   2HG2  ILE  62          HG22      ILE  62  28.993 -25.144   1.591
  436   3HG2  ILE  62          HG23      ILE  62  28.627 -24.016   0.304
  437   1HD1  ILE  62          HD11      ILE  62  28.665 -24.631   4.435
  438   2HD1  ILE  62          HD12      ILE  62  29.964 -25.505   3.581
  439   3HD1  ILE  62          HD13      ILE  62  30.313 -24.663   5.095
  440    HA   PRO  63           HA       PRO  63  27.188 -21.620  -1.914
  441   1HB   PRO  63          HB2       PRO  63  24.859 -20.174  -1.597
  442   2HB   PRO  63          HB3       PRO  63  25.041 -21.902  -1.174
  443   1HG   PRO  63          HG2       PRO  63  25.213 -19.504   0.667
  444   2HG   PRO  63          HG3       PRO  63  24.340 -21.048   0.925
  445   1HD   PRO  63          HD2       PRO  63  26.781 -20.584   2.007
  446   2HD   PRO  63          HD3       PRO  63  26.327 -22.206   1.408
  447    H    ASP  64           H        ASP  64  27.209 -18.627   0.057
  448    HA   ASP  64           HA       ASP  64  28.820 -17.104  -1.692
  449   1HB   ASP  64          HB2       ASP  64  26.984 -16.866  -3.224
  450   2HB   ASP  64          HB3       ASP  64  25.819 -16.627  -1.920
  451    H    ASN  65           H        ASN  65  25.895 -16.494   0.255
  452    HA   ASN  65           HA       ASN  65  27.034 -15.970   2.778
  453   1HB   ASN  65          HB2       ASN  65  27.993 -13.920   1.890
  454   2HB   ASN  65          HB3       ASN  65  26.457 -13.509   1.125
  455   1HD2  ASN  65          HD21      ASN  65  27.594 -14.394   4.495
  456   2HD2  ASN  65          HD22      ASN  65  26.806 -13.024   5.212
  457    H    LEU  66           H        LEU  66  24.643 -14.679   0.454
  458    HA   LEU  66           HA       LEU  66  22.352 -15.094   2.260
  459   1HB   LEU  66          HB2       LEU  66  22.397 -14.578  -0.748
  460   2HB   LEU  66          HB3       LEU  66  21.034 -14.539   0.366
  461    HG   LEU  66           HG       LEU  66  22.102 -12.543   1.508
  462   1HD1  LEU  66          HD11      LEU  66  24.369 -12.503   0.778
  463   2HD1  LEU  66          HD12      LEU  66  23.916 -12.718  -0.930
  464   3HD1  LEU  66          HD13      LEU  66  23.600 -11.189  -0.091
  465   1HD2  LEU  66          HD21      LEU  66  21.273 -10.989  -0.246
  466   2HD2  LEU  66          HD22      LEU  66  21.264 -12.321  -1.420
  467   3HD2  LEU  66          HD23      LEU  66  20.183 -12.350  -0.004
  468    H    SER  67           H        SER  67  21.199 -17.163   2.296
  469    HA   SER  67           HA       SER  67  22.719 -19.268   0.990
  470   1HB   SER  67          HB2       SER  67  20.733 -20.490   2.441
  471   2HB   SER  67          HB3       SER  67  22.360 -20.101   3.005
  472    HG   SER  67           HG       SER  67  20.675 -19.358   4.401
  473    HA   PRO  68           HA       PRO  68  18.647 -20.180  -1.216
  474   1HB   PRO  68          HB2       PRO  68  16.336 -18.801  -0.790
  475   2HB   PRO  68          HB3       PRO  68  16.923 -20.052   0.342
  476   1HG   PRO  68          HG2       PRO  68  17.210 -17.062   0.615
  477   2HG   PRO  68          HG3       PRO  68  16.708 -18.235   1.860
  478   1HD   PRO  68          HD2       PRO  68  19.250 -17.354   1.711
  479   2HD   PRO  68          HD3       PRO  68  18.825 -19.004   2.233
  480    H    PHE  69           H        PHE  69  18.872 -16.659  -0.663
  481    HA   PHE  69           HA       PHE  69  17.672 -15.813  -2.966
  482   1HB   PHE  69          HB2       PHE  69  19.959 -14.491  -1.480
  483   2HB   PHE  69          HB3       PHE  69  18.934 -13.715  -2.640
  484    HD1  PHE  69           HD1      PHE  69  16.772 -12.867  -2.111
  485    HD2  PHE  69           HD2      PHE  69  18.973 -15.153   0.811
  486    HE1  PHE  69           HE1      PHE  69  15.159 -12.201  -0.361
  487    HE2  PHE  69           HE2      PHE  69  17.352 -14.495   2.547
  488    HZ   PHE  69           HZ       PHE  69  15.438 -13.021   1.980
  489    H    TYR  70           H        TYR  70  21.215 -16.337  -2.514
  490    HA   TYR  70           HA       TYR  70  21.940 -15.460  -5.087
  491   1HB   TYR  70          HB2       TYR  70  23.545 -15.715  -3.278
  492   2HB   TYR  70          HB3       TYR  70  23.293 -17.457  -3.283
  493    HD1  TYR  70           HD1      TYR  70  24.214 -14.696  -5.703
  494    HD2  TYR  70           HD2      TYR  70  24.862 -18.774  -4.443
  495    HE1  TYR  70           HE1      TYR  70  25.972 -14.946  -7.431
  496    HE2  TYR  70           HE2      TYR  70  26.623 -19.029  -6.153
  497    HH   TYR  70           HH       TYR  70  27.778 -18.021  -7.900
  498    H    GLU  71           H        GLU  71  21.087 -18.797  -3.956
  499    HA   GLU  71           HA       GLU  71  21.548 -20.003  -6.501
  500   1HB   GLU  71          HB2       GLU  71  19.662 -20.906  -4.279
  501   2HB   GLU  71          HB3       GLU  71  20.267 -21.883  -5.625
  502   1HG   GLU  71          HG2       GLU  71  22.619 -21.280  -4.733
  503   2HG   GLU  71          HG3       GLU  71  21.817 -20.747  -3.270
  504    H    ALA  72           H        ALA  72  18.530 -18.714  -4.962
  505    HA   ALA  72           HA       ALA  72  16.798 -19.431  -7.083
  506   1HB   ALA  72          HB1       ALA  72  15.956 -18.819  -4.885
  507   2HB   ALA  72          HB2       ALA  72  16.651 -17.190  -5.040
  508   3HB   ALA  72          HB3       ALA  72  15.302 -17.680  -6.090
  509    H    LEU  73           H        LEU  73  18.780 -16.442  -6.627
  510    HA   LEU  73           HA       LEU  73  17.666 -14.867  -8.661
  511   1HB   LEU  73          HB2       LEU  73  20.459 -15.170  -7.494
  512   2HB   LEU  73          HB3       LEU  73  20.213 -14.125  -8.863
  513    HG   LEU  73           HG       LEU  73  18.819 -13.850  -6.172
  514   1HD1  LEU  73          HD11      LEU  73  21.226 -13.346  -6.074
  515   2HD1  LEU  73          HD12      LEU  73  21.061 -12.212  -7.431
  516   3HD1  LEU  73          HD13      LEU  73  20.268 -11.874  -5.876
  517   1HD2  LEU  73          HD21      LEU  73  17.365 -12.903  -7.899
  518   2HD2  LEU  73          HD22      LEU  73  18.125 -11.599  -7.005
  519   3HD2  LEU  73          HD23      LEU  73  18.736 -12.030  -8.619
  520    H    GLN  74           H        GLN  74  20.428 -17.130  -8.906
  521    HA   GLN  74           HA       GLN  74  20.552 -16.789 -11.752
  522   1HB   GLN  74          HB2       GLN  74  21.900 -19.123 -10.343
  523   2HB   GLN  74          HB3       GLN  74  22.356 -18.266 -11.801
  524   1HG   GLN  74          HG2       GLN  74  22.782 -16.236 -10.391
  525   2HG   GLN  74          HG3       GLN  74  22.374 -17.194  -8.963
  526   1HE2  GLN  74          HE22      GLN  74  24.697 -16.742 -11.556
  527   2HE2  GLN  74          HE21      GLN  74  25.922 -17.832 -10.910
  528    H    GLU  75           H        GLU  75  18.547 -18.770  -9.828
  529    HA   GLU  75           HA       GLU  75  18.128 -20.838 -11.778
  530   1HB   GLU  75          HB2       GLU  75  17.708 -21.047  -9.319
  531   2HB   GLU  75          HB3       GLU  75  16.290 -20.014  -9.523
  532   1HG   GLU  75          HG2       GLU  75  15.258 -21.666 -11.018
  533   2HG   GLU  75          HG3       GLU  75  16.719 -22.657 -10.969
  534    H    GLN  76           H        GLN  76  16.648 -17.667 -11.191
  535    HA   GLN  76           HA       GLN  76  14.765 -18.171 -13.457
  536   1HB   GLN  76          HB2       GLN  76  13.387 -16.336 -12.390
  537   2HB   GLN  76          HB3       GLN  76  13.382 -17.922 -11.633
  538   1HG   GLN  76          HG2       GLN  76  14.557 -17.237  -9.774
  539   2HG   GLN  76          HG3       GLN  76  15.326 -15.870 -10.587
  540   1HE2  GLN  76          HE22      GLN  76  14.676 -14.745  -8.525
  541   2HE2  GLN  76          HE21      GLN  76  13.097 -13.970  -8.518
  542    H    LYS  77           H        LYS  77  17.200 -15.906 -12.298
  543    HA   LYS  77           HA       LYS  77  17.635 -13.738 -12.884
  544   1HB   LYS  77          HB2       LYS  77  18.184 -15.097 -15.519
  545   2HB   LYS  77          HB3       LYS  77  18.925 -13.619 -14.892
  546   1HG   LYS  77          HG2       LYS  77  19.687 -15.093 -12.908
  547   2HG   LYS  77          HG3       LYS  77  19.230 -16.472 -13.920
  548   1HD   LYS  77          HD2       LYS  77  20.844 -15.053 -15.651
  549   2HD   LYS  77          HD3       LYS  77  21.545 -14.602 -14.078
  550   1HE   LYS  77          HE2       LYS  77  21.534 -17.136 -13.580
  551   2HE   LYS  77          HE3       LYS  77  21.211 -17.374 -15.295
  552   1HZ   LYS  77          HZ1       LYS  77  23.584 -16.056 -14.093
  553   2HZ   LYS  77          HZ2       LYS  77  23.562 -17.495 -14.869
  554   3HZ   LYS  77          HZ3       LYS  77  23.307 -16.131 -15.724
  555    HA   PRO  78           HA       PRO  78  13.585 -12.821 -14.986
  556   1HB   PRO  78          HB2       PRO  78  12.686 -10.913 -13.127
  557   2HB   PRO  78          HB3       PRO  78  12.287 -12.648 -13.156
  558   1HG   PRO  78          HG2       PRO  78  14.264 -11.204 -11.436
  559   2HG   PRO  78          HG3       PRO  78  13.272 -12.629 -11.054
  560   1HD   PRO  78          HD2       PRO  78  15.965 -12.742 -11.714
  561   2HD   PRO  78          HD3       PRO  78  14.811 -14.080 -11.975
  562    H    ASP  79           H        ASP  79  12.635 -10.520 -15.524
  563    HA   ASP  79           HA       ASP  79  14.799  -9.078 -16.856
  564   1HB   ASP  79          HB2       ASP  79  12.770  -9.704 -18.078
  565   2HB   ASP  79          HB3       ASP  79  11.774  -8.769 -16.955
  566    H    LEU  80           H        LEU  80  15.685  -8.456 -14.701
  567    HA   LEU  80           HA       LEU  80  14.352  -6.462 -13.102
  568   1HB   LEU  80          HB2       LEU  80  17.304  -7.089 -13.349
  569   2HB   LEU  80          HB3       LEU  80  16.630  -6.015 -12.170
  570    HG   LEU  80           HG       LEU  80  17.245  -7.941 -11.042
  571   1HD1  LEU  80          HD11      LEU  80  15.153  -8.550  -9.914
  572   2HD1  LEU  80          HD12      LEU  80  15.255  -6.810 -10.189
  573   3HD1  LEU  80          HD13      LEU  80  14.210  -7.821 -11.221
  574   1HD2  LEU  80          HD21      LEU  80  16.403 -10.133 -11.393
  575   2HD2  LEU  80          HD22      LEU  80  15.277  -9.565 -12.650
  576   3HD2  LEU  80          HD23      LEU  80  17.035  -9.544 -12.935
  577    H    SER  81           H        SER  81  15.244  -5.956 -16.234
  578    HA   SER  81           HA       SER  81  16.879  -3.739 -16.311
  579   1HB   SER  81          HB2       SER  81  14.724  -4.551 -18.288
  580   2HB   SER  81          HB3       SER  81  16.343  -3.917 -18.576
  581    HG   SER  81           HG       SER  81  15.492  -6.443 -18.365
  582    H    ALA  82           H        ALA  82  13.795  -3.912 -15.054
  583    HA   ALA  82           HA       ALA  82  13.130  -1.073 -15.721
  584   1HB   ALA  82          HB1       ALA  82  11.294  -3.365 -14.930
  585   2HB   ALA  82          HB2       ALA  82  10.789  -1.681 -15.190
  586   3HB   ALA  82          HB3       ALA  82  11.431  -2.633 -16.541
  587    H    VAL  83           H        VAL  83  14.763  -2.763 -13.437
  588    HA   VAL  83           HA       VAL  83  13.932  -0.809 -11.370
  589    HB   VAL  83           HB       VAL  83  12.813  -2.717 -10.647
  590   1HG1  VAL  83          HG11      VAL  83  13.773  -4.961 -10.346
  591   2HG1  VAL  83          HG12      VAL  83  13.776  -4.473 -12.042
  592   3HG1  VAL  83          HG13      VAL  83  15.283  -4.411 -11.102
  593   1HG2  VAL  83          HG21      VAL  83  14.222  -1.702  -8.806
  594   2HG2  VAL  83          HG22      VAL  83  13.721  -3.371  -8.576
  595   3HG2  VAL  83          HG23      VAL  83  15.383  -3.012  -9.065
  596    H    ARG  84           H        ARG  84  15.597  -0.326  -9.768
  597    HA   ARG  84           HA       ARG  84  18.336  -1.087 -10.566
  598   1HB   ARG  84          HB2       ARG  84  19.174   1.026  -9.984
  599   2HB   ARG  84          HB3       ARG  84  17.897   1.317 -11.163
  600   1HG   ARG  84          HG2       ARG  84  16.374   1.998  -9.282
  601   2HG   ARG  84          HG3       ARG  84  17.686   1.669  -8.135
  602   1HD   ARG  84          HD2       ARG  84  19.032   3.324  -9.740
  603   2HD   ARG  84          HD3       ARG  84  17.423   3.922 -10.113
  604    HE   ARG  84           HE       ARG  84  18.832   3.837  -7.465
  605   1HH1  ARG  84          HH11      ARG  84  16.285   5.283  -9.493
  606   2HH1  ARG  84          HH12      ARG  84  15.679   6.344  -8.284
  607   1HH2  ARG  84          HH21      ARG  84  17.949   5.240  -5.781
  608   2HH2  ARG  84          HH22      ARG  84  16.612   6.263  -6.121
  609    H    PHE  85           H        PHE  85  19.727  -1.296  -8.638
  610    HA   PHE  85           HA       PHE  85  18.120  -1.779  -6.180
  611   1HB   PHE  85          HB2       PHE  85  19.231  -3.737  -5.656
  612   2HB   PHE  85          HB3       PHE  85  18.683  -3.916  -7.301
  613    HD1  PHE  85           HD1      PHE  85  20.368  -3.783  -9.197
  614    HD2  PHE  85           HD2      PHE  85  21.561  -3.952  -5.061
  615    HE1  PHE  85           HE1      PHE  85  22.607  -4.598  -9.880
  616    HE2  PHE  85           HE2      PHE  85  23.805  -4.750  -5.746
  617    HZ   PHE  85           HZ       PHE  85  24.327  -5.095  -8.159
  618    H    GLY  86           H        GLY  86  19.682  -1.926  -4.266
  619   1HA   GLY  86          HA2       GLY  86  22.196  -0.456  -4.536
  620   2HA   GLY  86          HA3       GLY  86  20.998   0.234  -3.417
  621    H    ALA  87           H        ALA  87  23.447  -0.805  -2.467
  622    HA   ALA  87           HA       ALA  87  22.697  -3.399  -1.195
  623   1HB   ALA  87          HB1       ALA  87  24.303  -3.830  -3.005
  624   2HB   ALA  87          HB2       ALA  87  25.375  -2.551  -2.385
  625   3HB   ALA  87          HB3       ALA  87  25.104  -4.004  -1.430
  626    H    ILE  88           H        ILE  88  23.290  -3.555   0.937
  627    HA   ILE  88           HA       ILE  88  24.559  -1.191   2.228
  628    HB   ILE  88           HB       ILE  88  22.047  -2.666   3.128
  629   1HG1  ILE  88          HG12      ILE  88  22.309  -0.004   1.682
  630   2HG1  ILE  88          HG13      ILE  88  21.401  -1.424   1.187
  631   1HG2  ILE  88          HG21      ILE  88  21.923  -0.921   4.842
  632   2HG2  ILE  88          HG22      ILE  88  23.440  -1.791   4.950
  633   3HG2  ILE  88          HG23      ILE  88  23.409  -0.172   4.230
  634   1HD1  ILE  88          HD11      ILE  88  19.850  -1.076   3.120
  635   2HD1  ILE  88          HD12      ILE  88  20.702   0.452   3.464
  636   3HD1  ILE  88          HD13      ILE  88  19.860   0.234   1.927
  637    H    GLY  89           H        GLY  89  26.277  -1.924   3.398
  638   1HA   GLY  89          HA2       GLY  89  27.507  -3.157   4.904
  639   2HA   GLY  89          HA3       GLY  89  26.133  -4.246   5.126
  640    H    ILE  90           H        ILE  90  26.301  -4.545   1.983
  641    HA   ILE  90           HA       ILE  90  27.514  -7.072   2.000
  642    HB   ILE  90           HB       ILE  90  26.901  -5.310  -0.401
  643   1HG1  ILE  90          HG12      ILE  90  25.086  -6.920   1.383
  644   2HG1  ILE  90          HG13      ILE  90  24.904  -5.261   0.834
  645   1HG2  ILE  90          HG21      ILE  90  26.863  -8.347  -0.185
  646   2HG2  ILE  90          HG22      ILE  90  26.574  -7.375  -1.645
  647   3HG2  ILE  90          HG23      ILE  90  28.159  -7.377  -0.922
  648   1HD1  ILE  90          HD11      ILE  90  23.221  -6.545  -0.227
  649   2HD1  ILE  90          HD12      ILE  90  24.409  -6.162  -1.485
  650   3HD1  ILE  90          HD13      ILE  90  24.366  -7.782  -0.762
  651    H    GLY  91           H        GLY  91  29.562  -7.845   1.200
  652   1HA   GLY  91          HA2       GLY  91  31.766  -5.874   1.415
  653   2HA   GLY  91          HA3       GLY  91  31.877  -7.643   1.431
  654    H    SER  92           H        SER  92  29.983  -7.552  -1.008
  655    HA   SER  92           HA       SER  92  31.728  -8.260  -2.954
  656   1HB   SER  92          HB2       SER  92  28.936  -7.139  -3.126
  657   2HB   SER  92          HB3       SER  92  29.690  -8.126  -4.390
  658    HG   SER  92           HG       SER  92  29.380  -9.864  -3.178
  659    H    ARG  93           H        ARG  93  31.167  -4.923  -2.118
  660    HA   ARG  93           HA       ARG  93  32.474  -4.100  -4.666
  661   1HB   ARG  93          HB2       ARG  93  29.923  -3.499  -4.092
  662   2HB   ARG  93          HB3       ARG  93  30.661  -2.260  -3.104
  663   1HG   ARG  93          HG2       ARG  93  29.931  -1.489  -5.345
  664   2HG   ARG  93          HG3       ARG  93  31.634  -1.181  -5.041
  665   1HD   ARG  93          HD2       ARG  93  31.056  -2.018  -7.370
  666   2HD   ARG  93          HD3       ARG  93  32.331  -2.904  -6.524
  667    HE   ARG  93           HE       ARG  93  29.675  -4.036  -6.108
  668   1HH1  ARG  93          HH21      ARG  93  32.574  -4.257  -8.259
  669   2HH1  ARG  93          HH22      ARG  93  32.279  -5.974  -8.485
  670   1HH2  ARG  93          HH11      ARG  93  29.437  -6.120  -6.528
  671   2HH2  ARG  93          HH12      ARG  93  30.544  -6.999  -7.618
  672    H    GLU  94           H        GLU  94  33.222  -4.487  -1.495
  673    HA   GLU  94           HA       GLU  94  34.982  -2.077  -1.431
  674   1HB   GLU  94          HB2       GLU  94  33.055  -2.902   0.734
  675   2HB   GLU  94          HB3       GLU  94  34.302  -1.658   0.910
  676   1HG   GLU  94          HG2       GLU  94  33.210  -0.444  -1.059
  677   2HG   GLU  94          HG3       GLU  94  31.843  -1.552  -0.879
  678    H    TYR  95           H        TYR  95  34.355  -5.371  -0.410
  679    HA   TYR  95           HA       TYR  95  36.902  -5.431   1.141
  680   1HB   TYR  95          HB2       TYR  95  34.767  -5.813   2.368
  681   2HB   TYR  95          HB3       TYR  95  34.416  -7.179   1.318
  682    HD1  TYR  95           HD1      TYR  95  36.653  -5.907   4.000
  683    HD2  TYR  95           HD2      TYR  95  35.521  -9.338   1.634
  684    HE1  TYR  95           HE1      TYR  95  37.954  -7.368   5.510
  685    HE2  TYR  95           HE2      TYR  95  36.831 -10.807   3.139
  686    HH   TYR  95           HH       TYR  95  38.669  -9.539   5.960
  687    H    ASP  96           H        ASP  96  35.027  -7.066  -1.413
  688    HA   ASP  96           HA       ASP  96  37.155  -9.108  -1.706
  689   1HB   ASP  96          HB2       ASP  96  34.899  -9.868  -1.240
  690   2HB   ASP  96          HB3       ASP  96  34.273  -8.933  -2.609
  691    H    THR  97           H        THR  97  36.956  -6.281  -2.826
  692    HA   THR  97           HA       THR  97  36.841  -6.450  -5.682
  693    HB   THR  97           HB       THR  97  37.742  -4.004  -5.336
  694    HG1  THR  97           HG1      THR  97  38.549  -4.125  -3.264
  695   1HG2  THR  97          HG21      THR  97  35.162  -4.899  -3.972
  696   2HG2  THR  97          HG22      THR  97  35.538  -3.275  -4.606
  697   3HG2  THR  97          HG23      THR  97  35.364  -4.642  -5.719
  698    H    PHE  98           H        PHE  98  38.881  -8.147  -4.275
  699    HA   PHE  98           HA       PHE  98  41.117  -7.608  -6.124
  700   1HB   PHE  98          HB2       PHE  98  41.674  -6.688  -3.850
  701   2HB   PHE  98          HB3       PHE  98  41.472  -8.301  -3.180
  702    HD1  PHE  98           HD1      PHE  98  43.385  -6.450  -5.860
  703    HD2  PHE  98           HD2      PHE  98  43.406  -9.663  -2.975
  704    HE1  PHE  98           HE1      PHE  98  45.774  -6.898  -6.366
  705    HE2  PHE  98           HE2      PHE  98  45.792 -10.103  -3.487
  706    HZ   PHE  98           HZ       PHE  98  46.982  -8.724  -5.184
  707    H    CYS  99           H        CYS  99  38.858  -9.860  -4.658
  708    HA   CYS  99           HA       CYS  99  40.319 -12.069  -5.933
  709   1HB   CYS  99          HB2       CYS  99  39.018 -12.222  -3.172
  710   2HB   CYS  99          HB3       CYS  99  39.877 -13.535  -3.982
  711    HG   CYS  99           HG       CYS  99  41.309 -12.654  -1.989
  712    H    GLY 100           H        GLY 100  37.615 -10.532  -5.890
  713   1HA   GLY 100          HA2       GLY 100  35.409 -10.887  -6.515
  714   2HA   GLY 100          HA3       GLY 100  36.188 -11.815  -7.800
  715    H    ALA 101           H        ALA 101  35.970 -12.769  -4.324
  716    HA   ALA 101           HA       ALA 101  35.127 -15.452  -5.099
  717   1HB   ALA 101          HB1       ALA 101  36.706 -15.065  -3.232
  718   2HB   ALA 101          HB2       ALA 101  35.452 -14.155  -2.356
  719   3HB   ALA 101          HB3       ALA 101  35.233 -15.886  -2.677
  720    H    ILE 102           H        ILE 102  33.588 -12.513  -3.866
  721    HA   ILE 102           HA       ILE 102  30.934 -13.835  -3.891
  722    HB   ILE 102           HB       ILE 102  30.362 -12.655  -1.776
  723   1HG1  ILE 102          HG12      ILE 102  32.226 -12.206  -0.167
  724   2HG1  ILE 102          HG13      ILE 102  33.391 -12.299  -1.475
  725   1HG2  ILE 102          HG21      ILE 102  32.561 -14.741  -1.500
  726   2HG2  ILE 102          HG22      ILE 102  31.265 -14.377  -0.346
  727   3HG2  ILE 102          HG23      ILE 102  30.865 -15.079  -1.915
  728   1HD1  ILE 102          HD11      ILE 102  32.664  -9.962  -0.782
  729   2HD1  ILE 102          HD12      ILE 102  32.459 -10.318  -2.514
  730   3HD1  ILE 102          HD13      ILE 102  31.073 -10.330  -1.441
  731    H    ASP 103           H        ASP 103  32.806 -11.307  -5.046
  732    HA   ASP 103           HA       ASP 103  31.083  -9.191  -5.550
  733   1HB   ASP 103          HB2       ASP 103  33.269  -9.101  -6.432
  734   2HB   ASP 103          HB3       ASP 103  33.136 -10.688  -7.186
  735    H    LYS 104           H        LYS 104  30.897 -12.439  -6.699
  736    HA   LYS 104           HA       LYS 104  29.315 -12.529  -8.917
  737   1HB   LYS 104          HB2       LYS 104  29.131 -14.327  -6.477
  738   2HB   LYS 104          HB3       LYS 104  28.613 -14.745  -8.108
  739   1HG   LYS 104          HG2       LYS 104  30.854 -14.815  -8.902
  740   2HG   LYS 104          HG3       LYS 104  31.505 -14.038  -7.449
  741   1HD   LYS 104          HD2       LYS 104  30.735 -15.971  -6.085
  742   2HD   LYS 104          HD3       LYS 104  30.261 -16.813  -7.574
  743   1HE   LYS 104          HE2       LYS 104  32.518 -16.945  -8.346
  744   2HE   LYS 104          HE3       LYS 104  33.064 -15.697  -7.216
  745   1HZ   LYS 104          HZ1       LYS 104  32.147 -18.385  -6.386
  746   2HZ   LYS 104          HZ2       LYS 104  33.706 -17.915  -6.485
  747   3HZ   LYS 104          HZ3       LYS 104  32.711 -17.193  -5.398
  748    H    LEU 105           H        LEU 105  28.165 -11.945  -5.553
  749    HA   LEU 105           HA       LEU 105  25.443 -12.521  -6.020
  750   1HB   LEU 105          HB2       LEU 105  26.522 -12.263  -3.809
  751   2HB   LEU 105          HB3       LEU 105  26.717 -10.544  -4.061
  752    HG   LEU 105           HG       LEU 105  24.884 -11.186  -2.531
  753   1HD1  LEU 105          HD11      LEU 105  23.245  -9.618  -3.228
  754   2HD1  LEU 105          HD12      LEU 105  24.807  -9.011  -3.796
  755   3HD1  LEU 105          HD13      LEU 105  23.673  -9.779  -4.933
  756   1HD2  LEU 105          HD21      LEU 105  24.130 -13.242  -3.687
  757   2HD2  LEU 105          HD22      LEU 105  22.790 -12.138  -3.345
  758   3HD2  LEU 105          HD23      LEU 105  23.429 -12.252  -4.995
  759    H    GLU 106           H        GLU 106  27.106  -9.335  -6.013
  760    HA   GLU 106           HA       GLU 106  24.798  -7.910  -7.016
  761   1HB   GLU 106          HB2       GLU 106  27.730  -7.128  -6.949
  762   2HB   GLU 106          HB3       GLU 106  26.371  -6.024  -7.187
  763   1HG   GLU 106          HG2       GLU 106  25.507  -6.573  -4.942
  764   2HG   GLU 106          HG3       GLU 106  26.874  -7.656  -4.654
  765    H    ALA 107           H        ALA 107  27.643  -9.497  -8.412
  766    HA   ALA 107           HA       ALA 107  27.564  -8.324 -10.982
  767   1HB   ALA 107          HB1       ALA 107  28.876 -10.209 -11.730
  768   2HB   ALA 107          HB2       ALA 107  29.440  -9.736 -10.115
  769   3HB   ALA 107          HB3       ALA 107  28.399 -11.170 -10.326
  770    H    GLU 108           H        GLU 108  25.800 -11.263  -9.689
  771    HA   GLU 108           HA       GLU 108  24.549 -11.810 -12.236
  772   1HB   GLU 108          HB2       GLU 108  23.980 -12.596  -9.376
  773   2HB   GLU 108          HB3       GLU 108  22.949 -13.080 -10.707
  774   1HG   GLU 108          HG2       GLU 108  25.888 -13.840 -10.395
  775   2HG   GLU 108          HG3       GLU 108  24.484 -14.841 -10.126
  776    H    LEU 109           H        LEU 109  23.638  -9.790  -9.422
  777    HA   LEU 109           HA       LEU 109  20.982  -9.203 -10.297
  778   1HB   LEU 109          HB2       LEU 109  22.965  -7.782  -8.484
  779   2HB   LEU 109          HB3       LEU 109  21.397  -7.075  -8.855
  780    HG   LEU 109           HG       LEU 109  21.774  -9.795  -7.549
  781   1HD1  LEU 109          HD11      LEU 109  22.542  -7.924  -6.113
  782   2HD1  LEU 109          HD12      LEU 109  20.983  -7.107  -6.336
  783   3HD1  LEU 109          HD13      LEU 109  21.066  -8.665  -5.479
  784   1HD2  LEU 109          HD21      LEU 109  19.347  -9.530  -6.973
  785   2HD2  LEU 109          HD22      LEU 109  19.277  -8.092  -8.009
  786   3HD2  LEU 109          HD23      LEU 109  19.610  -9.691  -8.707
  787    H    LYS 110           H        LYS 110  24.109  -7.576 -11.029
  788    HA   LYS 110           HA       LYS 110  22.712  -5.613 -12.601
  789   1HB   LYS 110          HB2       LYS 110  24.704  -4.490 -13.115
  790   2HB   LYS 110          HB3       LYS 110  24.555  -4.839 -11.381
  791   1HG   LYS 110          HG2       LYS 110  25.723  -6.996 -12.031
  792   2HG   LYS 110          HG3       LYS 110  26.359  -6.145 -13.433
  793   1HD   LYS 110          HD2       LYS 110  26.789  -5.469 -10.475
  794   2HD   LYS 110          HD3       LYS 110  28.009  -6.076 -11.586
  795   1HE   LYS 110          HE2       LYS 110  26.614  -3.369 -11.847
  796   2HE   LYS 110          HE3       LYS 110  28.187  -3.626 -11.094
  797   1HZ   LYS 110          HZ1       LYS 110  29.020  -4.429 -13.229
  798   2HZ   LYS 110          HZ2       LYS 110  27.573  -4.160 -13.946
  799   3HZ   LYS 110          HZ3       LYS 110  28.445  -2.915 -13.366
  800    H    ASN 111           H        ASN 111  24.311  -8.658 -13.316
  801    HA   ASN 111           HA       ASN 111  24.325  -8.435 -16.162
  802   1HB   ASN 111          HB2       ASN 111  25.570 -10.229 -15.584
  803   2HB   ASN 111          HB3       ASN 111  24.760 -10.469 -14.076
  804   1HD2  ASN 111          HD21      ASN 111  22.868 -11.706 -13.829
  805   2HD2  ASN 111          HD22      ASN 111  22.636 -13.027 -14.940
  806    H    SER 112           H        SER 112  21.832  -9.390 -13.784
  807    HA   SER 112           HA       SER 112  20.216 -10.595 -15.828
  808   1HB   SER 112          HB2       SER 112  18.496 -10.786 -13.975
  809   2HB   SER 112          HB3       SER 112  20.032 -11.629 -13.791
  810    HG   SER 112           HG       SER 112  20.724 -10.214 -12.331
  811    H    GLY 113           H        GLY 113  20.441  -7.290 -14.721
  812   1HA   GLY 113          HA2       GLY 113  19.314  -6.221 -16.916
  813   2HA   GLY 113          HA3       GLY 113  17.879  -6.517 -15.934
  814    H    ALA 114           H        ALA 114  19.125  -5.942 -13.337
  815    HA   ALA 114           HA       ALA 114  18.590  -3.125 -13.372
  816   1HB   ALA 114          HB1       ALA 114  18.991  -3.325 -10.896
  817   2HB   ALA 114          HB2       ALA 114  17.809  -4.438 -11.505
  818   3HB   ALA 114          HB3       ALA 114  19.456  -5.025 -11.146
  819    H    LYS 115           H        LYS 115  20.137  -1.822 -11.723
  820    HA   LYS 115           HA       LYS 115  22.990  -2.326 -12.220
  821   1HB   LYS 115          HB2       LYS 115  23.394   0.091 -12.577
  822   2HB   LYS 115          HB3       LYS 115  22.467  -0.642 -13.887
  823   1HG   LYS 115          HG2       LYS 115  20.379   0.352 -13.019
  824   2HG   LYS 115          HG3       LYS 115  21.234   0.976 -11.608
  825   1HD   LYS 115          HD2       LYS 115  20.880   2.771 -13.165
  826   2HD   LYS 115          HD3       LYS 115  22.614   2.425 -13.075
  827   1HE   LYS 115          HE2       LYS 115  22.460   1.122 -15.192
  828   2HE   LYS 115          HE3       LYS 115  20.720   1.425 -15.258
  829   1HZ   LYS 115          HZ1       LYS 115  21.207   3.793 -15.477
  830   2HZ   LYS 115          HZ2       LYS 115  22.818   3.513 -15.411
  831   3HZ   LYS 115          HZ3       LYS 115  21.942   2.956 -16.664
  832    H    GLN 116           H        GLN 116  24.266  -1.523 -10.436
  833    HA   GLN 116           HA       GLN 116  22.770  -1.208  -7.927
  834   1HB   GLN 116          HB2       GLN 116  24.937  -2.506  -8.059
  835   2HB   GLN 116          HB3       GLN 116  25.749  -0.970  -8.400
  836   1HG   GLN 116          HG2       GLN 116  24.841  -0.052  -6.256
  837   2HG   GLN 116          HG3       GLN 116  24.081  -1.607  -5.924
  838   1HE2  GLN 116          HE22      GLN 116  25.706  -0.531  -4.047
  839   2HE2  GLN 116          HE21      GLN 116  27.128  -1.530  -3.879
  840    H    THR 117           H        THR 117  22.160   0.805  -7.231
  841    HA   THR 117           HA       THR 117  22.973   3.189  -8.709
  842    HB   THR 117           HB       THR 117  21.417   3.164  -6.087
  843    HG1  THR 117           HG1      THR 117  20.442   1.654  -7.393
  844   1HG2  THR 117          HG21      THR 117  21.380   4.934  -8.562
  845   2HG2  THR 117          HG22      THR 117  20.403   5.171  -7.101
  846   3HG2  THR 117          HG23      THR 117  22.159   5.329  -7.011
  847    H    GLY 118           H        GLY 118  24.471   4.726  -8.010
  848   1HA   GLY 118          HA2       GLY 118  26.220   5.644  -6.860
  849   2HA   GLY 118          HA3       GLY 118  25.333   5.194  -5.399
  850    H    GLU 119           H        GLU 119  26.433   3.929  -4.060
  851    HA   GLU 119           HA       GLU 119  27.863   1.594  -4.918
  852   1HB   GLU 119          HB2       GLU 119  30.053   2.108  -4.072
  853   2HB   GLU 119          HB3       GLU 119  29.616   3.329  -5.263
  854   1HG   GLU 119          HG2       GLU 119  28.944   4.852  -3.340
  855   2HG   GLU 119          HG3       GLU 119  29.630   3.635  -2.262
  856    H    THR 120           H        THR 120  28.564   0.314  -2.969
  857    HA   THR 120           HA       THR 120  26.420  -0.110  -1.413
  858    HB   THR 120           HB       THR 120  29.281  -0.916  -0.799
  859    HG1  THR 120           HG1      THR 120  28.620  -2.670  -2.215
  860   1HG2  THR 120          HG21      THR 120  27.837  -1.687   0.983
  861   2HG2  THR 120          HG22      THR 120  26.579  -2.186  -0.170
  862   3HG2  THR 120          HG23      THR 120  28.113  -3.055  -0.101
  863    H    LEU 121           H        LEU 121  25.522   0.546   0.334
  864    HA   LEU 121           HA       LEU 121  26.534   2.785   1.902
  865   1HB   LEU 121          HB2       LEU 121  24.078   2.103   1.073
  866   2HB   LEU 121          HB3       LEU 121  24.081   1.080   2.470
  867    HG   LEU 121           HG       LEU 121  24.924   3.819   3.168
  868   1HD1  LEU 121          HD11      LEU 121  22.158   3.446   1.948
  869   2HD1  LEU 121          HD12      LEU 121  22.735   4.876   2.828
  870   3HD1  LEU 121          HD13      LEU 121  23.474   4.438   1.281
  871   1HD2  LEU 121          HD21      LEU 121  22.530   2.177   4.093
  872   2HD2  LEU 121          HD22      LEU 121  24.144   2.130   4.831
  873   3HD2  LEU 121          HD23      LEU 121  23.203   3.620   4.881
  874    H    LYS 122           H        LYS 122  26.468   2.452   4.450
  875    HA   LYS 122           HA       LYS 122  27.155  -0.337   5.241
  876   1HB   LYS 122          HB2       LYS 122  28.800   2.155   5.721
  877   2HB   LYS 122          HB3       LYS 122  29.007   0.712   6.674
  878   1HG   LYS 122          HG2       LYS 122  29.877  -0.550   4.939
  879   2HG   LYS 122          HG3       LYS 122  29.197   0.444   3.663
  880   1HD   LYS 122          HD2       LYS 122  31.350   1.480   5.539
  881   2HD   LYS 122          HD3       LYS 122  31.731   0.613   4.051
  882   1HE   LYS 122          HE2       LYS 122  30.014   3.141   4.140
  883   2HE   LYS 122          HE3       LYS 122  31.755   3.127   3.842
  884   1HZ   LYS 122          HZ1       LYS 122  30.584   3.165   1.771
  885   2HZ   LYS 122          HZ2       LYS 122  31.363   1.726   1.904
  886   3HZ   LYS 122          HZ3       LYS 122  29.752   1.791   2.097
  887    H    ILE 123           H        ILE 123  26.570  -0.842   7.250
  888    HA   ILE 123           HA       ILE 123  25.525   1.098   9.172
  889    HB   ILE 123           HB       ILE 123  23.519  -0.373   9.536
  890   1HG1  ILE 123          HG12      ILE 123  22.818  -1.538   7.236
  891   2HG1  ILE 123          HG13      ILE 123  24.529  -1.761   7.029
  892   1HG2  ILE 123          HG21      ILE 123  22.165   0.707   7.941
  893   2HG2  ILE 123          HG22      ILE 123  23.479   1.822   8.311
  894   3HG2  ILE 123          HG23      ILE 123  23.502   0.902   6.788
  895   1HD1  ILE 123          HD11      ILE 123  22.850  -2.770   9.353
  896   2HD1  ILE 123          HD12      ILE 123  23.477  -3.728   8.005
  897   3HD1  ILE 123          HD13      ILE 123  24.597  -3.037   9.183
  898    H    ASN 124           H        ASN 124  25.435   0.202  11.353
  899    HA   ASN 124           HA       ASN 124  26.043  -2.539  11.744
  900   1HB   ASN 124          HB2       ASN 124  28.401  -1.449  11.307
  901   2HB   ASN 124          HB3       ASN 124  28.176  -0.680  12.883
  902   1HD2  ASN 124          HD22      ASN 124  27.681  -3.938  11.353
  903   2HD2  ASN 124          HD21      ASN 124  28.488  -4.831  12.638
  904    H    ILE 125           H        ILE 125  25.802  -3.146  13.986
  905    HA   ILE 125           HA       ILE 125  24.932  -1.067  15.886
  906    HB   ILE 125           HB       ILE 125  22.931  -2.575  16.456
  907   1HG1  ILE 125          HG12      ILE 125  21.878  -3.832  14.676
  908   2HG1  ILE 125          HG13      ILE 125  23.213  -3.531  13.571
  909   1HG2  ILE 125          HG21      ILE 125  21.497  -1.418  14.885
  910   2HG2  ILE 125          HG22      ILE 125  22.782  -0.338  15.434
  911   3HG2  ILE 125          HG23      ILE 125  22.868  -1.069  13.820
  912   1HD1  ILE 125          HD11      ILE 125  24.685  -4.958  14.904
  913   2HD1  ILE 125          HD12      ILE 125  23.418  -5.154  16.146
  914   3HD1  ILE 125          HD13      ILE 125  23.195  -5.829  14.520
  915    H    LEU 126           H        LEU 126  27.356  -2.744  15.621
  916    HA   LEU 126           HA       LEU 126  27.325  -3.915  18.343
  917   1HB   LEU 126          HB2       LEU 126  28.650  -5.085  15.857
  918   2HB   LEU 126          HB3       LEU 126  29.046  -5.577  17.496
  919    HG   LEU 126           HG       LEU 126  26.317  -5.915  16.204
  920   1HD1  LEU 126          HD11      LEU 126  26.871  -8.306  16.178
  921   2HD1  LEU 126          HD12      LEU 126  28.044  -7.378  15.235
  922   3HD1  LEU 126          HD13      LEU 126  28.479  -7.959  16.856
  923   1HD2  LEU 126          HD21      LEU 126  26.054  -5.685  18.633
  924   2HD2  LEU 126          HD22      LEU 126  25.831  -7.370  18.172
  925   3HD2  LEU 126          HD23      LEU 126  27.362  -6.857  18.914
  926    H    ASP 127           H        ASP 127  29.906  -4.198  18.833
  927    HA   ASP 127           HA       ASP 127  30.850  -1.545  19.126
  928   1HB   ASP 127          HB2       ASP 127  31.502  -3.347  20.636
  929   2HB   ASP 127          HB3       ASP 127  32.338  -4.189  19.324
  930    H    HIS 128           H        HIS 128  31.764  -4.092  16.751
  931    HA   HIS 128           HA       HIS 128  32.342  -2.155  14.743
  932   1HB   HIS 128          HB2       HIS 128  34.700  -2.704  14.350
  933   2HB   HIS 128          HB3       HIS 128  34.517  -1.988  15.937
  934    HD1  HIS 128           HD1      HIS 128  34.942  -3.686  18.068
  935    HD2  HIS 128           HD2      HIS 128  35.579  -5.227  14.190
  936    HE1  HIS 128           HE1      HIS 128  36.224  -5.869  18.357
  937    H    ASP 129           H        ASP 129  33.044  -3.266  12.734
  938    HA   ASP 129           HA       ASP 129  33.243  -6.030  12.349
  939   1HB   ASP 129          HB2       ASP 129  30.636  -4.810  11.335
  940   2HB   ASP 129          HB3       ASP 129  31.338  -6.264  10.694
  941    H    ILE 130           H        ILE 130  32.586  -5.816   9.532
  942    HA   ILE 130           HA       ILE 130  34.803  -4.189   8.588
  943    HB   ILE 130           HB       ILE 130  32.704  -5.737   7.035
  944   1HG1  ILE 130          HG12      ILE 130  33.965  -7.292   8.389
  945   2HG1  ILE 130          HG13      ILE 130  34.462  -7.443   6.719
  946   1HG2  ILE 130          HG21      ILE 130  33.662  -4.067   5.578
  947   2HG2  ILE 130          HG22      ILE 130  35.308  -4.469   6.103
  948   3HG2  ILE 130          HG23      ILE 130  34.353  -5.631   5.158
  949   1HD1  ILE 130          HD11      ILE 130  36.396  -7.607   8.159
  950   2HD1  ILE 130          HD12      ILE 130  36.527  -6.113   7.217
  951   3HD1  ILE 130          HD13      ILE 130  36.035  -6.055   8.927
  952    HA   PRO 131           HA       PRO 131  31.407  -1.302   6.797
  953   1HB   PRO 131          HB2       PRO 131  28.896  -1.272   7.913
  954   2HB   PRO 131          HB3       PRO 131  29.330  -2.306   6.515
  955   1HG   PRO 131          HG2       PRO 131  29.333  -3.085   9.459
  956   2HG   PRO 131          HG3       PRO 131  28.534  -3.923   8.121
  957   1HD   PRO 131          HD2       PRO 131  30.904  -4.772   8.904
  958   2HD   PRO 131          HD3       PRO 131  30.634  -4.574   7.153
  959    H    GLU 132           H        GLU 132  30.877  -2.198  10.157
  960    HA   GLU 132           HA       GLU 132  31.493  -1.350  12.134
  961   1HB   GLU 132          HB2       GLU 132  33.611  -0.895  10.767
  962   2HB   GLU 132          HB3       GLU 132  33.099   0.788  10.704
  963   1HG   GLU 132          HG2       GLU 132  33.137   0.884  13.191
  964   2HG   GLU 132          HG3       GLU 132  33.604  -0.816  13.243
  965    H    ASP 133           H        ASP 133  30.138   1.115   9.927
  966    HA   ASP 133           HA       ASP 133  28.983   2.531  12.288
  967   1HB   ASP 133          HB2       ASP 133  31.127   3.562  11.785
  968   2HB   ASP 133          HB3       ASP 133  30.739   3.647  10.071
  969    HA   PRO 134           HA       PRO 134  25.523   3.029   9.329
  970   1HB   PRO 134          HB2       PRO 134  24.009   4.830  10.701
  971   2HB   PRO 134          HB3       PRO 134  24.092   3.092  11.113
  972   1HG   PRO 134          HG2       PRO 134  25.624   5.377  12.383
  973   2HG   PRO 134          HG3       PRO 134  24.746   4.042  13.194
  974   1HD   PRO 134          HD2       PRO 134  27.436   3.977  12.807
  975   2HD   PRO 134          HD3       PRO 134  26.451   2.494  12.697
  976    H    ALA 135           H        ALA 135  26.500   3.861   7.620
  977    HA   ALA 135           HA       ALA 135  27.593   6.536   7.491
  978   1HB   ALA 135          HB1       ALA 135  27.033   4.505   5.288
  979   2HB   ALA 135          HB2       ALA 135  28.066   5.952   5.178
  980   3HB   ALA 135          HB3       ALA 135  28.535   4.617   6.239
  981    H    GLU 136           H        GLU 136  25.438   7.361   8.394
  982    HA   GLU 136           HA       GLU 136  23.086   7.598   6.883
  983   1HB   GLU 136          HB2       GLU 136  23.326   8.222   9.237
  984   2HB   GLU 136          HB3       GLU 136  24.413   9.552   8.812
  985   1HG   GLU 136          HG2       GLU 136  22.600  10.724   7.655
  986   2HG   GLU 136          HG3       GLU 136  21.527   9.336   7.865
  987    H    GLU 137           H        GLU 137  26.140   9.426   6.591
  988    HA   GLU 137           HA       GLU 137  25.193  11.435   4.803
  989   1HB   GLU 137          HB2       GLU 137  27.971  10.226   5.157
  990   2HB   GLU 137          HB3       GLU 137  27.611  11.673   4.205
  991   1HG   GLU 137          HG2       GLU 137  26.690  12.775   6.246
  992   2HG   GLU 137          HG3       GLU 137  27.134  11.360   7.202
  993    H    TRP 138           H        TRP 138  26.123   8.052   4.228
  994    HA   TRP 138           HA       TRP 138  26.426   8.252   1.373
  995   1HB   TRP 138          HB2       TRP 138  26.698   6.237   3.368
  996   2HB   TRP 138          HB3       TRP 138  25.385   5.714   2.371
  997    HD1  TRP 138           HD1      TRP 138  25.917   4.871  -0.051
  998    HE1  TRP 138           HE1      TRP 138  28.023   3.931  -1.073
  999    HE3  TRP 138           HE3      TRP 138  29.301   6.799   3.270
 1000    HZ2  TRP 138           HZ2      TRP 138  30.934   4.081  -0.563
 1001    HZ3  TRP 138           HZ3      TRP 138  31.725   6.368   2.990
 1002    HH2  TRP 138           HH2      TRP 138  32.549   5.024   1.068
 1003    H    LEU 139           H        LEU 139  23.748   7.454   3.631
 1004    HA   LEU 139           HA       LEU 139  21.778   6.850   1.664
 1005   1HB   LEU 139          HB2       LEU 139  21.834   6.618   4.329
 1006   2HB   LEU 139          HB3       LEU 139  21.176   8.210   4.326
 1007    HG   LEU 139           HG       LEU 139  19.269   7.461   2.871
 1008   1HD1  LEU 139          HD11      LEU 139  20.199   5.394   1.870
 1009   2HD1  LEU 139          HD12      LEU 139  20.329   4.661   3.486
 1010   3HD1  LEU 139          HD13      LEU 139  18.743   5.036   2.789
 1011   1HD2  LEU 139          HD21      LEU 139  19.098   7.701   5.313
 1012   2HD2  LEU 139          HD22      LEU 139  18.084   6.366   4.739
 1013   3HD2  LEU 139          HD23      LEU 139  19.643   6.024   5.533
 1014    H    GLY 140           H        GLY 140  22.443   9.733   3.555
 1015   1HA   GLY 140          HA2       GLY 140  20.707  11.610   2.462
 1016   2HA   GLY 140          HA3       GLY 140  22.334  12.002   3.056
 1017    H    SER 141           H        SER 141  24.067  10.855   1.184
 1018    HA   SER 141           HA       SER 141  24.057  12.633  -0.939
 1019   1HB   SER 141          HB2       SER 141  25.362   9.965  -0.203
 1020   2HB   SER 141          HB3       SER 141  25.783  10.833  -1.627
 1021    HG   SER 141           HG       SER 141  26.107  11.490   1.076
 1022    H    TRP 142           H        TRP 142  23.401   9.087  -0.929
 1023    HA   TRP 142           HA       TRP 142  22.653   8.789  -3.618
 1024   1HB   TRP 142          HB2       TRP 142  23.180   6.936  -2.204
 1025   2HB   TRP 142          HB3       TRP 142  21.894   7.336  -1.090
 1026    HD1  TRP 142           HD1      TRP 142  22.317   5.848  -4.627
 1027    HE1  TRP 142           HE1      TRP 142  20.281   4.371  -5.135
 1028    HE3  TRP 142           HE3      TRP 142  19.615   6.803  -0.424
 1029    HZ2  TRP 142           HZ2      TRP 142  17.689   3.797  -3.905
 1030    HZ3  TRP 142           HZ3      TRP 142  17.304   5.947  -0.191
 1031    HH2  TRP 142           HH2      TRP 142  16.343   4.415  -1.902
 1032    H    VAL 143           H        VAL 143  20.598   9.682  -0.819
 1033    HA   VAL 143           HA       VAL 143  18.132   9.878  -2.231
 1034    HB   VAL 143           HB       VAL 143  19.196  11.047   0.354
 1035   1HG1  VAL 143          HG11      VAL 143  16.915  11.857   0.872
 1036   2HG1  VAL 143          HG12      VAL 143  17.677  12.774  -0.422
 1037   3HG1  VAL 143          HG13      VAL 143  16.448  11.540  -0.820
 1038   1HG2  VAL 143          HG21      VAL 143  18.549   8.642   0.283
 1039   2HG2  VAL 143          HG22      VAL 143  17.497   9.574   1.345
 1040   3HG2  VAL 143          HG23      VAL 143  16.933   9.096  -0.272
 1041    H    ASN 144           H        ASN 144  20.627  12.434  -1.547
 1042    HA   ASN 144           HA       ASN 144  19.274  14.498  -2.910
 1043   1HB   ASN 144          HB2       ASN 144  22.285  14.086  -2.678
 1044   2HB   ASN 144          HB3       ASN 144  21.500  15.585  -3.139
 1045   1HD2  ASN 144          HD22      ASN 144  23.286  14.887  -0.801
 1046   2HD2  ASN 144          HD21      ASN 144  22.379  15.303   0.622
 1047    H    LEU 145           H        LEU 145  21.133  11.811  -4.174
 1048    HA   LEU 145           HA       LEU 145  21.487  12.965  -6.842
 1049   1HB   LEU 145          HB2       LEU 145  22.305  10.459  -5.426
 1050   2HB   LEU 145          HB3       LEU 145  21.947  10.272  -7.135
 1051    HG   LEU 145           HG       LEU 145  23.541  12.038  -7.731
 1052   1HD1  LEU 145          HD11      LEU 145  23.520  13.411  -5.665
 1053   2HD1  LEU 145          HD12      LEU 145  24.295  12.085  -4.776
 1054   3HD1  LEU 145          HD13      LEU 145  25.159  12.909  -6.091
 1055   1HD2  LEU 145          HD21      LEU 145  24.724   9.858  -5.954
 1056   2HD2  LEU 145          HD22      LEU 145  24.253   9.678  -7.658
 1057   3HD2  LEU 145          HD23      LEU 145  25.586  10.757  -7.225
 1058    H    LEU 146           H        LEU 146  19.351  10.413  -5.371
 1059    HA   LEU 146           HA       LEU 146  18.055   9.911  -7.859
 1060   1HB   LEU 146          HB2       LEU 146  16.754   8.444  -6.737
 1061   2HB   LEU 146          HB3       LEU 146  18.268   8.381  -5.873
 1062    HG   LEU 146           HG       LEU 146  16.941  10.081  -4.244
 1063   1HD1  LEU 146          HD11      LEU 146  14.836  10.134  -5.607
 1064   2HD1  LEU 146          HD12      LEU 146  14.695   8.379  -5.419
 1065   3HD1  LEU 146          HD13      LEU 146  14.583   9.448  -4.012
 1066   1HD2  LEU 146          HD21      LEU 146  16.441   7.081  -4.191
 1067   2HD2  LEU 146          HD22      LEU 146  17.915   7.886  -3.611
 1068   3HD2  LEU 146          HD23      LEU 146  16.367   8.201  -2.827
 1069    H    LYS 147           H        LYS 147  17.380  12.116  -5.191
 1070    HA   LYS 147           HA       LYS 147  14.796  12.995  -5.941
 1071   1HB   LYS 147          HB2       LYS 147  17.084  14.150  -4.316
 1072   2HB   LYS 147          HB3       LYS 147  15.693  15.161  -4.728
 1073   1HG   LYS 147          HG2       LYS 147  14.146  13.477  -3.746
 1074   2HG   LYS 147          HG3       LYS 147  15.536  12.499  -3.248
 1075   1HD   LYS 147          HD2       LYS 147  16.359  14.402  -1.871
 1076   2HD   LYS 147          HD3       LYS 147  14.953  15.362  -2.334
 1077   1HE   LYS 147          HE2       LYS 147  14.813  12.685  -0.869
 1078   2HE   LYS 147          HE3       LYS 147  14.820  14.250  -0.059
 1079   1HZ   LYS 147          HZ1       LYS 147  12.732  14.770  -1.105
 1080   2HZ   LYS 147          HZ2       LYS 147  12.733  13.378  -1.971
 1081   3HZ   LYS 147          HZ3       LYS 147  12.610  13.322  -0.343
  Start of MODEL    4
    1   1H    MET   1          H1        MET   1   1.330   1.258  -0.680
    2   2H    MET   1          H2        MET   1   1.891   0.469  -1.996
    3   3H    MET   1          H3        MET   1   0.508  -0.025  -1.267
    4    HA   MET   1           HA       MET   1   1.665  -0.641   0.718
    5   1HB   MET   1          HB2       MET   1   2.800  -1.918  -1.802
    6   2HB   MET   1          HB3       MET   1   3.121  -2.503  -0.173
    7   1HG   MET   1          HG2       MET   1   0.401  -2.318  -1.510
    8   2HG   MET   1          HG3       MET   1   1.325  -3.777  -1.208
    9   1HE   MET   1          HE1       MET   1   1.558  -5.000   1.068
   10   2HE   MET   1          HE2       MET   1   2.362  -3.587   1.793
   11   3HE   MET   1          HE3       MET   1   0.996  -4.355   2.624
   12    H    ALA   2           H        ALA   2   4.442  -0.403  -1.630
   13    HA   ALA   2           HA       ALA   2   5.811   1.512   0.107
   14   1HB   ALA   2          HB1       ALA   2   7.797  -0.001   0.302
   15   2HB   ALA   2          HB2       ALA   2   6.392  -0.625   1.184
   16   3HB   ALA   2          HB3       ALA   2   6.846  -1.323  -0.389
   17    H    ASP   3           H        ASP   3   7.842   2.203  -0.941
   18    HA   ASP   3           HA       ASP   3   7.778   2.015  -3.897
   19   1HB   ASP   3          HB2       ASP   3   7.675   4.286  -2.697
   20   2HB   ASP   3          HB3       ASP   3   9.283   3.943  -2.094
   21    H    ILE   4           H        ILE   4   9.585   1.204  -1.006
   22    HA   ILE   4           HA       ILE   4  11.800   0.081  -2.640
   23    HB   ILE   4           HB       ILE   4  12.140   1.300   0.108
   24   1HG1  ILE   4          HG12      ILE   4  12.692   2.752  -2.504
   25   2HG1  ILE   4          HG13      ILE   4  11.434   3.170  -1.339
   26   1HG2  ILE   4          HG21      ILE   4  14.168   0.726  -2.097
   27   2HG2  ILE   4          HG22      ILE   4  14.513   1.205  -0.421
   28   3HG2  ILE   4          HG23      ILE   4  13.823  -0.374  -0.761
   29   1HD1  ILE   4          HD11      ILE   4  14.426   3.403  -0.905
   30   2HD1  ILE   4          HD12      ILE   4  13.237   4.700  -1.052
   31   3HD1  ILE   4          HD13      ILE   4  13.205   3.635   0.366
   32    H    THR   5           H        THR   5  12.071  -2.056  -2.255
   33    HA   THR   5           HA       THR   5  10.874  -3.305   0.150
   34    HB   THR   5           HB       THR   5  10.424  -4.369  -2.019
   35    HG1  THR   5           HG1      THR   5  10.629  -5.805  -0.378
   36   1HG2  THR   5          HG21      THR   5  12.298  -3.689  -3.391
   37   2HG2  THR   5          HG22      THR   5  13.403  -4.700  -2.433
   38   3HG2  THR   5          HG23      THR   5  12.112  -5.442  -3.392
   39    H    LEU   6           H        LEU   6  12.193  -3.678   1.925
   40    HA   LEU   6           HA       LEU   6  15.143  -3.206   1.658
   41   1HB   LEU   6          HB2       LEU   6  13.176  -2.987   3.939
   42   2HB   LEU   6          HB3       LEU   6  14.855  -3.284   4.271
   43    HG   LEU   6           HG       LEU   6  14.104  -0.921   4.470
   44   1HD1  LEU   6          HD11      LEU   6  16.159   0.033   3.480
   45   2HD1  LEU   6          HD12      LEU   6  16.457  -1.463   4.364
   46   3HD1  LEU   6          HD13      LEU   6  16.423  -1.478   2.588
   47   1HD2  LEU   6          HD21      LEU   6  14.197  -0.853   1.440
   48   2HD2  LEU   6          HD22      LEU   6  12.701  -0.831   2.398
   49   3HD2  LEU   6          HD23      LEU   6  13.863   0.502   2.537
   50    H    ILE   7           H        ILE   7  15.709  -5.150   0.890
   51    HA   ILE   7           HA       ILE   7  14.531  -7.633   1.955
   52    HB   ILE   7           HB       ILE   7  16.540  -7.138  -0.278
   53   1HG1  ILE   7          HG12      ILE   7  13.614  -7.941  -0.566
   54   2HG1  ILE   7          HG13      ILE   7  14.128  -6.261  -0.609
   55   1HG2  ILE   7          HG21      ILE   7  16.740  -9.430   0.713
   56   2HG2  ILE   7          HG22      ILE   7  15.007  -9.687   0.442
   57   3HG2  ILE   7          HG23      ILE   7  16.114  -9.495  -0.928
   58   1HD1  ILE   7          HD11      ILE   7  15.481  -6.601  -2.573
   59   2HD1  ILE   7          HD12      ILE   7  15.155  -8.348  -2.566
   60   3HD1  ILE   7          HD13      ILE   7  13.842  -7.204  -2.864
   61    H    SER   8           H        SER   8  15.319  -7.875   4.046
   62    HA   SER   8           HA       SER   8  18.280  -7.911   4.420
   63   1HB   SER   8          HB2       SER   8  16.812  -6.196   5.663
   64   2HB   SER   8          HB3       SER   8  16.153  -7.571   6.563
   65    HG   SER   8           HG       SER   8  17.981  -6.575   7.590
   66    H    GLY   9           H        GLY   9  18.178  -9.322   6.822
   67   1HA   GLY   9          HA2       GLY   9  18.051 -11.401   7.742
   68   2HA   GLY   9          HA3       GLY   9  16.474 -11.548   6.949
   69    H    SER  10           H        SER  10  19.868 -11.422   5.717
   70    HA   SER  10           HA       SER  10  19.724 -13.129   3.611
   71   1HB   SER  10          HB2       SER  10  21.988 -12.841   5.638
   72   2HB   SER  10          HB3       SER  10  22.156 -13.374   3.952
   73    HG   SER  10           HG       SER  10  22.612 -11.170   4.207
   74    H    THR  11           H        THR  11  19.165 -15.202   3.346
   75    HA   THR  11           HA       THR  11  18.675 -17.342   3.665
   76    HB   THR  11           HB       THR  11  20.611 -17.407   5.981
   77    HG1  THR  11           HG1      THR  11  21.779 -16.985   4.244
   78   1HG2  THR  11          HG21      THR  11  19.213 -19.434   6.039
   79   2HG2  THR  11          HG22      THR  11  19.354 -19.619   4.279
   80   3HG2  THR  11          HG23      THR  11  20.777 -19.821   5.324
   81    H    LEU  12           H        LEU  12  16.848 -15.567   4.269
   82    HA   LEU  12           HA       LEU  12  14.849 -15.275   5.155
   83   1HB   LEU  12          HB2       LEU  12  14.950 -17.642   4.220
   84   2HB   LEU  12          HB3       LEU  12  14.951 -18.209   5.885
   85    HG   LEU  12           HG       LEU  12  12.713 -16.985   6.195
   86   1HD1  LEU  12          HD11      LEU  12  11.432 -16.460   4.148
   87   2HD1  LEU  12          HD12      LEU  12  12.825 -15.391   4.314
   88   3HD1  LEU  12          HD13      LEU  12  12.880 -16.736   3.159
   89   1HD2  LEU  12          HD21      LEU  12  12.860 -19.414   5.807
   90   2HD2  LEU  12          HD22      LEU  12  11.424 -18.726   5.037
   91   3HD2  LEU  12          HD23      LEU  12  12.844 -19.145   4.050
   92    H    GLY  13           H        GLY  13  16.807 -14.528   6.952
   93   1HA   GLY  13          HA2       GLY  13  15.275 -13.721   9.085
   94   2HA   GLY  13          HA3       GLY  13  16.023 -15.203   9.694
   95    H    GLY  14           H        GLY  14  16.496 -12.537  10.760
   96   1HA   GLY  14          HA2       GLY  14  19.212 -12.488  11.212
   97   2HA   GLY  14          HA3       GLY  14  18.997 -11.488   9.770
   98    H    ALA  15           H        ALA  15  19.890  -9.894  11.390
   99    HA   ALA  15           HA       ALA  15  18.155  -8.853  13.471
  100   1HB   ALA  15          HB1       ALA  15  20.586  -8.790  13.727
  101   2HB   ALA  15          HB2       ALA  15  20.744  -7.790  12.262
  102   3HB   ALA  15          HB3       ALA  15  19.930  -7.146  13.702
  103    H    GLU  16           H        GLU  16  16.336  -8.727  11.795
  104    HA   GLU  16           HA       GLU  16  16.129  -6.882   9.733
  105   1HB   GLU  16          HB2       GLU  16  14.057  -7.742  11.788
  106   2HB   GLU  16          HB3       GLU  16  13.667  -6.794  10.349
  107   1HG   GLU  16          HG2       GLU  16  14.446  -8.581   8.878
  108   2HG   GLU  16          HG3       GLU  16  14.945  -9.554  10.263
  109    H    TYR  17           H        TYR  17  16.268  -6.120  13.170
  110    HA   TYR  17           HA       TYR  17  15.119  -3.587  13.272
  111   1HB   TYR  17          HB2       TYR  17  15.926  -4.795  15.228
  112   2HB   TYR  17          HB3       TYR  17  17.590  -4.681  14.661
  113    HD1  TYR  17           HD1      TYR  17  18.948  -2.811  15.253
  114    HD2  TYR  17           HD2      TYR  17  14.665  -2.591  15.757
  115    HE1  TYR  17           HE1      TYR  17  19.202  -0.644  16.422
  116    HE2  TYR  17           HE2      TYR  17  14.909  -0.425  16.927
  117    HH   TYR  17           HH       TYR  17  16.388   1.209  17.686
  118    H    VAL  18           H        VAL  18  18.289  -4.461  11.773
  119    HA   VAL  18           HA       VAL  18  19.149  -1.685  11.747
  120    HB   VAL  18           HB       VAL  18  20.597  -3.795  11.760
  121   1HG1  VAL  18          HG11      VAL  18  21.330  -4.737   9.655
  122   2HG1  VAL  18          HG12      VAL  18  19.579  -4.921   9.747
  123   3HG1  VAL  18          HG13      VAL  18  20.286  -3.651   8.728
  124   1HG2  VAL  18          HG21      VAL  18  21.313  -1.602   9.787
  125   2HG2  VAL  18          HG22      VAL  18  21.458  -1.497  11.556
  126   3HG2  VAL  18          HG23      VAL  18  22.431  -2.674  10.672
  127    H    ALA  19           H        ALA  19  17.323  -3.818   9.647
  128    HA   ALA  19           HA       ALA  19  17.313  -1.985   7.365
  129   1HB   ALA  19          HB1       ALA  19  15.704  -4.499   7.957
  130   2HB   ALA  19          HB2       ALA  19  15.649  -3.567   6.447
  131   3HB   ALA  19          HB3       ALA  19  17.159  -4.354   6.941
  132    H    GLU  20           H        GLU  20  15.244  -2.700  10.209
  133    HA   GLU  20           HA       GLU  20  13.093  -0.988   9.439
  134   1HB   GLU  20          HB2       GLU  20  13.088  -2.756  11.263
  135   2HB   GLU  20          HB3       GLU  20  14.010  -1.639  12.272
  136   1HG   GLU  20          HG2       GLU  20  12.179   0.024  12.113
  137   2HG   GLU  20          HG3       GLU  20  11.282  -1.052  11.040
  138    H    HIS  21           H        HIS  21  16.121  -0.394  11.294
  139    HA   HIS  21           HA       HIS  21  15.732   2.365  11.843
  140   1HB   HIS  21          HB2       HIS  21  17.547   1.424  12.958
  141   2HB   HIS  21          HB3       HIS  21  18.106   0.532  11.551
  142    HD1  HIS  21           HD1      HIS  21  20.027   1.609  10.168
  143    HD2  HIS  21           HD2      HIS  21  18.003   4.265  12.730
  144    HE1  HIS  21           HE1      HIS  21  21.245   3.840   9.992
  145    H    LEU  22           H        LEU  22  17.308   0.762   9.019
  146    HA   LEU  22           HA       LEU  22  17.833   3.090   7.510
  147   1HB   LEU  22          HB2       LEU  22  17.292   0.188   6.859
  148   2HB   LEU  22          HB3       LEU  22  17.347   1.327   5.543
  149    HG   LEU  22           HG       LEU  22  19.606   1.083   7.580
  150   1HD1  LEU  22          HD11      LEU  22  19.332  -1.106   6.551
  151   2HD1  LEU  22          HD12      LEU  22  19.260  -0.382   4.928
  152   3HD1  LEU  22          HD13      LEU  22  20.763  -0.318   5.880
  153   1HD2  LEU  22          HD21      LEU  22  19.545   2.182   4.732
  154   2HD2  LEU  22          HD22      LEU  22  19.613   3.163   6.211
  155   3HD2  LEU  22          HD23      LEU  22  20.966   2.110   5.794
  156    H    ALA  23           H        ALA  23  14.974   0.962   7.389
  157    HA   ALA  23           HA       ALA  23  13.452   2.290   5.515
  158   1HB   ALA  23          HB1       ALA  23  12.544   0.796   8.007
  159   2HB   ALA  23          HB2       ALA  23  11.483   1.248   6.681
  160   3HB   ALA  23          HB3       ALA  23  12.820   0.120   6.389
  161    H    GLU  24           H        GLU  24  13.670   3.108   9.035
  162    HA   GLU  24           HA       GLU  24  11.653   5.070   9.083
  163   1HB   GLU  24          HB2       GLU  24  13.003   4.092  11.031
  164   2HB   GLU  24          HB3       GLU  24  14.306   5.172  10.594
  165   1HG   GLU  24          HG2       GLU  24  13.168   6.236  12.352
  166   2HG   GLU  24          HG3       GLU  24  12.753   7.131  10.900
  167    H    LYS  25           H        LYS  25  15.197   5.650   8.752
  168    HA   LYS  25           HA       LYS  25  15.200   8.286   8.000
  169   1HB   LYS  25          HB2       LYS  25  16.983   6.069   6.874
  170   2HB   LYS  25          HB3       LYS  25  17.362   7.758   6.999
  171   1HG   LYS  25          HG2       LYS  25  17.271   5.624   9.135
  172   2HG   LYS  25          HG3       LYS  25  18.532   6.774   8.775
  173   1HD   LYS  25          HD2       LYS  25  16.995   8.580   9.679
  174   2HD   LYS  25          HD3       LYS  25  15.881   7.350  10.188
  175   1HE   LYS  25          HE2       LYS  25  17.274   8.184  12.031
  176   2HE   LYS  25          HE3       LYS  25  17.306   6.436  11.814
  177   1HZ   LYS  25          HZ1       LYS  25  19.458   8.177  10.737
  178   2HZ   LYS  25          HZ2       LYS  25  19.490   7.539  12.246
  179   3HZ   LYS  25          HZ3       LYS  25  19.467   6.535  10.973
  180    H    LEU  26           H        LEU  26  14.870   5.500   5.855
  181    HA   LEU  26           HA       LEU  26  14.829   6.965   3.406
  182   1HB   LEU  26          HB2       LEU  26  13.745   4.235   4.176
  183   2HB   LEU  26          HB3       LEU  26  13.701   4.846   2.521
  184    HG   LEU  26           HG       LEU  26  16.283   4.559   4.114
  185   1HD1  LEU  26          HD11      LEU  26  15.199   2.364   3.787
  186   2HD1  LEU  26          HD12      LEU  26  15.096   2.680   2.037
  187   3HD1  LEU  26          HD13      LEU  26  16.681   2.526   2.839
  188   1HD2  LEU  26          HD21      LEU  26  15.693   5.089   1.182
  189   2HD2  LEU  26          HD22      LEU  26  16.525   6.171   2.322
  190   3HD2  LEU  26          HD23      LEU  26  17.295   4.665   1.832
  191    H    GLU  27           H        GLU  27  12.069   6.031   5.601
  192    HA   GLU  27           HA       GLU  27  10.160   7.043   3.699
  193   1HB   GLU  27          HB2       GLU  27  10.005   6.377   6.666
  194   2HB   GLU  27          HB3       GLU  27   8.657   7.005   5.713
  195   1HG   GLU  27          HG2       GLU  27   9.151   5.103   4.037
  196   2HG   GLU  27          HG3       GLU  27  10.138   4.405   5.295
  197    H    GLU  28           H        GLU  28  11.983   8.480   6.448
  198    HA   GLU  28           HA       GLU  28  10.783  11.062   6.250
  199   1HB   GLU  28          HB2       GLU  28  13.452  10.026   7.286
  200   2HB   GLU  28          HB3       GLU  28  13.000  11.716   7.370
  201   1HG   GLU  28          HG2       GLU  28  11.386   9.454   8.621
  202   2HG   GLU  28          HG3       GLU  28  12.583  10.419   9.471
  203    H    ALA  29           H        ALA  29  13.161   9.429   4.206
  204    HA   ALA  29           HA       ALA  29  14.092  11.835   2.897
  205   1HB   ALA  29          HB1       ALA  29  15.426   9.730   2.922
  206   2HB   ALA  29          HB2       ALA  29  14.207   8.964   1.879
  207   3HB   ALA  29          HB3       ALA  29  15.124  10.341   1.288
  208    H    GLY  30           H        GLY  30  11.066  10.215   2.790
  209   1HA   GLY  30          HA2       GLY  30   9.328  11.493   1.800
  210   2HA   GLY  30          HA3       GLY  30  10.354  11.867   0.417
  211    H    PHE  31           H        PHE  31  10.248   8.553   1.601
  212    HA   PHE  31           HA       PHE  31   8.456   7.790  -0.669
  213   1HB   PHE  31          HB2       PHE  31  10.744   6.018   0.133
  214   2HB   PHE  31          HB3       PHE  31   9.861   6.095  -1.369
  215    HD1  PHE  31           HD1      PHE  31  12.841   7.135   0.353
  216    HD2  PHE  31           HD2      PHE  31  10.210   8.176  -2.903
  217    HE1  PHE  31           HE1      PHE  31  14.623   8.537  -0.640
  218    HE2  PHE  31           HE2      PHE  31  12.004   9.572  -3.900
  219    HZ   PHE  31           HZ       PHE  31  14.217   9.750  -2.772
  220    H    THR  32           H        THR  32   8.162   5.121  -0.222
  221    HA   THR  32           HA       THR  32   7.568   4.740   2.653
  222    HB   THR  32           HB       THR  32   5.687   3.224   1.810
  223    HG1  THR  32           HG1      THR  32   4.748   3.978  -0.160
  224   1HG2  THR  32          HG21      THR  32   4.071   5.078   1.860
  225   2HG2  THR  32          HG22      THR  32   5.345   5.305   3.072
  226   3HG2  THR  32          HG23      THR  32   5.380   6.251   1.564
  227    H    THR  33           H        THR  33   7.978   2.607   3.378
  228    HA   THR  33           HA       THR  33   9.547   0.915   1.491
  229    HB   THR  33           HB       THR  33  11.328   0.835   3.137
  230    HG1  THR  33           HG1      THR  33  11.119   2.519   4.861
  231   1HG2  THR  33          HG21      THR  33  10.699   3.796   2.783
  232   2HG2  THR  33          HG22      THR  33  12.285   2.981   2.840
  233   3HG2  THR  33          HG23      THR  33  11.229   2.787   1.438
  234    H    GLU  34           H        GLU  34   9.827  -1.353   2.201
  235    HA   GLU  34           HA       GLU  34   8.015  -2.192   4.388
  236   1HB   GLU  34          HB2       GLU  34   7.875  -2.623   1.630
  237   2HB   GLU  34          HB3       GLU  34   8.468  -4.100   2.333
  238   1HG   GLU  34          HG2       GLU  34   6.145  -2.485   3.443
  239   2HG   GLU  34          HG3       GLU  34   5.970  -3.707   2.258
  240    H    THR  35           H        THR  35   9.344  -2.883   6.065
  241    HA   THR  35           HA       THR  35  12.108  -3.743   5.612
  242    HB   THR  35           HB       THR  35  10.447  -3.777   8.167
  243    HG1  THR  35           HG1      THR  35  10.670  -1.667   7.370
  244   1HG2  THR  35          HG21      THR  35  13.454  -3.845   7.662
  245   2HG2  THR  35          HG22      THR  35  12.671  -3.799   9.258
  246   3HG2  THR  35          HG23      THR  35  12.481  -5.218   8.222
  247    H    LEU  36           H        LEU  36  12.646  -5.815   5.139
  248    HA   LEU  36           HA       LEU  36  10.712  -8.021   5.737
  249   1HB   LEU  36          HB2       LEU  36  12.066  -7.263   3.114
  250   2HB   LEU  36          HB3       LEU  36  11.221  -8.770   3.354
  251    HG   LEU  36           HG       LEU  36   9.754  -6.152   3.806
  252   1HD1  LEU  36          HD11      LEU  36   9.073  -6.185   1.469
  253   2HD1  LEU  36          HD12      LEU  36  10.809  -5.905   1.674
  254   3HD1  LEU  36          HD13      LEU  36  10.237  -7.509   1.146
  255   1HD2  LEU  36          HD21      LEU  36   8.667  -8.297   4.491
  256   2HD2  LEU  36          HD22      LEU  36   7.805  -7.475   3.184
  257   3HD2  LEU  36          HD23      LEU  36   8.817  -8.878   2.813
  258    H    HIS  37           H        HIS  37  11.631 -10.124   5.634
  259    HA   HIS  37           HA       HIS  37  14.595 -10.295   5.694
  260   1HB   HIS  37          HB2       HIS  37  14.209 -12.446   6.954
  261   2HB   HIS  37          HB3       HIS  37  13.790 -10.972   7.806
  262    HD1  HIS  37           HD1      HIS  37  11.238 -10.599   8.427
  263    HD2  HIS  37           HD2      HIS  37  12.110 -14.090   6.232
  264    HE1  HIS  37           HE1      HIS  37   9.115 -12.038   8.471
  265    H    GLY  38           H        GLY  38  13.330  -9.994   3.280
  266   1HA   GLY  38          HA2       GLY  38  12.823 -10.865   1.242
  267   2HA   GLY  38          HA3       GLY  38  14.123 -12.005   1.596
  268    HA   PRO  39           HA       PRO  39  10.518 -14.604   3.155
  269   1HB   PRO  39          HB2       PRO  39   7.903 -13.748   3.233
  270   2HB   PRO  39          HB3       PRO  39   9.082 -13.477   4.553
  271   1HG   PRO  39          HG2       PRO  39   8.305 -11.572   2.324
  272   2HG   PRO  39          HG3       PRO  39   8.418 -11.234   4.082
  273   1HD   PRO  39          HD2       PRO  39  10.450 -10.624   2.371
  274   2HD   PRO  39          HD3       PRO  39  10.773 -11.242   4.026
  275    H    LEU  40           H        LEU  40   9.875 -12.579   0.331
  276    HA   LEU  40           HA       LEU  40   9.001 -14.942  -1.224
  277   1HB   LEU  40          HB2       LEU  40   8.223 -11.980  -1.263
  278   2HB   LEU  40          HB3       LEU  40   7.866 -13.073  -2.566
  279    HG   LEU  40           HG       LEU  40   6.815 -13.378   0.273
  280   1HD1  LEU  40          HD11      LEU  40   4.658 -12.677  -0.681
  281   2HD1  LEU  40          HD12      LEU  40   5.882 -11.419  -0.892
  282   3HD1  LEU  40          HD13      LEU  40   5.419 -12.441  -2.270
  283   1HD2  LEU  40          HD21      LEU  40   6.934 -15.577  -0.805
  284   2HD2  LEU  40          HD22      LEU  40   5.255 -15.048  -0.735
  285   3HD2  LEU  40          HD23      LEU  40   6.149 -14.938  -2.268
  286    H    LEU  41           H        LEU  41  11.710 -13.551  -0.519
  287    HA   LEU  41           HA       LEU  41  13.623 -12.853  -1.388
  288   1HB   LEU  41          HB2       LEU  41  12.869 -14.745  -3.132
  289   2HB   LEU  41          HB3       LEU  41  12.825 -13.376  -4.230
  290    HG   LEU  41           HG       LEU  41  15.191 -14.510  -2.704
  291   1HD1  LEU  41          HD11      LEU  41  16.047 -14.929  -4.991
  292   2HD1  LEU  41          HD12      LEU  41  14.469 -15.700  -4.734
  293   3HD1  LEU  41          HD13      LEU  41  14.581 -14.198  -5.674
  294   1HD2  LEU  41          HD21      LEU  41  16.655 -12.914  -3.935
  295   2HD2  LEU  41          HD22      LEU  41  15.209 -12.000  -4.420
  296   3HD2  LEU  41          HD23      LEU  41  15.662 -12.142  -2.701
  297    H    GLU  42           H        GLU  42  10.730 -11.642  -2.964
  298    HA   GLU  42           HA       GLU  42  11.736  -8.891  -3.244
  299   1HB   GLU  42          HB2       GLU  42  11.260  -8.921  -5.695
  300   2HB   GLU  42          HB3       GLU  42  12.672  -9.841  -5.215
  301   1HG   GLU  42          HG2       GLU  42  11.323 -11.964  -5.416
  302   2HG   GLU  42          HG3       GLU  42   9.986 -11.018  -6.052
  303    H    ASP  43           H        ASP  43  10.131  -8.391  -1.759
  304    HA   ASP  43           HA       ASP  43   7.367  -9.182  -2.078
  305   1HB   ASP  43          HB2       ASP  43   8.208  -8.378   0.070
  306   2HB   ASP  43          HB3       ASP  43   8.594  -6.805  -0.661
  307    H    LEU  44           H        LEU  44   9.308  -6.335  -3.157
  308    HA   LEU  44           HA       LEU  44   6.983  -5.386  -4.752
  309   1HB   LEU  44          HB2       LEU  44   9.786  -4.255  -4.504
  310   2HB   LEU  44          HB3       LEU  44   8.565  -3.572  -5.504
  311    HG   LEU  44           HG       LEU  44   8.423  -3.744  -2.477
  312   1HD1  LEU  44          HD11      LEU  44   8.618  -1.331  -2.559
  313   2HD1  LEU  44          HD12      LEU  44   9.954  -2.016  -3.509
  314   3HD1  LEU  44          HD13      LEU  44   8.550  -1.326  -4.333
  315   1HD2  LEU  44          HD21      LEU  44   6.144  -3.980  -3.291
  316   2HD2  LEU  44          HD22      LEU  44   6.367  -2.337  -2.699
  317   3HD2  LEU  44          HD23      LEU  44   6.373  -2.644  -4.448
  318    HA   PRO  45           HA       PRO  45   8.157  -7.670  -8.292
  319   1HB   PRO  45          HB2       PRO  45   7.549  -5.932 -10.401
  320   2HB   PRO  45          HB3       PRO  45   6.387  -6.847  -9.439
  321   1HG   PRO  45          HG2       PRO  45   7.318  -3.974  -9.115
  322   2HG   PRO  45          HG3       PRO  45   5.644  -4.589  -9.053
  323   1HD   PRO  45          HD2       PRO  45   7.090  -4.051  -6.803
  324   2HD   PRO  45          HD3       PRO  45   5.925  -5.407  -6.873
  325    H    ALA  46           H        ALA  46   9.185  -7.271 -10.560
  326    HA   ALA  46           HA       ALA  46  11.966  -6.547 -10.206
  327   1HB   ALA  46          HB1       ALA  46  11.278  -8.496 -11.586
  328   2HB   ALA  46          HB2       ALA  46  10.401  -7.408 -12.693
  329   3HB   ALA  46          HB3       ALA  46  12.166  -7.327 -12.576
  330    H    SER  47           H        SER  47  10.241  -4.319  -9.784
  331    HA   SER  47           HA       SER  47  11.123  -2.317 -11.639
  332   1HB   SER  47          HB2       SER  47   8.152  -2.757 -11.273
  333   2HB   SER  47          HB3       SER  47   8.918  -1.492 -12.239
  334    HG   SER  47           HG       SER  47   8.127  -3.234 -13.508
  335    H    GLY  48           H        GLY  48  11.349  -0.426 -10.373
  336   1HA   GLY  48          HA2       GLY  48  10.146   0.991  -8.601
  337   2HA   GLY  48          HA3       GLY  48  10.139  -0.475  -7.628
  338    H    ILE  49           H        ILE  49  11.474   0.184  -6.012
  339    HA   ILE  49           HA       ILE  49  14.346   0.578  -6.704
  340    HB   ILE  49           HB       ILE  49  12.973   1.447  -4.167
  341   1HG1  ILE  49          HG12      ILE  49  11.821   2.763  -5.863
  342   2HG1  ILE  49          HG13      ILE  49  12.821   3.748  -4.823
  343   1HG2  ILE  49          HG21      ILE  49  14.929   2.940  -3.907
  344   2HG2  ILE  49          HG22      ILE  49  15.405   1.239  -4.023
  345   3HG2  ILE  49          HG23      ILE  49  15.609   2.306  -5.415
  346   1HD1  ILE  49          HD11      ILE  49  14.453   4.097  -6.541
  347   2HD1  ILE  49          HD12      ILE  49  13.691   2.893  -7.610
  348   3HD1  ILE  49          HD13      ILE  49  12.859   4.412  -7.230
  349    H    TRP  50           H        TRP  50  15.698  -0.945  -5.731
  350    HA   TRP  50           HA       TRP  50  14.538  -2.844  -3.727
  351   1HB   TRP  50          HB2       TRP  50  16.260  -3.268  -6.187
  352   2HB   TRP  50          HB3       TRP  50  16.494  -4.283  -4.802
  353    HD1  TRP  50           HD1      TRP  50  12.897  -3.382  -5.868
  354    HE1  TRP  50           HE1      TRP  50  11.760  -5.400  -6.934
  355    HE3  TRP  50           HE3      TRP  50  16.891  -6.586  -5.910
  356    HZ2  TRP  50           HZ2      TRP  50  12.485  -8.098  -7.670
  357    HZ3  TRP  50           HZ3      TRP  50  16.631  -8.882  -6.805
  358    HH2  TRP  50           HH2      TRP  50  14.438  -9.650  -7.687
  359    H    LEU  51           H        LEU  51  15.768  -3.023  -1.879
  360    HA   LEU  51           HA       LEU  51  18.600  -2.110  -1.953
  361   1HB   LEU  51          HB2       LEU  51  16.508  -1.582   0.195
  362   2HB   LEU  51          HB3       LEU  51  18.238  -1.466   0.475
  363    HG   LEU  51           HG       LEU  51  16.623   0.298  -1.429
  364   1HD1  LEU  51          HD11      LEU  51  17.118   2.059   0.185
  365   2HD1  LEU  51          HD12      LEU  51  16.301   0.718   1.002
  366   3HD1  LEU  51          HD13      LEU  51  18.048   0.934   1.194
  367   1HD2  LEU  51          HD21      LEU  51  19.613   0.174  -0.823
  368   2HD2  LEU  51          HD22      LEU  51  18.798   0.109  -2.402
  369   3HD2  LEU  51          HD23      LEU  51  18.827   1.614  -1.487
  370    H    VAL  52           H        VAL  52  19.913  -3.674  -1.128
  371    HA   VAL  52           HA       VAL  52  18.557  -5.929   0.301
  372    HB   VAL  52           HB       VAL  52  20.780  -6.440  -1.676
  373   1HG1  VAL  52          HG11      VAL  52  20.247  -8.166   0.067
  374   2HG1  VAL  52          HG12      VAL  52  18.595  -8.247  -0.552
  375   3HG1  VAL  52          HG13      VAL  52  19.960  -8.729  -1.580
  376   1HG2  VAL  52          HG21      VAL  52  19.066  -7.223  -3.296
  377   2HG2  VAL  52          HG22      VAL  52  17.783  -6.589  -2.246
  378   3HG2  VAL  52          HG23      VAL  52  18.926  -5.487  -3.030
  379    H    ILE  53           H        ILE  53  19.445  -6.525   2.120
  380    HA   ILE  53           HA       ILE  53  22.052  -5.379   2.945
  381    HB   ILE  53           HB       ILE  53  19.793  -6.235   4.803
  382   1HG1  ILE  53          HG12      ILE  53  19.441  -3.767   5.258
  383   2HG1  ILE  53          HG13      ILE  53  20.287  -3.414   3.764
  384   1HG2  ILE  53          HG21      ILE  53  22.091  -6.098   5.750
  385   2HG2  ILE  53          HG22      ILE  53  22.222  -4.425   5.186
  386   3HG2  ILE  53          HG23      ILE  53  21.040  -4.868   6.441
  387   1HD1  ILE  53          HD11      ILE  53  17.759  -3.340   3.710
  388   2HD1  ILE  53          HD12      ILE  53  18.459  -4.360   2.462
  389   3HD1  ILE  53          HD13      ILE  53  17.749  -5.095   3.921
  390    H    SER  54           H        SER  54  22.586  -7.205   1.452
  391    HA   SER  54           HA       SER  54  22.273  -9.883   2.276
  392   1HB   SER  54          HB2       SER  54  24.584  -8.880   0.612
  393   2HB   SER  54          HB3       SER  54  23.687 -10.393   0.464
  394    HG   SER  54           HG       SER  54  23.078  -8.876  -1.141
  395    H    SER  55           H        SER  55  24.616  -7.425   3.174
  396    HA   SER  55           HA       SER  55  26.790  -7.575   3.854
  397   1HB   SER  55          HB2       SER  55  25.247  -8.613   6.238
  398   2HB   SER  55          HB3       SER  55  26.746  -7.641   6.262
  399    HG   SER  55           HG       SER  55  24.807  -6.401   6.557
  400    H    THR  56           H        THR  56  27.086  -9.367   2.254
  401    HA   THR  56           HA       THR  56  27.068 -12.012   2.662
  402    HB   THR  56           HB       THR  56  28.901 -12.003   0.822
  403    HG1  THR  56           HG1      THR  56  29.646 -10.178   0.198
  404   1HG2  THR  56          HG21      THR  56  26.489 -10.180   0.450
  405   2HG2  THR  56          HG22      THR  56  27.444 -10.953  -0.826
  406   3HG2  THR  56          HG23      THR  56  26.487 -11.949   0.286
  407    H    HIS  57           H        HIS  57  29.845 -10.042   3.718
  408    HA   HIS  57           HA       HIS  57  30.237 -12.166   5.701
  409   1HB   HIS  57          HB2       HIS  57  32.525 -12.506   5.425
  410   2HB   HIS  57          HB3       HIS  57  31.792 -12.712   3.843
  411    HD1  HIS  57           HD1      HIS  57  34.294 -10.552   5.685
  412    HD2  HIS  57           HD2      HIS  57  32.370 -10.818   1.950
  413    HE1  HIS  57           HE1      HIS  57  35.595  -9.042   4.098
  414    H    GLY  58           H        GLY  58  29.214  -9.342   5.486
  415   1HA   GLY  58          HA2       GLY  58  30.821  -7.976   7.572
  416   2HA   GLY  58          HA3       GLY  58  29.415  -7.329   6.703
  417    H    ALA  59           H        ALA  59  27.932  -9.883   7.031
  418    HA   ALA  59           HA       ALA  59  27.710 -10.546   9.831
  419   1HB   ALA  59          HB1       ALA  59  25.298  -9.361   8.367
  420   2HB   ALA  59          HB2       ALA  59  25.285 -10.121   9.970
  421   3HB   ALA  59          HB3       ALA  59  26.159  -8.599   9.725
  422    H    GLY  60           H        GLY  60  28.866 -12.068   8.147
  423   1HA   GLY  60          HA2       GLY  60  27.129 -14.191   7.227
  424   2HA   GLY  60          HA3       GLY  60  27.697 -13.171   5.925
  425    H    ASP  61           H        ASP  61  29.073 -14.612   4.972
  426    HA   ASP  61           HA       ASP  61  31.632 -15.171   6.244
  427   1HB   ASP  61          HB2       ASP  61  30.276 -17.082   7.051
  428   2HB   ASP  61          HB3       ASP  61  29.835 -17.476   5.389
  429    H    ILE  62           H        ILE  62  29.465 -15.430   3.402
  430    HA   ILE  62           HA       ILE  62  31.607 -15.064   1.488
  431    HB   ILE  62           HB       ILE  62  30.780 -17.162   0.213
  432   1HG1  ILE  62          HG12      ILE  62  29.914 -18.122   2.964
  433   2HG1  ILE  62          HG13      ILE  62  28.816 -17.634   1.674
  434   1HG2  ILE  62          HG21      ILE  62  33.041 -16.887   1.279
  435   2HG2  ILE  62          HG22      ILE  62  32.420 -17.802   2.669
  436   3HG2  ILE  62          HG23      ILE  62  32.495 -18.550   1.065
  437   1HD1  ILE  62          HD11      ILE  62  28.995 -20.043   1.693
  438   2HD1  ILE  62          HD12      ILE  62  29.785 -19.441   0.220
  439   3HD1  ILE  62          HD13      ILE  62  30.760 -19.981   1.610
  440    HA   PRO  63           HA       PRO  63  28.307 -13.210  -0.925
  441   1HB   PRO  63          HB2       PRO  63  28.863 -15.291  -3.040
  442   2HB   PRO  63          HB3       PRO  63  28.538 -13.540  -3.243
  443   1HG   PRO  63          HG2       PRO  63  31.080 -14.467  -3.287
  444   2HG   PRO  63          HG3       PRO  63  30.694 -12.965  -2.386
  445   1HD   PRO  63          HD2       PRO  63  31.160 -15.742  -1.338
  446   2HD   PRO  63          HD3       PRO  63  31.654 -14.177  -0.632
  447    H    ASP  64           H        ASP  64  28.223 -16.738  -0.570
  448    HA   ASP  64           HA       ASP  64  25.433 -17.048  -1.246
  449   1HB   ASP  64          HB2       ASP  64  27.294 -18.748  -1.522
  450   2HB   ASP  64          HB3       ASP  64  27.283 -18.945   0.230
  451    H    ASN  65           H        ASN  65  26.570 -15.408   1.343
  452    HA   ASN  65           HA       ASN  65  25.548 -16.449   3.691
  453   1HB   ASN  65          HB2       ASN  65  26.851 -14.368   3.476
  454   2HB   ASN  65          HB3       ASN  65  25.416 -13.562   2.820
  455   1HD2  ASN  65          HD22      ASN  65  24.986 -12.053   4.543
  456   2HD2  ASN  65          HD21      ASN  65  24.916 -12.551   6.217
  457    H    LEU  66           H        LEU  66  23.737 -15.109   1.049
  458    HA   LEU  66           HA       LEU  66  21.171 -15.559   2.448
  459   1HB   LEU  66          HB2       LEU  66  20.084 -14.063   0.955
  460   2HB   LEU  66          HB3       LEU  66  21.310 -13.225   1.861
  461    HG   LEU  66           HG       LEU  66  21.429 -13.886  -1.108
  462   1HD1  LEU  66          HD11      LEU  66  21.349 -11.439  -1.336
  463   2HD1  LEU  66          HD12      LEU  66  19.919 -12.054  -0.509
  464   3HD1  LEU  66          HD13      LEU  66  21.208 -11.266   0.424
  465   1HD2  LEU  66          HD21      LEU  66  23.701 -14.009  -0.429
  466   2HD2  LEU  66          HD22      LEU  66  23.497 -12.364  -0.996
  467   3HD2  LEU  66          HD23      LEU  66  23.521 -12.676   0.747
  468    H    SER  67           H        SER  67  21.154 -17.762   2.105
  469    HA   SER  67           HA       SER  67  22.528 -18.834  -0.221
  470   1HB   SER  67          HB2       SER  67  21.026 -20.199   2.045
  471   2HB   SER  67          HB3       SER  67  22.053 -20.996   0.835
  472    HG   SER  67           HG       SER  67  23.537 -19.102   1.798
  473    HA   PRO  68           HA       PRO  68  18.220 -20.439  -1.470
  474   1HB   PRO  68          HB2       PRO  68  15.948 -19.209  -0.478
  475   2HB   PRO  68          HB3       PRO  68  16.726 -20.639   0.249
  476   1HG   PRO  68          HG2       PRO  68  16.995 -17.774   1.125
  477   2HG   PRO  68          HG3       PRO  68  16.770 -19.225   2.141
  478   1HD   PRO  68          HD2       PRO  68  19.175 -18.092   1.734
  479   2HD   PRO  68          HD3       PRO  68  18.994 -19.851   1.943
  480    H    PHE  69           H        PHE  69  18.437 -17.048  -0.509
  481    HA   PHE  69           HA       PHE  69  16.994 -15.975  -2.714
  482   1HB   PHE  69          HB2       PHE  69  19.101 -14.703  -0.943
  483   2HB   PHE  69          HB3       PHE  69  17.977 -13.850  -1.957
  484    HD1  PHE  69           HD1      PHE  69  18.160 -13.000   0.771
  485    HD2  PHE  69           HD2      PHE  69  15.747 -16.205  -0.847
  486    HE1  PHE  69           HE1      PHE  69  16.713 -12.940   2.777
  487    HE2  PHE  69           HE2      PHE  69  14.314 -16.115   1.146
  488    HZ   PHE  69           HZ       PHE  69  14.802 -14.521   2.972
  489    H    TYR  70           H        TYR  70  20.588 -16.196  -2.170
  490    HA   TYR  70           HA       TYR  70  21.209 -15.064  -4.676
  491   1HB   TYR  70          HB2       TYR  70  22.783 -15.189  -2.803
  492   2HB   TYR  70          HB3       TYR  70  22.870 -16.934  -3.000
  493    HD1  TYR  70           HD1      TYR  70  23.009 -14.121  -5.543
  494    HD2  TYR  70           HD2      TYR  70  25.074 -17.415  -3.664
  495    HE1  TYR  70           HE1      TYR  70  24.965 -13.701  -6.977
  496    HE2  TYR  70           HE2      TYR  70  27.037 -17.008  -5.116
  497    HH   TYR  70           HH       TYR  70  27.166 -14.277  -7.452
  498    H    GLU  71           H        GLU  71  20.967 -18.621  -3.766
  499    HA   GLU  71           HA       GLU  71  21.589 -19.497  -6.374
  500   1HB   GLU  71          HB2       GLU  71  19.822 -20.810  -4.262
  501   2HB   GLU  71          HB3       GLU  71  20.425 -21.587  -5.735
  502   1HG   GLU  71          HG2       GLU  71  22.769 -20.792  -4.879
  503   2HG   GLU  71          HG3       GLU  71  22.004 -20.647  -3.324
  504    H    ALA  72           H        ALA  72  18.404 -18.514  -4.980
  505    HA   ALA  72           HA       ALA  72  16.923 -19.215  -7.339
  506   1HB   ALA  72          HB1       ALA  72  16.352 -17.218  -5.121
  507   2HB   ALA  72          HB2       ALA  72  15.193 -17.679  -6.389
  508   3HB   ALA  72          HB3       ALA  72  15.776 -18.894  -5.230
  509    H    LEU  73           H        LEU  73  18.639 -16.166  -6.377
  510    HA   LEU  73           HA       LEU  73  17.732 -14.529  -8.477
  511   1HB   LEU  73          HB2       LEU  73  20.298 -14.685  -6.868
  512   2HB   LEU  73          HB3       LEU  73  20.245 -13.644  -8.244
  513    HG   LEU  73           HG       LEU  73  18.395 -13.545  -5.828
  514   1HD1  LEU  73          HD11      LEU  73  20.698 -12.855  -5.313
  515   2HD1  LEU  73          HD12      LEU  73  20.673 -11.697  -6.659
  516   3HD1  LEU  73          HD13      LEU  73  19.608 -11.468  -5.253
  517   1HD2  LEU  73          HD21      LEU  73  17.145 -12.632  -7.713
  518   2HD2  LEU  73          HD22      LEU  73  17.692 -11.293  -6.719
  519   3HD2  LEU  73          HD23      LEU  73  18.547 -11.672  -8.232
  520    H    GLN  74           H        GLN  74  20.618 -16.641  -8.392
  521    HA   GLN  74           HA       GLN  74  21.179 -16.164 -11.165
  522   1HB   GLN  74          HB2       GLN  74  22.199 -18.737  -9.973
  523   2HB   GLN  74          HB3       GLN  74  22.902 -17.621 -11.106
  524   1HG   GLN  74          HG2       GLN  74  23.020 -15.979  -9.065
  525   2HG   GLN  74          HG3       GLN  74  22.670 -17.429  -8.105
  526   1HE2  GLN  74          HE22      GLN  74  24.810 -16.439 -10.803
  527   2HE2  GLN  74          HE21      GLN  74  26.207 -17.344 -10.238
  528    H    GLU  75           H        GLU  75  18.881 -18.335  -9.694
  529    HA   GLU  75           HA       GLU  75  18.694 -20.053 -11.991
  530   1HB   GLU  75          HB2       GLU  75  18.075 -20.721  -9.669
  531   2HB   GLU  75          HB3       GLU  75  16.684 -19.638  -9.769
  532   1HG   GLU  75          HG2       GLU  75  15.769 -20.942 -11.648
  533   2HG   GLU  75          HG3       GLU  75  17.201 -21.975 -11.649
  534    H    GLN  76           H        GLN  76  16.830 -17.175 -10.851
  535    HA   GLN  76           HA       GLN  76  15.153 -17.400 -13.291
  536   1HB   GLN  76          HB2       GLN  76  13.797 -15.570 -12.199
  537   2HB   GLN  76          HB3       GLN  76  13.714 -17.190 -11.527
  538   1HG   GLN  76          HG2       GLN  76  14.759 -16.637  -9.567
  539   2HG   GLN  76          HG3       GLN  76  15.680 -15.303 -10.271
  540   1HE2  GLN  76          HE22      GLN  76  14.977 -14.236  -8.204
  541   2HE2  GLN  76          HE21      GLN  76  13.471 -13.336  -8.248
  542    H    LYS  77           H        LYS  77  17.637 -15.292 -11.979
  543    HA   LYS  77           HA       LYS  77  18.236 -13.151 -12.461
  544   1HB   LYS  77          HB2       LYS  77  18.681 -14.642 -15.040
  545   2HB   LYS  77          HB3       LYS  77  19.392 -13.060 -14.680
  546   1HG   LYS  77          HG2       LYS  77  20.500 -13.959 -12.720
  547   2HG   LYS  77          HG3       LYS  77  19.780 -15.548 -12.968
  548   1HD   LYS  77          HD2       LYS  77  21.655 -14.244 -14.965
  549   2HD   LYS  77          HD3       LYS  77  22.179 -15.340 -13.667
  550   1HE   LYS  77          HE2       LYS  77  20.677 -17.081 -14.586
  551   2HE   LYS  77          HE3       LYS  77  20.197 -16.001 -15.900
  552   1HZ   LYS  77          HZ1       LYS  77  22.947 -17.014 -15.436
  553   2HZ   LYS  77          HZ2       LYS  77  21.931 -17.527 -16.598
  554   3HZ   LYS  77          HZ3       LYS  77  22.510 -16.007 -16.651
  555    HA   PRO  78           HA       PRO  78  14.144 -12.107 -14.380
  556   1HB   PRO  78          HB2       PRO  78  13.264 -10.267 -12.467
  557   2HB   PRO  78          HB3       PRO  78  12.948 -12.013 -12.479
  558   1HG   PRO  78          HG2       PRO  78  15.066 -10.479 -10.978
  559   2HG   PRO  78          HG3       PRO  78  14.064 -11.831 -10.383
  560   1HD   PRO  78          HD2       PRO  78  16.652 -12.182 -11.201
  561   2HD   PRO  78          HD3       PRO  78  15.403 -13.416 -11.498
  562    H    ASP  79           H        ASP  79  13.171 -10.092 -15.069
  563    HA   ASP  79           HA       ASP  79  15.195  -8.461 -16.372
  564   1HB   ASP  79          HB2       ASP  79  13.271  -9.334 -17.611
  565   2HB   ASP  79          HB3       ASP  79  12.162  -8.433 -16.571
  566    H    LEU  80           H        LEU  80  15.890  -7.739 -14.182
  567    HA   LEU  80           HA       LEU  80  14.388  -5.708 -12.798
  568   1HB   LEU  80          HB2       LEU  80  17.244  -6.670 -12.746
  569   2HB   LEU  80          HB3       LEU  80  16.788  -5.306 -11.814
  570    HG   LEU  80           HG       LEU  80  16.122  -6.410 -10.096
  571   1HD1  LEU  80          HD11      LEU  80  14.422  -8.229 -11.823
  572   2HD1  LEU  80          HD12      LEU  80  14.426  -8.175 -10.044
  573   3HD1  LEU  80          HD13      LEU  80  13.923  -6.757 -10.948
  574   1HD2  LEU  80          HD21      LEU  80  18.035  -7.834 -10.712
  575   2HD2  LEU  80          HD22      LEU  80  16.802  -8.712  -9.796
  576   3HD2  LEU  80          HD23      LEU  80  16.914  -8.941 -11.552
  577    H    SER  81           H        SER  81  15.427  -5.296 -15.843
  578    HA   SER  81           HA       SER  81  17.020  -3.045 -15.969
  579   1HB   SER  81          HB2       SER  81  14.787  -3.968 -17.824
  580   2HB   SER  81          HB3       SER  81  16.323  -3.206 -18.222
  581    HG   SER  81           HG       SER  81  15.701  -5.795 -17.984
  582    H    ALA  82           H        ALA  82  13.969  -3.334 -14.601
  583    HA   ALA  82           HA       ALA  82  13.192  -0.508 -15.174
  584   1HB   ALA  82          HB1       ALA  82  11.547  -2.145 -16.018
  585   2HB   ALA  82          HB2       ALA  82  11.422  -2.861 -14.395
  586   3HB   ALA  82          HB3       ALA  82  10.884  -1.194 -14.678
  587    H    VAL  83           H        VAL  83  14.895  -2.227 -12.926
  588    HA   VAL  83           HA       VAL  83  13.927  -0.374 -10.817
  589    HB   VAL  83           HB       VAL  83  12.954  -2.346 -10.136
  590   1HG1  VAL  83          HG11      VAL  83  14.049  -4.544  -9.912
  591   2HG1  VAL  83          HG12      VAL  83  13.999  -3.984 -11.584
  592   3HG1  VAL  83          HG13      VAL  83  15.515  -3.867 -10.661
  593   1HG2  VAL  83          HG21      VAL  83  13.904  -3.010  -8.100
  594   2HG2  VAL  83          HG22      VAL  83  15.547  -2.577  -8.588
  595   3HG2  VAL  83          HG23      VAL  83  14.341  -1.321  -8.269
  596    H    ARG  84           H        ARG  84  15.413   0.268  -9.229
  597    HA   ARG  84           HA       ARG  84  18.273   0.020 -10.065
  598   1HB   ARG  84          HB2       ARG  84  18.724   1.996  -8.737
  599   2HB   ARG  84          HB3       ARG  84  17.719   2.343 -10.134
  600   1HG   ARG  84          HG2       ARG  84  15.928   3.021  -8.914
  601   2HG   ARG  84          HG3       ARG  84  16.181   1.859  -7.624
  602   1HD   ARG  84          HD2       ARG  84  16.522   4.345  -7.009
  603   2HD   ARG  84          HD3       ARG  84  17.742   3.184  -6.502
  604    HE   ARG  84           HE       ARG  84  19.300   4.141  -7.792
  605   1HH1  ARG  84          HH11      ARG  84  16.176   5.481  -8.898
  606   2HH1  ARG  84          HH12      ARG  84  16.874   6.410 -10.167
  607   1HH2  ARG  84          HH21      ARG  84  20.159   5.186  -9.572
  608   2HH2  ARG  84          HH22      ARG  84  19.241   6.330 -10.514
  609    H    PHE  85           H        PHE  85  19.779  -0.275  -8.378
  610    HA   PHE  85           HA       PHE  85  18.670  -1.816  -6.061
  611   1HB   PHE  85          HB2       PHE  85  19.411  -3.414  -7.591
  612   2HB   PHE  85          HB3       PHE  85  20.763  -2.431  -8.144
  613    HD1  PHE  85           HD1      PHE  85  19.671  -3.765  -4.762
  614    HD2  PHE  85           HD2      PHE  85  22.781  -3.473  -7.744
  615    HE1  PHE  85           HE1      PHE  85  21.231  -4.996  -3.283
  616    HE2  PHE  85           HE2      PHE  85  24.303  -4.759  -6.276
  617    HZ   PHE  85           HZ       PHE  85  23.518  -5.548  -4.047
  618    H    GLY  86           H        GLY  86  19.853  -1.564  -4.105
  619   1HA   GLY  86          HA2       GLY  86  22.307   0.097  -4.168
  620   2HA   GLY  86          HA3       GLY  86  21.022   0.480  -3.018
  621    H    ALA  87           H        ALA  87  23.822  -1.241  -3.354
  622    HA   ALA  87           HA       ALA  87  23.152  -3.698  -1.876
  623   1HB   ALA  87          HB1       ALA  87  24.968  -3.749  -3.568
  624   2HB   ALA  87          HB2       ALA  87  25.794  -2.414  -2.748
  625   3HB   ALA  87          HB3       ALA  87  25.648  -3.978  -1.953
  626    H    ILE  88           H        ILE  88  23.629  -3.980   0.365
  627    HA   ILE  88           HA       ILE  88  24.697  -1.621   1.831
  628    HB   ILE  88           HB       ILE  88  22.186  -3.177   2.553
  629   1HG1  ILE  88          HG12      ILE  88  22.522  -0.453   1.266
  630   2HG1  ILE  88          HG13      ILE  88  21.584  -1.824   0.695
  631   1HG2  ILE  88          HG21      ILE  88  23.394  -0.711   3.872
  632   2HG2  ILE  88          HG22      ILE  88  21.953  -1.610   4.396
  633   3HG2  ILE  88          HG23      ILE  88  23.526  -2.365   4.493
  634   1HD1  ILE  88          HD11      ILE  88  19.968  -1.492   2.553
  635   2HD1  ILE  88          HD12      ILE  88  20.889  -0.047   3.059
  636   3HD1  ILE  88          HD13      ILE  88  20.115  -0.092   1.478
  637    H    GLY  89           H        GLY  89  26.346  -2.260   3.022
  638   1HA   GLY  89          HA2       GLY  89  27.562  -3.352   4.651
  639   2HA   GLY  89          HA3       GLY  89  26.203  -4.457   4.896
  640    H    ILE  90           H        ILE  90  26.844  -4.620   1.664
  641    HA   ILE  90           HA       ILE  90  27.727  -7.284   1.764
  642    HB   ILE  90           HB       ILE  90  27.763  -5.325  -0.568
  643   1HG1  ILE  90          HG12      ILE  90  25.577  -6.906   0.765
  644   2HG1  ILE  90          HG13      ILE  90  25.576  -5.250   0.190
  645   1HG2  ILE  90          HG21      ILE  90  27.649  -8.359  -0.609
  646   2HG2  ILE  90          HG22      ILE  90  27.664  -7.262  -2.010
  647   3HG2  ILE  90          HG23      ILE  90  29.079  -7.364  -0.985
  648   1HD1  ILE  90          HD11      ILE  90  24.099  -6.469  -1.209
  649   2HD1  ILE  90          HD12      ILE  90  25.550  -6.179  -2.187
  650   3HD1  ILE  90          HD13      ILE  90  25.278  -7.771  -1.453
  651    H    GLY  91           H        GLY  91  29.668  -8.086   2.226
  652   1HA   GLY  91          HA2       GLY  91  32.011  -6.386   2.532
  653   2HA   GLY  91          HA3       GLY  91  31.913  -8.131   2.784
  654    H    SER  92           H        SER  92  30.718  -8.666   0.230
  655    HA   SER  92           HA       SER  92  32.791  -8.906  -1.687
  656   1HB   SER  92          HB2       SER  92  29.830  -9.159  -2.166
  657   2HB   SER  92          HB3       SER  92  31.147 -10.004  -2.974
  658    HG   SER  92           HG       SER  92  31.592 -11.079  -0.993
  659    H    ARG  93           H        ARG  93  33.078  -6.406  -1.151
  660    HA   ARG  93           HA       ARG  93  32.343  -5.031  -3.631
  661   1HB   ARG  93          HB2       ARG  93  30.851  -3.908  -2.193
  662   2HB   ARG  93          HB3       ARG  93  31.938  -4.032  -0.818
  663   1HG   ARG  93          HG2       ARG  93  31.818  -1.748  -1.365
  664   2HG   ARG  93          HG3       ARG  93  33.411  -2.293  -1.774
  665   1HD   ARG  93          HD2       ARG  93  31.215  -1.274  -3.531
  666   2HD   ARG  93          HD3       ARG  93  32.921  -0.892  -3.542
  667    HE   ARG  93           HE       ARG  93  33.401  -2.974  -4.678
  668   1HH1  ARG  93          HH12      ARG  93  29.945  -2.221  -4.456
  669   2HH1  ARG  93          HH11      ARG  93  29.459  -3.395  -5.592
  670   1HH2  ARG  93          HH21      ARG  93  32.684  -4.736  -6.039
  671   2HH2  ARG  93          HH22      ARG  93  31.070  -4.742  -6.660
  672    H    GLU  94           H        GLU  94  34.439  -5.188  -0.798
  673    HA   GLU  94           HA       GLU  94  36.823  -4.806  -2.474
  674   1HB   GLU  94          HB2       GLU  94  36.001  -2.878  -0.308
  675   2HB   GLU  94          HB3       GLU  94  37.689  -3.088  -0.725
  676   1HG   GLU  94          HG2       GLU  94  35.510  -2.035  -2.561
  677   2HG   GLU  94          HG3       GLU  94  36.779  -1.114  -1.787
  678    H    TYR  95           H        TYR  95  35.406  -5.369   0.708
  679    HA   TYR  95           HA       TYR  95  37.773  -6.130   2.029
  680   1HB   TYR  95          HB2       TYR  95  34.917  -6.920   2.706
  681   2HB   TYR  95          HB3       TYR  95  36.275  -6.778   3.806
  682    HD1  TYR  95           HD1      TYR  95  37.210  -4.478   4.363
  683    HD2  TYR  95           HD2      TYR  95  33.570  -5.004   2.110
  684    HE1  TYR  95           HE1      TYR  95  36.540  -2.159   4.903
  685    HE2  TYR  95           HE2      TYR  95  32.879  -2.699   2.664
  686    HH   TYR  95           HH       TYR  95  34.897  -0.534   4.705
  687    H    ASP  96           H        ASP  96  35.659  -7.950  -0.055
  688    HA   ASP  96           HA       ASP  96  36.161 -10.521   1.070
  689   1HB   ASP  96          HB2       ASP  96  34.136  -9.528  -0.187
  690   2HB   ASP  96          HB3       ASP  96  34.946 -10.057  -1.657
  691    H    THR  97           H        THR  97  38.651  -9.282   0.269
  692    HA   THR  97           HA       THR  97  39.635 -10.623  -2.078
  693    HB   THR  97           HB       THR  97  41.877  -9.703  -1.022
  694    HG1  THR  97           HG1      THR  97  41.581  -8.187   0.554
  695   1HG2  THR  97          HG21      THR  97  40.749  -8.650  -2.935
  696   2HG2  THR  97          HG22      THR  97  39.626  -7.818  -1.843
  697   3HG2  THR  97          HG23      THR  97  41.358  -7.419  -1.819
  698    H    PHE  98           H        PHE  98  38.576 -12.067   0.393
  699    HA   PHE  98           HA       PHE  98  40.654 -13.896   1.271
  700   1HB   PHE  98          HB2       PHE  98  38.575 -13.559   2.542
  701   2HB   PHE  98          HB3       PHE  98  37.616 -14.131   1.182
  702    HD1  PHE  98           HD1      PHE  98  37.164 -16.466   0.901
  703    HD2  PHE  98           HD2      PHE  98  40.221 -15.188   3.668
  704    HE1  PHE  98           HE1      PHE  98  37.359 -18.784   1.760
  705    HE2  PHE  98           HE2      PHE  98  40.411 -17.511   4.524
  706    HZ   PHE  98           HZ       PHE  98  38.981 -19.313   3.572
  707    H    CYS  99           H        CYS  99  38.227 -13.831  -1.363
  708    HA   CYS  99           HA       CYS  99  39.856 -15.761  -2.896
  709   1HB   CYS  99          HB2       CYS  99  37.714 -16.955  -3.543
  710   2HB   CYS  99          HB3       CYS  99  38.236 -17.194  -1.873
  711    HG   CYS  99           HG       CYS  99  35.635 -17.051  -1.952
  712    H    GLY 100           H        GLY 100  39.276 -12.805  -2.915
  713   1HA   GLY 100          HA2       GLY 100  39.047 -11.140  -4.462
  714   2HA   GLY 100          HA3       GLY 100  39.272 -12.378  -5.707
  715    H    ALA 101           H        ALA 101  36.563 -12.427  -3.381
  716    HA   ALA 101           HA       ALA 101  34.728 -12.645  -5.661
  717   1HB   ALA 101          HB1       ALA 101  33.124 -13.362  -3.871
  718   2HB   ALA 101          HB2       ALA 101  34.610 -14.324  -3.921
  719   3HB   ALA 101          HB3       ALA 101  34.394 -13.083  -2.669
  720    H    ILE 102           H        ILE 102  35.903 -10.010  -4.881
  721    HA   ILE 102           HA       ILE 102  34.240  -8.388  -3.368
  722    HB   ILE 102           HB       ILE 102  35.654  -6.567  -4.217
  723   1HG1  ILE 102          HG12      ILE 102  36.888  -8.621  -6.107
  724   2HG1  ILE 102          HG13      ILE 102  35.793  -7.328  -6.600
  725   1HG2  ILE 102          HG21      ILE 102  37.722  -7.365  -3.289
  726   2HG2  ILE 102          HG22      ILE 102  36.397  -8.108  -2.405
  727   3HG2  ILE 102          HG23      ILE 102  37.300  -9.058  -3.604
  728   1HD1  ILE 102          HD11      ILE 102  38.563  -6.973  -5.391
  729   2HD1  ILE 102          HD12      ILE 102  38.051  -6.634  -7.051
  730   3HD1  ILE 102          HD13      ILE 102  37.422  -5.643  -5.719
  731    H    ASP 103           H        ASP 103  32.777  -9.627  -5.800
  732    HA   ASP 103           HA       ASP 103  30.917  -7.458  -5.947
  733   1HB   ASP 103          HB2       ASP 103  32.633  -6.869  -7.799
  734   2HB   ASP 103          HB3       ASP 103  32.050  -8.291  -8.650
  735    H    LYS 104           H        LYS 104  31.469 -10.748  -5.784
  736    HA   LYS 104           HA       LYS 104  30.012 -11.814  -7.970
  737   1HB   LYS 104          HB2       LYS 104  30.730 -12.989  -5.267
  738   2HB   LYS 104          HB3       LYS 104  29.867 -13.896  -6.515
  739   1HG   LYS 104          HG2       LYS 104  31.742 -13.342  -8.087
  740   2HG   LYS 104          HG3       LYS 104  32.647 -12.679  -6.721
  741   1HD   LYS 104          HD2       LYS 104  32.507 -14.916  -5.592
  742   2HD   LYS 104          HD3       LYS 104  31.607 -15.543  -6.984
  743   1HE   LYS 104          HE2       LYS 104  33.537 -15.006  -8.468
  744   2HE   LYS 104          HE3       LYS 104  34.451 -14.430  -7.070
  745   1HZ   LYS 104          HZ1       LYS 104  34.325 -16.686  -6.153
  746   2HZ   LYS 104          HZ2       LYS 104  33.485 -17.207  -7.457
  747   3HZ   LYS 104          HZ3       LYS 104  35.023 -16.705  -7.625
  748    H    LEU 105           H        LEU 105  28.657 -10.952  -4.734
  749    HA   LEU 105           HA       LEU 105  26.120 -12.168  -5.386
  750   1HB   LEU 105          HB2       LEU 105  26.736 -11.702  -3.090
  751   2HB   LEU 105          HB3       LEU 105  26.845  -9.972  -3.393
  752    HG   LEU 105           HG       LEU 105  24.862 -10.717  -2.157
  753   1HD1  LEU 105          HD11      LEU 105  24.786  -8.589  -3.554
  754   2HD1  LEU 105          HD12      LEU 105  23.835  -9.505  -4.742
  755   3HD1  LEU 105          HD13      LEU 105  23.223  -9.304  -3.114
  756   1HD2  LEU 105          HD21      LEU 105  23.886 -11.967  -4.757
  757   2HD2  LEU 105          HD22      LEU 105  24.440 -12.861  -3.320
  758   3HD2  LEU 105          HD23      LEU 105  22.982 -11.853  -3.244
  759    H    GLU 106           H        GLU 106  27.212  -8.765  -5.323
  760    HA   GLU 106           HA       GLU 106  24.923  -7.612  -6.414
  761   1HB   GLU 106          HB2       GLU 106  27.801  -6.696  -6.809
  762   2HB   GLU 106          HB3       GLU 106  26.340  -5.718  -6.989
  763   1HG   GLU 106          HG2       GLU 106  25.866  -6.034  -4.559
  764   2HG   GLU 106          HG3       GLU 106  27.399  -6.907  -4.394
  765    H    ALA 107           H        ALA 107  27.716  -8.964  -8.167
  766    HA   ALA 107           HA       ALA 107  27.381  -7.987 -10.705
  767   1HB   ALA 107          HB1       ALA 107  28.278 -10.781  -9.863
  768   2HB   ALA 107          HB2       ALA 107  28.528 -10.054 -11.464
  769   3HB   ALA 107          HB3       ALA 107  29.314  -9.345 -10.046
  770    H    GLU 108           H        GLU 108  25.759 -10.856  -9.237
  771    HA   GLU 108           HA       GLU 108  24.404 -11.621 -11.660
  772   1HB   GLU 108          HB2       GLU 108  23.929 -12.177  -8.728
  773   2HB   GLU 108          HB3       GLU 108  22.934 -12.838 -10.009
  774   1HG   GLU 108          HG2       GLU 108  25.914 -13.378  -9.618
  775   2HG   GLU 108          HG3       GLU 108  24.558 -14.454  -9.324
  776    H    LEU 109           H        LEU 109  23.613  -9.227  -9.117
  777    HA   LEU 109           HA       LEU 109  20.843  -8.941 -10.041
  778   1HB   LEU 109          HB2       LEU 109  22.635  -7.237  -8.254
  779   2HB   LEU 109          HB3       LEU 109  20.996  -6.770  -8.674
  780    HG   LEU 109           HG       LEU 109  21.655  -9.422  -7.318
  781   1HD1  LEU 109          HD11      LEU 109  20.775  -6.802  -6.042
  782   2HD1  LEU 109          HD12      LEU 109  20.943  -8.367  -5.212
  783   3HD1  LEU 109          HD13      LEU 109  22.371  -7.564  -5.876
  784   1HD2  LEU 109          HD21      LEU 109  19.249  -9.326  -6.673
  785   2HD2  LEU 109          HD22      LEU 109  19.052  -7.850  -7.638
  786   3HD2  LEU 109          HD23      LEU 109  19.452  -9.391  -8.426
  787    H    LYS 110           H        LYS 110  23.962  -7.287 -10.638
  788    HA   LYS 110           HA       LYS 110  22.979  -5.199 -12.295
  789   1HB   LYS 110          HB2       LYS 110  25.687  -6.617 -12.126
  790   2HB   LYS 110          HB3       LYS 110  25.408  -5.093 -12.961
  791   1HG   LYS 110          HG2       LYS 110  25.008  -3.921 -10.984
  792   2HG   LYS 110          HG3       LYS 110  24.633  -5.313 -10.028
  793   1HD   LYS 110          HD2       LYS 110  26.899  -6.000  -9.874
  794   2HD   LYS 110          HD3       LYS 110  27.462  -4.839 -11.054
  795   1HE   LYS 110          HE2       LYS 110  26.650  -2.990  -9.517
  796   2HE   LYS 110          HE3       LYS 110  26.150  -4.227  -8.362
  797   1HZ   LYS 110          HZ1       LYS 110  28.881  -3.438  -9.082
  798   2HZ   LYS 110          HZ2       LYS 110  28.165  -3.550  -7.600
  799   3HZ   LYS 110          HZ3       LYS 110  28.625  -4.896  -8.367
  800    H    ASN 111           H        ASN 111  24.149  -8.495 -12.955
  801    HA   ASN 111           HA       ASN 111  23.904  -8.432 -15.800
  802   1HB   ASN 111          HB2       ASN 111  25.237 -10.139 -15.283
  803   2HB   ASN 111          HB3       ASN 111  24.704 -10.262 -13.668
  804   1HD2  ASN 111          HD22      ASN 111  22.825 -11.503 -13.073
  805   2HD2  ASN 111          HD21      ASN 111  22.851 -13.047 -13.854
  806    H    SER 112           H        SER 112  21.655  -9.297 -13.172
  807    HA   SER 112           HA       SER 112  19.632 -10.383 -14.889
  808   1HB   SER 112          HB2       SER 112  19.385  -9.143 -12.147
  809   2HB   SER 112          HB3       SER 112  18.150 -10.107 -12.973
  810    HG   SER 112           HG       SER 112  20.693 -10.937 -12.056
  811    H    GLY 113           H        GLY 113  20.329  -7.087 -13.625
  812   1HA   GLY 113          HA2       GLY 113  19.910  -5.679 -15.820
  813   2HA   GLY 113          HA3       GLY 113  18.227  -5.922 -15.361
  814    H    ALA 114           H        ALA 114  19.437  -5.687 -12.323
  815    HA   ALA 114           HA       ALA 114  18.270  -3.087 -12.171
  816   1HB   ALA 114          HB1       ALA 114  18.760  -3.140  -9.794
  817   2HB   ALA 114          HB2       ALA 114  18.071  -4.682 -10.260
  818   3HB   ALA 114          HB3       ALA 114  19.827  -4.555  -9.997
  819    H    LYS 115           H        LYS 115  19.241  -1.025 -11.766
  820    HA   LYS 115           HA       LYS 115  22.108  -0.920 -12.538
  821   1HB   LYS 115          HB2       LYS 115  21.724   1.516 -12.755
  822   2HB   LYS 115          HB3       LYS 115  20.808   0.507 -13.869
  823   1HG   LYS 115          HG2       LYS 115  18.765   0.818 -12.441
  824   2HG   LYS 115          HG3       LYS 115  19.700   1.925 -11.413
  825   1HD   LYS 115          HD2       LYS 115  20.100   3.403 -13.352
  826   2HD   LYS 115          HD3       LYS 115  19.222   2.271 -14.404
  827   1HE   LYS 115          HE2       LYS 115  17.177   2.592 -12.992
  828   2HE   LYS 115          HE3       LYS 115  18.053   3.789 -12.027
  829   1HZ   LYS 115          HZ1       LYS 115  16.712   4.839 -13.746
  830   2HZ   LYS 115          HZ2       LYS 115  18.287   5.131 -14.049
  831   3HZ   LYS 115          HZ3       LYS 115  17.472   4.022 -14.928
  832    H    GLN 116           H        GLN 116  23.506  -1.069 -10.863
  833    HA   GLN 116           HA       GLN 116  22.720  -0.442  -8.146
  834   1HB   GLN 116          HB2       GLN 116  24.560  -1.997  -8.518
  835   2HB   GLN 116          HB3       GLN 116  25.481  -0.728  -9.347
  836   1HG   GLN 116          HG2       GLN 116  25.590   0.612  -7.286
  837   2HG   GLN 116          HG3       GLN 116  24.477  -0.492  -6.475
  838   1HE2  GLN 116          HE22      GLN 116  25.532  -1.774  -5.014
  839   2HE2  GLN 116          HE21      GLN 116  27.094  -2.515  -5.288
  840    H    THR 117           H        THR 117  22.598   1.542  -7.290
  841    HA   THR 117           HA       THR 117  23.639   3.876  -8.857
  842    HB   THR 117           HB       THR 117  21.515   3.626  -6.710
  843    HG1  THR 117           HG1      THR 117  21.142   2.716  -8.876
  844   1HG2  THR 117          HG21      THR 117  20.850   5.903  -7.357
  845   2HG2  THR 117          HG22      THR 117  22.517   5.905  -6.767
  846   3HG2  THR 117          HG23      THR 117  22.199   5.975  -8.520
  847    H    GLY 118           H        GLY 118  24.915   5.432  -7.755
  848   1HA   GLY 118          HA2       GLY 118  26.462   6.197  -6.246
  849   2HA   GLY 118          HA3       GLY 118  25.529   5.399  -4.973
  850    H    GLU 119           H        GLU 119  26.631   3.903  -3.927
  851    HA   GLU 119           HA       GLU 119  27.864   1.698  -5.212
  852   1HB   GLU 119          HB2       GLU 119  30.119   1.837  -4.360
  853   2HB   GLU 119          HB3       GLU 119  29.805   3.256  -5.349
  854   1HG   GLU 119          HG2       GLU 119  29.359   4.564  -3.225
  855   2HG   GLU 119          HG3       GLU 119  29.845   3.131  -2.317
  856    H    THR 120           H        THR 120  28.645   0.120  -3.443
  857    HA   THR 120           HA       THR 120  26.694  -0.606  -1.790
  858    HB   THR 120           HB       THR 120  29.651  -0.997  -1.275
  859    HG1  THR 120           HG1      THR 120  28.396  -2.819  -2.928
  860   1HG2  THR 120          HG21      THR 120  28.986  -3.314  -0.669
  861   2HG2  THR 120          HG22      THR 120  28.357  -2.089   0.437
  862   3HG2  THR 120          HG23      THR 120  27.278  -2.822  -0.764
  863    H    LEU 121           H        LEU 121  25.723   0.202  -0.079
  864    HA   LEU 121           HA       LEU 121  26.791   2.294   1.657
  865   1HB   LEU 121          HB2       LEU 121  24.319   1.721   0.805
  866   2HB   LEU 121          HB3       LEU 121  24.314   0.603   2.134
  867    HG   LEU 121           HG       LEU 121  25.218   3.295   2.978
  868   1HD1  LEU 121          HD11      LEU 121  23.032   4.385   2.748
  869   2HD1  LEU 121          HD12      LEU 121  23.710   4.009   1.156
  870   3HD1  LEU 121          HD13      LEU 121  22.410   2.999   1.823
  871   1HD2  LEU 121          HD21      LEU 121  24.434   1.507   4.570
  872   2HD2  LEU 121          HD22      LEU 121  23.528   3.015   4.713
  873   3HD2  LEU 121          HD23      LEU 121  22.812   1.635   3.862
  874    H    LYS 122           H        LYS 122  26.639   1.738   4.194
  875    HA   LYS 122           HA       LYS 122  27.448  -1.094   4.672
  876   1HB   LYS 122          HB2       LYS 122  28.901   1.338   5.735
  877   2HB   LYS 122          HB3       LYS 122  29.167  -0.311   6.203
  878   1HG   LYS 122          HG2       LYS 122  30.914  -0.110   4.792
  879   2HG   LYS 122          HG3       LYS 122  29.723  -0.740   3.661
  880   1HD   LYS 122          HD2       LYS 122  29.273   1.591   2.866
  881   2HD   LYS 122          HD3       LYS 122  30.411   2.228   4.046
  882   1HE   LYS 122          HE2       LYS 122  31.132   0.293   1.792
  883   2HE   LYS 122          HE3       LYS 122  31.264   2.048   1.699
  884   1HZ   LYS 122          HZ1       LYS 122  32.776   1.890   3.696
  885   2HZ   LYS 122          HZ2       LYS 122  32.845   0.270   3.457
  886   3HZ   LYS 122          HZ3       LYS 122  33.379   1.276   2.296
  887    H    ILE 123           H        ILE 123  26.705  -1.951   6.510
  888    HA   ILE 123           HA       ILE 123  25.877  -0.341   8.789
  889    HB   ILE 123           HB       ILE 123  23.898  -1.741   9.116
  890   1HG1  ILE 123          HG12      ILE 123  22.995  -2.802   6.857
  891   2HG1  ILE 123          HG13      ILE 123  24.674  -2.982   6.449
  892   1HG2  ILE 123          HG21      ILE 123  23.724   0.496   8.051
  893   2HG2  ILE 123          HG22      ILE 123  23.719  -0.285   6.455
  894   3HG2  ILE 123          HG23      ILE 123  22.412  -0.605   7.611
  895   1HD1  ILE 123          HD11      ILE 123  25.053  -4.458   8.331
  896   2HD1  ILE 123          HD12      ILE 123  23.474  -4.053   9.035
  897   3HD1  ILE 123          HD13      ILE 123  23.571  -4.984   7.535
  898    H    ASN 124           H        ASN 124  26.064  -1.730  10.748
  899    HA   ASN 124           HA       ASN 124  27.252  -4.406  10.282
  900   1HB   ASN 124          HB2       ASN 124  29.158  -2.737  10.392
  901   2HB   ASN 124          HB3       ASN 124  28.649  -2.338  12.033
  902   1HD2  ASN 124          HD22      ASN 124  29.422  -5.249   9.984
  903   2HD2  ASN 124          HD21      ASN 124  30.277  -6.090  11.248
  904    H    ILE 125           H        ILE 125  26.294  -5.830  11.597
  905    HA   ILE 125           HA       ILE 125  25.569  -5.258  14.327
  906    HB   ILE 125           HB       ILE 125  23.695  -4.210  13.036
  907   1HG1  ILE 125          HG12      ILE 125  21.773  -5.259  14.046
  908   2HG1  ILE 125          HG13      ILE 125  22.679  -6.719  14.417
  909   1HG2  ILE 125          HG21      ILE 125  23.191  -6.986  11.882
  910   2HG2  ILE 125          HG22      ILE 125  22.135  -5.582  11.710
  911   3HG2  ILE 125          HG23      ILE 125  23.746  -5.557  10.985
  912   1HD1  ILE 125          HD11      ILE 125  23.276  -3.939  15.539
  913   2HD1  ILE 125          HD12      ILE 125  22.371  -5.216  16.378
  914   3HD1  ILE 125          HD13      ILE 125  24.087  -5.452  16.015
  915    H    LEU 126           H        LEU 126  24.794  -7.320  15.322
  916    HA   LEU 126           HA       LEU 126  24.689  -9.473  15.744
  917   1HB   LEU 126          HB2       LEU 126  23.020  -9.257  13.917
  918   2HB   LEU 126          HB3       LEU 126  24.233  -9.795  12.762
  919    HG   LEU 126           HG       LEU 126  24.301 -12.020  13.792
  920   1HD1  LEU 126          HD11      LEU 126  23.837 -11.509  16.154
  921   2HD1  LEU 126          HD12      LEU 126  22.210 -10.924  15.735
  922   3HD1  LEU 126          HD13      LEU 126  22.632 -12.641  15.546
  923   1HD2  LEU 126          HD21      LEU 126  22.062 -12.751  13.164
  924   2HD2  LEU 126          HD22      LEU 126  21.453 -11.086  13.275
  925   3HD2  LEU 126          HD23      LEU 126  22.647 -11.524  12.032
  926    H    ASP 127           H        ASP 127  27.315  -8.466  13.858
  927    HA   ASP 127           HA       ASP 127  28.913 -10.856  14.518
  928   1HB   ASP 127          HB2       ASP 127  27.840 -11.194  12.256
  929   2HB   ASP 127          HB3       ASP 127  28.609  -9.698  11.721
  930    H    HIS 128           H        HIS 128  31.249 -10.342  13.789
  931    HA   HIS 128           HA       HIS 128  32.192  -7.968  15.052
  932   1HB   HIS 128          HB2       HIS 128  33.380 -10.185  14.784
  933   2HB   HIS 128          HB3       HIS 128  33.619  -9.801  13.080
  934    HD1  HIS 128           HD1      HIS 128  34.492  -8.091  16.498
  935    HD2  HIS 128           HD2      HIS 128  35.954  -8.768  12.605
  936    HE1  HIS 128           HE1      HIS 128  36.822  -7.077  16.423
  937    H    ASP 129           H        ASP 129  33.573  -6.268  13.961
  938    HA   ASP 129           HA       ASP 129  32.124  -5.186  11.732
  939   1HB   ASP 129          HB2       ASP 129  33.164  -3.230  11.972
  940   2HB   ASP 129          HB3       ASP 129  33.087  -3.809  13.628
  941    H    ILE 130           H        ILE 130  32.744  -4.882   9.741
  942    HA   ILE 130           HA       ILE 130  35.303  -5.653   8.605
  943    HB   ILE 130           HB       ILE 130  32.741  -7.158   8.100
  944   1HG1  ILE 130          HG12      ILE 130  34.381  -8.297   9.453
  945   2HG1  ILE 130          HG13      ILE 130  34.104  -9.129   7.945
  946   1HG2  ILE 130          HG21      ILE 130  33.525  -7.974   5.907
  947   2HG2  ILE 130          HG22      ILE 130  33.146  -6.267   5.861
  948   3HG2  ILE 130          HG23      ILE 130  34.840  -6.771   5.933
  949   1HD1  ILE 130          HD11      ILE 130  36.248  -8.262   7.033
  950   2HD1  ILE 130          HD12      ILE 130  36.553  -7.423   8.574
  951   3HD1  ILE 130          HD13      ILE 130  36.465  -9.188   8.524
  952    HA   PRO 131           HA       PRO 131  32.815  -2.634   5.911
  953   1HB   PRO 131          HB2       PRO 131  30.157  -2.248   6.053
  954   2HB   PRO 131          HB3       PRO 131  30.814  -3.732   5.350
  955   1HG   PRO 131          HG2       PRO 131  29.971  -3.382   8.281
  956   2HG   PRO 131          HG3       PRO 131  29.294  -4.507   7.066
  957   1HD   PRO 131          HD2       PRO 131  31.304  -5.262   8.688
  958   2HD   PRO 131          HD3       PRO 131  31.314  -5.721   6.968
  959    H    GLU 132           H        GLU 132  30.369  -1.163   7.453
  960    HA   GLU 132           HA       GLU 132  31.750   0.340   9.518
  961   1HB   GLU 132          HB2       GLU 132  30.850   1.688   6.920
  962   2HB   GLU 132          HB3       GLU 132  31.371   2.519   8.382
  963   1HG   GLU 132          HG2       GLU 132  33.641   1.574   8.131
  964   2HG   GLU 132          HG3       GLU 132  33.133   0.724   6.665
  965    H    ASP 133           H        ASP 133  29.848   2.247   9.999
  966    HA   ASP 133           HA       ASP 133  27.204   1.016   9.540
  967   1HB   ASP 133          HB2       ASP 133  28.144   0.050  11.626
  968   2HB   ASP 133          HB3       ASP 133  28.179   1.671  12.324
  969    HA   PRO 134           HA       PRO 134  26.242   5.422  10.887
  970   1HB   PRO 134          HB2       PRO 134  28.063   7.430  11.038
  971   2HB   PRO 134          HB3       PRO 134  27.896   6.197  12.314
  972   1HG   PRO 134          HG2       PRO 134  29.879   6.210  10.016
  973   2HG   PRO 134          HG3       PRO 134  30.219   6.008  11.767
  974   1HD   PRO 134          HD2       PRO 134  29.930   3.910  10.061
  975   2HD   PRO 134          HD3       PRO 134  29.385   3.807  11.768
  976    H    ALA 135           H        ALA 135  26.425   4.237   8.308
  977    HA   ALA 135           HA       ALA 135  27.409   6.032   6.286
  978   1HB   ALA 135          HB1       ALA 135  25.645   3.564   6.066
  979   2HB   ALA 135          HB2       ALA 135  26.635   4.263   4.776
  980   3HB   ALA 135          HB3       ALA 135  27.427   3.533   6.174
  981    H    GLU 136           H        GLU 136  25.217   7.222   7.985
  982    HA   GLU 136           HA       GLU 136  22.778   7.315   6.465
  983   1HB   GLU 136          HB2       GLU 136  22.938   7.881   8.857
  984   2HB   GLU 136          HB3       GLU 136  23.940   9.291   8.476
  985   1HG   GLU 136          HG2       GLU 136  22.100  10.325   7.247
  986   2HG   GLU 136          HG3       GLU 136  21.113   8.865   7.407
  987    H    GLU 137           H        GLU 137  25.830   9.175   6.333
  988    HA   GLU 137           HA       GLU 137  24.938  11.120   4.411
  989   1HB   GLU 137          HB2       GLU 137  27.715   9.997   4.993
  990   2HB   GLU 137          HB3       GLU 137  27.382  11.379   3.940
  991   1HG   GLU 137          HG2       GLU 137  26.312  12.566   5.863
  992   2HG   GLU 137          HG3       GLU 137  26.745  11.220   6.919
  993    H    TRP 138           H        TRP 138  26.086   7.760   4.071
  994    HA   TRP 138           HA       TRP 138  26.415   7.796   1.222
  995   1HB   TRP 138          HB2       TRP 138  26.709   5.890   3.324
  996   2HB   TRP 138          HB3       TRP 138  25.433   5.289   2.334
  997    HD1  TRP 138           HD1      TRP 138  26.039   4.632  -0.217
  998    HE1  TRP 138           HE1      TRP 138  28.175   3.664  -1.168
  999    HE3  TRP 138           HE3      TRP 138  29.268   6.144   3.457
 1000    HZ2  TRP 138           HZ2      TRP 138  31.032   3.633  -0.462
 1001    HZ3  TRP 138           HZ3      TRP 138  31.688   5.628   3.294
 1002    HH2  TRP 138           HH2      TRP 138  32.578   4.390   1.332
 1003    H    LEU 139           H        LEU 139  23.734   7.016   3.462
 1004    HA   LEU 139           HA       LEU 139  21.755   6.270   1.560
 1005   1HB   LEU 139          HB2       LEU 139  21.883   6.373   4.285
 1006   2HB   LEU 139          HB3       LEU 139  21.031   7.860   4.039
 1007    HG   LEU 139           HG       LEU 139  19.268   6.648   2.714
 1008   1HD1  LEU 139          HD11      LEU 139  20.417   4.609   2.024
 1009   2HD1  LEU 139          HD12      LEU 139  20.785   4.193   3.714
 1010   3HD1  LEU 139          HD13      LEU 139  19.118   4.150   3.124
 1011   1HD2  LEU 139          HD21      LEU 139  18.983   7.243   5.086
 1012   2HD2  LEU 139          HD22      LEU 139  18.202   5.695   4.737
 1013   3HD2  LEU 139          HD23      LEU 139  19.764   5.726   5.582
 1014    H    GLY 140           H        GLY 140  22.355   9.385   3.157
 1015   1HA   GLY 140          HA2       GLY 140  20.535  11.009   1.786
 1016   2HA   GLY 140          HA3       GLY 140  22.085  11.572   2.440
 1017    H    SER 141           H        SER 141  23.943  10.265   0.822
 1018    HA   SER 141           HA       SER 141  23.938  11.811  -1.541
 1019   1HB   SER 141          HB2       SER 141  25.927  10.845  -0.350
 1020   2HB   SER 141          HB3       SER 141  25.501   9.251  -0.998
 1021    HG   SER 141           HG       SER 141  27.060  10.395  -2.263
 1022    H    TRP 142           H        TRP 142  23.319   8.256  -1.117
 1023    HA   TRP 142           HA       TRP 142  22.703   7.699  -3.803
 1024   1HB   TRP 142          HB2       TRP 142  23.227   5.986  -2.222
 1025   2HB   TRP 142          HB3       TRP 142  21.887   6.442  -1.187
 1026    HD1  TRP 142           HD1      TRP 142  22.446   4.881  -4.669
 1027    HE1  TRP 142           HE1      TRP 142  20.358   3.522  -5.322
 1028    HE3  TRP 142           HE3      TRP 142  19.610   5.789  -0.518
 1029    HZ2  TRP 142           HZ2      TRP 142  17.785   2.882  -4.151
 1030    HZ3  TRP 142           HZ3      TRP 142  17.303   4.874  -0.377
 1031    HH2  TRP 142           HH2      TRP 142  16.398   3.410  -2.149
 1032    H    VAL 143           H        VAL 143  20.552   8.771  -1.156
 1033    HA   VAL 143           HA       VAL 143  18.092   8.710  -2.548
 1034    HB   VAL 143           HB       VAL 143  19.210  10.212  -0.172
 1035   1HG1  VAL 143          HG11      VAL 143  16.427  10.623  -1.281
 1036   2HG1  VAL 143          HG12      VAL 143  17.015  11.167   0.317
 1037   3HG1  VAL 143          HG13      VAL 143  17.714  11.858  -1.140
 1038   1HG2  VAL 143          HG21      VAL 143  17.535   8.883   1.039
 1039   2HG2  VAL 143          HG22      VAL 143  16.914   8.227  -0.496
 1040   3HG2  VAL 143          HG23      VAL 143  18.542   7.821   0.051
 1041    H    ASN 144           H        ASN 144  20.404  11.518  -2.167
 1042    HA   ASN 144           HA       ASN 144  18.749  13.072  -3.887
 1043   1HB   ASN 144          HB2       ASN 144  19.960  14.825  -3.350
 1044   2HB   ASN 144          HB3       ASN 144  20.656  13.784  -2.122
 1045   1HD2  ASN 144          HD22      ASN 144  22.564  12.311  -3.290
 1046   2HD2  ASN 144          HD21      ASN 144  23.743  13.323  -4.096
 1047    H    LEU 145           H        LEU 145  21.020  10.629  -4.671
 1048    HA   LEU 145           HA       LEU 145  21.421  11.480  -7.444
 1049   1HB   LEU 145          HB2       LEU 145  22.265   9.179  -5.719
 1050   2HB   LEU 145          HB3       LEU 145  21.938   8.777  -7.395
 1051    HG   LEU 145           HG       LEU 145  23.530  10.466  -8.182
 1052   1HD1  LEU 145          HD11      LEU 145  25.102  11.552  -6.619
 1053   2HD1  LEU 145          HD12      LEU 145  23.445  12.087  -6.316
 1054   3HD1  LEU 145          HD13      LEU 145  24.199  10.893  -5.238
 1055   1HD2  LEU 145          HD21      LEU 145  25.571   9.273  -7.465
 1056   2HD2  LEU 145          HD22      LEU 145  24.678   8.537  -6.114
 1057   3HD2  LEU 145          HD23      LEU 145  24.251   8.140  -7.793
 1058    H    LEU 146           H        LEU 146  19.349   9.062  -5.694
 1059    HA   LEU 146           HA       LEU 146  18.148   8.147  -8.106
 1060   1HB   LEU 146          HB2       LEU 146  16.960   6.746  -6.841
 1061   2HB   LEU 146          HB3       LEU 146  18.345   6.994  -5.822
 1062    HG   LEU 146           HG       LEU 146  16.664   8.716  -4.604
 1063   1HD1  LEU 146          HD11      LEU 146  14.748   8.508  -6.168
 1064   2HD1  LEU 146          HD12      LEU 146  14.760   6.747  -5.962
 1065   3HD1  LEU 146          HD13      LEU 146  14.340   7.806  -4.611
 1066   1HD2  LEU 146          HD21      LEU 146  16.408   5.699  -4.351
 1067   2HD2  LEU 146          HD22      LEU 146  17.676   6.688  -3.609
 1068   3HD2  LEU 146          HD23      LEU 146  15.994   6.901  -3.110
 1069    H    LYS 147           H        LYS 147  17.293  10.643  -5.817
 1070    HA   LYS 147           HA       LYS 147  14.699  11.345  -6.680
 1071   1HB   LYS 147          HB2       LYS 147  16.990  12.825  -5.349
 1072   2HB   LYS 147          HB3       LYS 147  15.547  13.697  -5.869
 1073   1HG   LYS 147          HG2       LYS 147  14.111  12.191  -4.516
 1074   2HG   LYS 147          HG3       LYS 147  15.556  11.342  -3.940
 1075   1HD   LYS 147          HD2       LYS 147  16.410  13.470  -2.977
 1076   2HD   LYS 147          HD3       LYS 147  14.955  14.313  -3.509
 1077   1HE   LYS 147          HE2       LYS 147  14.975  11.942  -1.583
 1078   2HE   LYS 147          HE3       LYS 147  15.016  13.625  -1.067
 1079   1HZ   LYS 147          HZ1       LYS 147  12.816  12.670  -1.002
 1080   2HZ   LYS 147          HZ2       LYS 147  12.850  13.948  -2.031
 1081   3HZ   LYS 147          HZ3       LYS 147  12.801  12.417  -2.619
  Start of MODEL    5
    1   1H    MET   1          H1        MET   1   1.765  -2.681   1.167
    2   2H    MET   1          H2        MET   1   3.372  -2.463   1.475
    3   3H    MET   1          H3        MET   1   2.271  -1.470   2.161
    4    HA   MET   1           HA       MET   1   2.780  -1.683  -0.719
    5   1HB   MET   1          HB2       MET   1   0.475  -0.949  -0.135
    6   2HB   MET   1          HB3       MET   1   1.137   0.387   0.816
    7   1HG   MET   1          HG2       MET   1   2.220   1.289  -1.230
    8   2HG   MET   1          HG3       MET   1   1.549  -0.039  -2.177
    9   1HE   MET   1          HE1       MET   1  -0.920  -0.243  -2.947
   10   2HE   MET   1          HE2       MET   1  -1.484  -0.334  -1.261
   11   3HE   MET   1          HE3       MET   1  -2.243   0.803  -2.391
   12    H    ALA   2           H        ALA   2   4.617  -0.680  -1.429
   13    HA   ALA   2           HA       ALA   2   5.936   1.392   0.180
   14   1HB   ALA   2          HB1       ALA   2   6.729  -0.699   1.221
   15   2HB   ALA   2          HB2       ALA   2   7.120  -1.367  -0.375
   16   3HB   ALA   2          HB3       ALA   2   8.032   0.013   0.254
   17    H    ASP   3           H        ASP   3   7.867   2.189  -0.947
   18    HA   ASP   3           HA       ASP   3   7.744   2.019  -3.898
   19   1HB   ASP   3          HB2       ASP   3   7.689   4.267  -2.691
   20   2HB   ASP   3          HB3       ASP   3   9.288   3.906  -2.075
   21    H    ILE   4           H        ILE   4   9.623   1.161  -1.065
   22    HA   ILE   4           HA       ILE   4  11.797   0.060  -2.776
   23    HB   ILE   4           HB       ILE   4  12.185   1.261  -0.019
   24   1HG1  ILE   4          HG12      ILE   4  12.663   2.739  -2.632
   25   2HG1  ILE   4          HG13      ILE   4  11.435   3.136  -1.426
   26   1HG2  ILE   4          HG21      ILE   4  14.536   1.172  -0.569
   27   2HG2  ILE   4          HG22      ILE   4  13.862  -0.397  -0.989
   28   3HG2  ILE   4          HG23      ILE   4  14.189   0.769  -2.263
   29   1HD1  ILE   4          HD11      ILE   4  13.230   4.677  -1.165
   30   2HD1  ILE   4          HD12      ILE   4  13.259   3.585   0.233
   31   3HD1  ILE   4          HD13      ILE   4  14.435   3.387  -1.086
   32    H    THR   5           H        THR   5  12.114  -2.106  -2.404
   33    HA   THR   5           HA       THR   5  10.951  -3.358   0.014
   34    HB   THR   5           HB       THR   5  10.564  -4.495  -2.164
   35    HG1  THR   5           HG1      THR   5  10.672  -5.883  -0.519
   36   1HG2  THR   5          HG21      THR   5  13.564  -4.844  -2.408
   37   2HG2  THR   5          HG22      THR   5  12.312  -5.582  -3.421
   38   3HG2  THR   5          HG23      THR   5  12.530  -3.829  -3.442
   39    H    LEU   6           H        LEU   6  12.273  -3.788   1.775
   40    HA   LEU   6           HA       LEU   6  15.194  -3.129   1.571
   41   1HB   LEU   6          HB2       LEU   6  13.149  -2.874   3.776
   42   2HB   LEU   6          HB3       LEU   6  14.830  -3.015   4.168
   43    HG   LEU   6           HG       LEU   6  13.758  -0.710   4.136
   44   1HD1  LEU   6          HD11      LEU   6  16.189  -1.062   4.336
   45   2HD1  LEU   6          HD12      LEU   6  16.331  -1.007   2.560
   46   3HD1  LEU   6          HD13      LEU   6  15.792   0.421   3.463
   47   1HD2  LEU   6          HD21      LEU   6  13.736   0.572   2.087
   48   2HD2  LEU   6          HD22      LEU   6  14.241  -0.854   1.162
   49   3HD2  LEU   6          HD23      LEU   6  12.644  -0.820   1.946
   50    H    ILE   7           H        ILE   7  15.765  -5.136   0.883
   51    HA   ILE   7           HA       ILE   7  14.696  -7.579   2.072
   52    HB   ILE   7           HB       ILE   7  16.938  -7.252   0.033
   53   1HG1  ILE   7          HG12      ILE   7  13.930  -7.586  -0.395
   54   2HG1  ILE   7          HG13      ILE   7  14.903  -6.187  -0.843
   55   1HG2  ILE   7          HG21      ILE   7  16.475  -9.599  -0.471
   56   2HG2  ILE   7          HG22      ILE   7  16.792  -9.455   1.249
   57   3HG2  ILE   7          HG23      ILE   7  15.112  -9.609   0.680
   58   1HD1  ILE   7          HD11      ILE   7  14.444  -7.421  -2.828
   59   2HD1  ILE   7          HD12      ILE   7  16.170  -7.609  -2.467
   60   3HD1  ILE   7          HD13      ILE   7  15.028  -8.933  -2.124
   61    H    SER   8           H        SER   8  15.257  -7.591   4.160
   62    HA   SER   8           HA       SER   8  17.871  -6.676   5.106
   63   1HB   SER   8          HB2       SER   8  15.388  -7.543   6.636
   64   2HB   SER   8          HB3       SER   8  16.721  -6.531   7.215
   65    HG   SER   8           HG       SER   8  14.937  -5.826   5.088
   66    H    GLY   9           H        GLY   9  17.370  -9.491   3.819
   67   1HA   GLY   9          HA2       GLY   9  18.782 -11.076   5.778
   68   2HA   GLY   9          HA3       GLY   9  17.050 -11.464   5.699
   69    H    SER  10           H        SER  10  20.002 -11.114   3.708
   70    HA   SER  10           HA       SER  10  19.226 -12.620   1.442
   71   1HB   SER  10          HB2       SER  10  21.920 -12.281   2.834
   72   2HB   SER  10          HB3       SER  10  21.676 -12.898   1.199
   73    HG   SER  10           HG       SER  10  21.299 -10.334   2.244
   74    H    THR  11           H        THR  11  19.757 -13.707   4.692
   75    HA   THR  11           HA       THR  11  19.693 -16.561   3.867
   76    HB   THR  11           HB       THR  11  20.814 -16.754   6.248
   77    HG1  THR  11           HG1      THR  11  20.606 -14.419   6.700
   78   1HG2  THR  11          HG21      THR  11  23.051 -16.380   5.236
   79   2HG2  THR  11          HG22      THR  11  21.986 -17.313   4.170
   80   3HG2  THR  11          HG23      THR  11  22.289 -15.588   3.851
   81    H    LEU  12           H        LEU  12  17.372 -14.848   4.050
   82    HA   LEU  12           HA       LEU  12  15.344 -14.628   4.890
   83   1HB   LEU  12          HB2       LEU  12  15.725 -17.330   6.212
   84   2HB   LEU  12          HB3       LEU  12  14.196 -16.488   6.002
   85    HG   LEU  12           HG       LEU  12  15.964 -17.506   3.754
   86   1HD1  LEU  12          HD11      LEU  12  14.178 -19.153   3.390
   87   2HD1  LEU  12          HD12      LEU  12  14.853 -19.300   5.019
   88   3HD1  LEU  12          HD13      LEU  12  13.278 -18.508   4.783
   89   1HD2  LEU  12          HD21      LEU  12  14.739 -15.534   2.962
   90   2HD2  LEU  12          HD22      LEU  12  13.991 -16.979   2.287
   91   3HD2  LEU  12          HD23      LEU  12  13.226 -16.150   3.658
   92    H    GLY  13           H        GLY  13  17.713 -13.747   6.387
   93   1HA   GLY  13          HA2       GLY  13  16.619 -12.076   8.269
   94   2HA   GLY  13          HA3       GLY  13  17.166 -13.513   9.173
   95    H    GLY  14           H        GLY  14  18.478 -10.935   9.401
   96   1HA   GLY  14          HA2       GLY  14  21.105 -11.731   9.440
   97   2HA   GLY  14          HA3       GLY  14  20.925 -11.043   7.821
   98    H    ALA  15           H        ALA  15  19.026  -8.905   8.552
   99    HA   ALA  15           HA       ALA  15  20.718  -7.170  10.280
  100   1HB   ALA  15          HB1       ALA  15  21.051  -5.588   8.454
  101   2HB   ALA  15          HB2       ALA  15  21.674  -7.168   7.959
  102   3HB   ALA  15          HB3       ALA  15  20.099  -6.604   7.349
  103    H    GLU  16           H        GLU  16  17.699  -8.167  10.105
  104    HA   GLU  16           HA       GLU  16  16.090  -6.113   9.218
  105   1HB   GLU  16          HB2       GLU  16  15.412  -7.779  11.663
  106   2HB   GLU  16          HB3       GLU  16  14.323  -6.919  10.576
  107   1HG   GLU  16          HG2       GLU  16  14.056  -9.014   9.733
  108   2HG   GLU  16          HG3       GLU  16  15.406  -8.509   8.723
  109    H    TYR  17           H        TYR  17  17.671  -6.219  12.425
  110    HA   TYR  17           HA       TYR  17  16.126  -4.204  13.659
  111   1HB   TYR  17          HB2       TYR  17  17.621  -5.687  14.889
  112   2HB   TYR  17          HB3       TYR  17  19.030  -5.016  14.077
  113    HD1  TYR  17           HD1      TYR  17  20.125  -3.057  14.928
  114    HD2  TYR  17           HD2      TYR  17  16.229  -4.170  16.421
  115    HE1  TYR  17           HE1      TYR  17  20.317  -1.338  16.698
  116    HE2  TYR  17           HE2      TYR  17  16.411  -2.454  18.194
  117    HH   TYR  17           HH       TYR  17  17.726  -0.773  19.130
  118    H    VAL  18           H        VAL  18  19.231  -3.867  11.822
  119    HA   VAL  18           HA       VAL  18  19.123  -0.964  12.111
  120    HB   VAL  18           HB       VAL  18  21.206  -2.222  12.260
  121   1HG1  VAL  18          HG11      VAL  18  20.947  -2.816   9.284
  122   2HG1  VAL  18          HG12      VAL  18  22.363  -3.121  10.308
  123   3HG1  VAL  18          HG13      VAL  18  20.873  -4.004  10.607
  124   1HG2  VAL  18          HG21      VAL  18  22.587  -0.729  10.975
  125   2HG2  VAL  18          HG22      VAL  18  21.236  -0.315   9.892
  126   3HG2  VAL  18          HG23      VAL  18  21.199   0.166  11.603
  127    H    ALA  19           H        ALA  19  18.291  -3.408   9.656
  128    HA   ALA  19           HA       ALA  19  17.936  -1.616   7.483
  129   1HB   ALA  19          HB1       ALA  19  18.018  -4.085   7.256
  130   2HB   ALA  19          HB2       ALA  19  16.437  -4.187   8.074
  131   3HB   ALA  19          HB3       ALA  19  16.576  -3.365   6.509
  132    H    GLU  20           H        GLU  20  15.650  -2.621  10.132
  133    HA   GLU  20           HA       GLU  20  13.425  -1.193   9.165
  134   1HB   GLU  20          HB2       GLU  20  13.482  -2.858  11.058
  135   2HB   GLU  20          HB3       GLU  20  14.200  -1.608  12.082
  136   1HG   GLU  20          HG2       GLU  20  12.189  -0.186  11.714
  137   2HG   GLU  20          HG3       GLU  20  11.507  -1.419  10.655
  138    H    HIS  21           H        HIS  21  16.216  -0.005  11.119
  139    HA   HIS  21           HA       HIS  21  15.096   2.606  11.578
  140   1HB   HIS  21          HB2       HIS  21  16.935   1.736  12.938
  141   2HB   HIS  21          HB3       HIS  21  17.989   1.652  11.526
  142    HD1  HIS  21           HD1      HIS  21  19.383   3.828  11.037
  143    HD2  HIS  21           HD2      HIS  21  16.079   4.376  13.591
  144    HE1  HIS  21           HE1      HIS  21  19.496   6.238  11.846
  145    H    LEU  22           H        LEU  22  17.347   1.309   9.103
  146    HA   LEU  22           HA       LEU  22  17.718   3.649   7.550
  147   1HB   LEU  22          HB2       LEU  22  17.717   0.669   7.026
  148   2HB   LEU  22          HB3       LEU  22  17.817   1.748   5.663
  149    HG   LEU  22           HG       LEU  22  19.726   1.997   8.031
  150   1HD1  LEU  22          HD11      LEU  22  21.323   0.616   6.696
  151   2HD1  LEU  22          HD12      LEU  22  19.922  -0.294   7.272
  152   3HD1  LEU  22          HD13      LEU  22  19.996   0.224   5.574
  153   1HD2  LEU  22          HD21      LEU  22  19.991   2.785   5.089
  154   2HD2  LEU  22          HD22      LEU  22  19.666   3.904   6.429
  155   3HD2  LEU  22          HD23      LEU  22  21.209   3.045   6.356
  156    H    ALA  23           H        ALA  23  15.299   1.062   7.200
  157    HA   ALA  23           HA       ALA  23  13.798   2.043   5.089
  158   1HB   ALA  23          HB1       ALA  23  13.565  -0.207   6.242
  159   2HB   ALA  23          HB2       ALA  23  12.682   0.604   7.537
  160   3HB   ALA  23          HB3       ALA  23  12.026   0.586   5.902
  161    H    GLU  24           H        GLU  24  13.310   2.722   8.608
  162    HA   GLU  24           HA       GLU  24  11.037   4.347   8.353
  163   1HB   GLU  24          HB2       GLU  24  12.163   3.361  10.447
  164   2HB   GLU  24          HB3       GLU  24  13.243   4.734  10.434
  165   1HG   GLU  24          HG2       GLU  24  11.321   6.262  10.582
  166   2HG   GLU  24          HG3       GLU  24  10.201   4.901  10.540
  167    H    LYS  25           H        LYS  25  14.486   5.333   8.632
  168    HA   LYS  25           HA       LYS  25  14.116   8.094   8.200
  169   1HB   LYS  25          HB2       LYS  25  16.385   6.192   7.451
  170   2HB   LYS  25          HB3       LYS  25  16.512   7.926   7.306
  171   1HG   LYS  25          HG2       LYS  25  15.965   6.347   9.877
  172   2HG   LYS  25          HG3       LYS  25  17.484   7.045   9.428
  173   1HD   LYS  25          HD2       LYS  25  14.930   8.398  10.270
  174   2HD   LYS  25          HD3       LYS  25  16.453   8.406  11.127
  175   1HE   LYS  25          HE2       LYS  25  15.956   9.786   8.442
  176   2HE   LYS  25          HE3       LYS  25  15.835  10.560  10.017
  177   1HZ   LYS  25          HZ1       LYS  25  17.991  10.962   9.022
  178   2HZ   LYS  25          HZ2       LYS  25  18.182  10.100  10.386
  179   3HZ   LYS  25          HZ3       LYS  25  18.325   9.370   8.929
  180    H    LEU  26           H        LEU  26  14.430   5.514   5.767
  181    HA   LEU  26           HA       LEU  26  14.262   7.362   3.555
  182   1HB   LEU  26          HB2       LEU  26  13.898   4.369   3.775
  183   2HB   LEU  26          HB3       LEU  26  13.681   5.233   2.247
  184    HG   LEU  26           HG       LEU  26  16.248   5.241   3.897
  185   1HD1  LEU  26          HD11      LEU  26  15.549   3.759   1.329
  186   2HD1  LEU  26          HD12      LEU  26  17.134   3.776   2.130
  187   3HD1  LEU  26          HD13      LEU  26  15.750   3.030   2.937
  188   1HD2  LEU  26          HD21      LEU  26  15.614   6.396   1.147
  189   2HD2  LEU  26          HD22      LEU  26  16.147   7.286   2.591
  190   3HD2  LEU  26          HD23      LEU  26  17.255   6.182   1.799
  191    H    GLU  27           H        GLU  27  11.649   5.996   5.620
  192    HA   GLU  27           HA       GLU  27   9.637   6.781   3.707
  193   1HB   GLU  27          HB2       GLU  27   9.445   6.328   6.721
  194   2HB   GLU  27          HB3       GLU  27   8.135   6.595   5.591
  195   1HG   GLU  27          HG2       GLU  27   9.215   4.534   4.313
  196   2HG   GLU  27          HG3       GLU  27   9.862   4.185   5.923
  197    H    GLU  28           H        GLU  28  11.291   8.282   6.554
  198    HA   GLU  28           HA       GLU  28   9.921  10.758   6.463
  199   1HB   GLU  28          HB2       GLU  28  12.709   9.974   7.417
  200   2HB   GLU  28          HB3       GLU  28  11.993  11.543   7.677
  201   1HG   GLU  28          HG2       GLU  28  10.833   8.929   8.719
  202   2HG   GLU  28          HG3       GLU  28  11.853  10.026   9.636
  203    H    ALA  29           H        ALA  29  12.516   9.463   4.442
  204    HA   ALA  29           HA       ALA  29  13.303  11.941   3.228
  205   1HB   ALA  29          HB1       ALA  29  13.455   9.114   2.095
  206   2HB   ALA  29          HB2       ALA  29  14.312  10.523   1.500
  207   3HB   ALA  29          HB3       ALA  29  14.693   9.892   3.112
  208    H    GLY  30           H        GLY  30  10.323  10.229   2.993
  209   1HA   GLY  30          HA2       GLY  30   8.532  11.447   2.021
  210   2HA   GLY  30          HA3       GLY  30   9.565  11.950   0.681
  211    H    PHE  31           H        PHE  31   9.710   8.595   1.721
  212    HA   PHE  31           HA       PHE  31   8.038   7.757  -0.607
  213   1HB   PHE  31          HB2       PHE  31  10.488   6.238   0.251
  214   2HB   PHE  31          HB3       PHE  31   9.609   6.156  -1.257
  215    HD1  PHE  31           HD1      PHE  31  12.531   7.422   0.302
  216    HD2  PHE  31           HD2      PHE  31   9.621   8.392  -2.731
  217    HE1  PHE  31           HE1      PHE  31  14.131   9.006  -0.726
  218    HE2  PHE  31           HE2      PHE  31  11.233   9.972  -3.765
  219    HZ   PHE  31           HZ       PHE  31  13.490  10.286  -2.764
  220    H    THR  32           H        THR  32   8.159   4.997  -0.102
  221    HA   THR  32           HA       THR  32   7.502   4.607   2.736
  222    HB   THR  32           HB       THR  32   5.707   2.953   1.921
  223    HG1  THR  32           HG1      THR  32   5.684   4.780  -0.264
  224   1HG2  THR  32          HG21      THR  32   5.117   5.939   1.781
  225   2HG2  THR  32          HG22      THR  32   3.933   4.635   2.051
  226   3HG2  THR  32          HG23      THR  32   5.203   4.942   3.250
  227    H    THR  33           H        THR  33   8.071   2.504   3.432
  228    HA   THR  33           HA       THR  33   9.696   0.944   1.468
  229    HB   THR  33           HB       THR  33  11.523   0.965   3.033
  230    HG1  THR  33           HG1      THR  33  11.215   2.762   4.739
  231   1HG2  THR  33          HG21      THR  33  12.317   3.193   2.710
  232   2HG2  THR  33          HG22      THR  33  11.268   2.862   1.330
  233   3HG2  THR  33          HG23      THR  33  10.671   3.871   2.654
  234    H    GLU  34           H        GLU  34  10.084  -1.255   1.991
  235    HA   GLU  34           HA       GLU  34   8.227  -2.402   3.986
  236   1HB   GLU  34          HB2       GLU  34   8.193  -2.497   1.259
  237   2HB   GLU  34          HB3       GLU  34   9.158  -3.896   1.588
  238   1HG   GLU  34          HG2       GLU  34   6.977  -4.552   1.492
  239   2HG   GLU  34          HG3       GLU  34   7.395  -4.660   3.193
  240    H    THR  35           H        THR  35   9.770  -2.519   5.759
  241    HA   THR  35           HA       THR  35  12.333  -3.814   5.431
  242    HB   THR  35           HB       THR  35  10.800  -3.796   8.035
  243    HG1  THR  35           HG1      THR  35  10.682  -1.694   7.612
  244   1HG2  THR  35          HG21      THR  35  13.024  -4.997   7.734
  245   2HG2  THR  35          HG22      THR  35  13.756  -3.432   7.348
  246   3HG2  THR  35          HG23      THR  35  13.048  -3.717   8.956
  247    H    LEU  36           H        LEU  36  12.592  -5.849   4.881
  248    HA   LEU  36           HA       LEU  36  10.634  -7.964   5.734
  249   1HB   LEU  36          HB2       LEU  36  11.777  -7.262   2.989
  250   2HB   LEU  36          HB3       LEU  36  10.945  -8.766   3.332
  251    HG   LEU  36           HG       LEU  36   9.611  -6.071   3.728
  252   1HD1  LEU  36          HD11      LEU  36   9.734  -7.819   1.248
  253   2HD1  LEU  36          HD12      LEU  36   8.625  -6.433   1.482
  254   3HD1  LEU  36          HD13      LEU  36  10.379  -6.177   1.459
  255   1HD2  LEU  36          HD21      LEU  36   8.499  -7.999   4.833
  256   2HD2  LEU  36          HD22      LEU  36   7.530  -7.363   3.498
  257   3HD2  LEU  36          HD23      LEU  36   8.456  -8.861   3.277
  258    H    HIS  37           H        HIS  37  11.690  -9.932   6.229
  259    HA   HIS  37           HA       HIS  37  14.612 -10.044   5.805
  260   1HB   HIS  37          HB2       HIS  37  14.501 -12.114   7.117
  261   2HB   HIS  37          HB3       HIS  37  13.800 -10.748   7.960
  262    HD1  HIS  37           HD1      HIS  37  12.449 -13.711   5.844
  263    HD2  HIS  37           HD2      HIS  37  11.541 -11.264   9.140
  264    HE1  HIS  37           HE1      HIS  37  10.298 -14.657   6.873
  265    H    GLY  38           H        GLY  38  13.325  -9.789   3.436
  266   1HA   GLY  38          HA2       GLY  38  12.802 -10.667   1.392
  267   2HA   GLY  38          HA3       GLY  38  14.157 -11.748   1.730
  268    HA   PRO  39           HA       PRO  39  10.779 -14.586   3.273
  269   1HB   PRO  39          HB2       PRO  39   8.148 -13.891   3.622
  270   2HB   PRO  39          HB3       PRO  39   9.418 -13.540   4.833
  271   1HG   PRO  39          HG2       PRO  39   8.294 -11.690   2.710
  272   2HG   PRO  39          HG3       PRO  39   8.557 -11.351   4.452
  273   1HD   PRO  39          HD2       PRO  39  10.347 -10.623   2.514
  274   2HD   PRO  39          HD3       PRO  39  10.867 -11.132   4.157
  275    H    LEU  40           H        LEU  40   9.814 -12.502   0.585
  276    HA   LEU  40           HA       LEU  40   8.465 -14.751  -0.793
  277   1HB   LEU  40          HB2       LEU  40   8.111 -11.712  -0.812
  278   2HB   LEU  40          HB3       LEU  40   7.366 -12.777  -1.973
  279    HG   LEU  40           HG       LEU  40   6.840 -12.857   1.022
  280   1HD1  LEU  40          HD11      LEU  40   5.964 -10.826  -0.063
  281   2HD1  LEU  40          HD12      LEU  40   5.121 -11.820  -1.271
  282   3HD1  LEU  40          HD13      LEU  40   4.651 -11.899   0.442
  283   1HD2  LEU  40          HD21      LEU  40   6.474 -15.082   0.074
  284   2HD2  LEU  40          HD22      LEU  40   4.918 -14.326   0.408
  285   3HD2  LEU  40          HD23      LEU  40   5.522 -14.393  -1.262
  286    H    LEU  41           H        LEU  41  11.416 -13.713  -0.576
  287    HA   LEU  41           HA       LEU  41  13.235 -13.351  -1.796
  288   1HB   LEU  41          HB2       LEU  41  12.258 -15.298  -3.124
  289   2HB   LEU  41          HB3       LEU  41  11.662 -14.100  -4.266
  290    HG   LEU  41           HG       LEU  41  14.130 -13.306  -4.461
  291   1HD1  LEU  41          HD11      LEU  41  15.818 -14.980  -3.992
  292   2HD1  LEU  41          HD12      LEU  41  14.991 -14.580  -2.480
  293   3HD1  LEU  41          HD13      LEU  41  14.608 -16.095  -3.316
  294   1HD2  LEU  41          HD21      LEU  41  13.288 -16.057  -5.462
  295   2HD2  LEU  41          HD22      LEU  41  12.925 -14.501  -6.233
  296   3HD2  LEU  41          HD23      LEU  41  14.603 -15.059  -6.133
  297    H    GLU  42           H        GLU  42  10.320 -11.710  -2.836
  298    HA   GLU  42           HA       GLU  42  11.545  -9.148  -3.381
  299   1HB   GLU  42          HB2       GLU  42  11.019  -9.181  -5.853
  300   2HB   GLU  42          HB3       GLU  42  12.450 -10.052  -5.365
  301   1HG   GLU  42          HG2       GLU  42  11.232 -12.214  -5.570
  302   2HG   GLU  42          HG3       GLU  42   9.795 -11.356  -6.105
  303    H    ASP  43           H        ASP  43   9.937  -8.540  -1.913
  304    HA   ASP  43           HA       ASP  43   7.139  -9.139  -2.347
  305   1HB   ASP  43          HB2       ASP  43   7.923  -8.431  -0.160
  306   2HB   ASP  43          HB3       ASP  43   8.465  -6.878  -0.831
  307    H    LEU  44           H        LEU  44   9.321  -6.400  -3.308
  308    HA   LEU  44           HA       LEU  44   7.105  -5.360  -5.010
  309   1HB   LEU  44          HB2       LEU  44   9.906  -4.265  -4.669
  310   2HB   LEU  44          HB3       LEU  44   8.680  -3.558  -5.651
  311    HG   LEU  44           HG       LEU  44   8.571  -3.779  -2.626
  312   1HD1  LEU  44          HD11      LEU  44  10.050  -2.012  -3.667
  313   2HD1  LEU  44          HD12      LEU  44   8.620  -1.341  -4.458
  314   3HD1  LEU  44          HD13      LEU  44   8.717  -1.364  -2.685
  315   1HD2  LEU  44          HD21      LEU  44   6.283  -4.047  -3.420
  316   2HD2  LEU  44          HD22      LEU  44   6.485  -2.415  -2.792
  317   3HD2  LEU  44          HD23      LEU  44   6.470  -2.683  -4.549
  318    HA   PRO  45           HA       PRO  45   8.451  -7.708  -8.447
  319   1HB   PRO  45          HB2       PRO  45   7.819  -6.043 -10.603
  320   2HB   PRO  45          HB3       PRO  45   6.670  -6.964  -9.636
  321   1HG   PRO  45          HG2       PRO  45   7.500  -4.056  -9.393
  322   2HG   PRO  45          HG3       PRO  45   5.849  -4.729  -9.313
  323   1HD   PRO  45          HD2       PRO  45   7.307  -4.066  -7.078
  324   2HD   PRO  45          HD3       PRO  45   6.130  -5.419  -7.096
  325    H    ALA  46           H        ALA  46   9.503  -7.285 -10.709
  326    HA   ALA  46           HA       ALA  46  12.251  -6.442 -10.322
  327   1HB   ALA  46          HB1       ALA  46  10.759  -7.376 -12.828
  328   2HB   ALA  46          HB2       ALA  46  12.516  -7.227 -12.676
  329   3HB   ALA  46          HB3       ALA  46  11.654  -8.427 -11.701
  330    H    SER  47           H        SER  47  10.418  -4.306  -9.933
  331    HA   SER  47           HA       SER  47  11.265  -2.262 -11.759
  332   1HB   SER  47          HB2       SER  47   8.305  -2.798 -11.444
  333   2HB   SER  47          HB3       SER  47   9.043  -1.487 -12.369
  334    HG   SER  47           HG       SER  47   8.338  -3.230 -13.687
  335    H    GLY  48           H        GLY  48  11.558  -0.449 -10.399
  336   1HA   GLY  48          HA2       GLY  48  10.287   0.906  -8.585
  337   2HA   GLY  48          HA3       GLY  48  10.341  -0.598  -7.671
  338    H    ILE  49           H        ILE  49  11.682  -0.007  -6.069
  339    HA   ILE  49           HA       ILE  49  14.547   0.433  -6.754
  340    HB   ILE  49           HB       ILE  49  13.149   1.397  -4.258
  341   1HG1  ILE  49          HG12      ILE  49  12.095   2.695  -6.037
  342   2HG1  ILE  49          HG13      ILE  49  13.063   3.673  -4.963
  343   1HG2  ILE  49          HG21      ILE  49  15.147   2.822  -3.960
  344   2HG2  ILE  49          HG22      ILE  49  15.585   1.112  -4.058
  345   3HG2  ILE  49          HG23      ILE  49  15.845   2.161  -5.451
  346   1HD1  ILE  49          HD11      ILE  49  13.234   4.302  -7.377
  347   2HD1  ILE  49          HD12      ILE  49  14.786   3.975  -6.601
  348   3HD1  ILE  49          HD13      ILE  49  14.062   2.766  -7.689
  349    H    TRP  50           H        TRP  50  15.885  -1.101  -5.717
  350    HA   TRP  50           HA       TRP  50  14.665  -2.914  -3.672
  351   1HB   TRP  50          HB2       TRP  50  16.458  -3.456  -6.067
  352   2HB   TRP  50          HB3       TRP  50  16.561  -4.451  -4.650
  353    HD1  TRP  50           HD1      TRP  50  13.060  -3.439  -5.876
  354    HE1  TRP  50           HE1      TRP  50  11.900  -5.424  -6.989
  355    HE3  TRP  50           HE3      TRP  50  16.947  -6.770  -5.786
  356    HZ2  TRP  50           HZ2      TRP  50  12.534  -8.166  -7.622
  357    HZ3  TRP  50           HZ3      TRP  50  16.633  -9.072  -6.652
  358    HH2  TRP  50           HH2      TRP  50  14.431  -9.783  -7.565
  359    H    LEU  51           H        LEU  51  15.844  -2.940  -1.783
  360    HA   LEU  51           HA       LEU  51  18.690  -2.054  -1.873
  361   1HB   LEU  51          HB2       LEU  51  16.585  -1.390   0.226
  362   2HB   LEU  51          HB3       LEU  51  18.318  -1.223   0.482
  363    HG   LEU  51           HG       LEU  51  16.640   0.365  -1.517
  364   1HD1  LEU  51          HD11      LEU  51  16.353   0.976   0.879
  365   2HD1  LEU  51          HD12      LEU  51  18.104   1.201   1.031
  366   3HD1  LEU  51          HD13      LEU  51  17.160   2.253  -0.044
  367   1HD2  LEU  51          HD21      LEU  51  19.636   0.487  -0.920
  368   2HD2  LEU  51          HD22      LEU  51  18.862   0.095  -2.476
  369   3HD2  LEU  51          HD23      LEU  51  18.731   1.723  -1.819
  370    H    VAL  52           H        VAL  52  20.019  -3.502  -0.857
  371    HA   VAL  52           HA       VAL  52  18.697  -5.751   0.613
  372    HB   VAL  52           HB       VAL  52  21.178  -5.919  -1.133
  373   1HG1  VAL  52          HG11      VAL  52  20.820  -8.370  -0.926
  374   2HG1  VAL  52          HG12      VAL  52  21.111  -7.625   0.645
  375   3HG1  VAL  52          HG13      VAL  52  19.458  -8.078   0.176
  376   1HG2  VAL  52          HG21      VAL  52  19.243  -5.514  -2.605
  377   2HG2  VAL  52          HG22      VAL  52  19.753  -7.197  -2.735
  378   3HG2  VAL  52          HG23      VAL  52  18.320  -6.780  -1.775
  379    H    ILE  53           H        ILE  53  19.503  -6.247   2.575
  380    HA   ILE  53           HA       ILE  53  21.855  -4.771   3.592
  381    HB   ILE  53           HB       ILE  53  19.346  -5.119   5.264
  382   1HG1  ILE  53          HG12      ILE  53  19.048  -2.544   4.821
  383   2HG1  ILE  53          HG13      ILE  53  19.831  -2.895   3.280
  384   1HG2  ILE  53          HG21      ILE  53  21.555  -4.631   6.320
  385   2HG2  ILE  53          HG22      ILE  53  21.629  -3.123   5.409
  386   3HG2  ILE  53          HG23      ILE  53  20.348  -3.371   6.609
  387   1HD1  ILE  53          HD11      ILE  53  17.365  -2.911   3.134
  388   2HD1  ILE  53          HD12      ILE  53  17.993  -4.494   2.734
  389   3HD1  ILE  53          HD13      ILE  53  17.282  -4.211   4.334
  390    H    SER  54           H        SER  54  23.249  -6.290   4.078
  391    HA   SER  54           HA       SER  54  22.777  -8.471   5.862
  392   1HB   SER  54          HB2       SER  54  23.198  -9.103   2.900
  393   2HB   SER  54          HB3       SER  54  23.416 -10.276   4.209
  394    HG   SER  54           HG       SER  54  21.013  -8.898   4.227
  395    H    SER  55           H        SER  55  25.252  -9.895   5.040
  396    HA   SER  55           HA       SER  55  27.202  -7.831   4.399
  397   1HB   SER  55          HB2       SER  55  27.443  -9.379   7.012
  398   2HB   SER  55          HB3       SER  55  28.620  -8.225   6.349
  399    HG   SER  55           HG       SER  55  26.281  -7.020   6.407
  400    H    THR  56           H        THR  56  29.166  -8.746   3.631
  401    HA   THR  56           HA       THR  56  29.056 -11.672   3.097
  402    HB   THR  56           HB       THR  56  30.096 -10.969   0.853
  403    HG1  THR  56           HG1      THR  56  29.665  -8.938   0.211
  404   1HG2  THR  56          HG21      THR  56  27.820 -11.757   0.891
  405   2HG2  THR  56          HG22      THR  56  27.228 -10.192   1.487
  406   3HG2  THR  56          HG23      THR  56  27.915 -10.335  -0.147
  407    H    HIS  57           H        HIS  57  31.151  -8.931   3.962
  408    HA   HIS  57           HA       HIS  57  33.613 -10.428   3.902
  409   1HB   HIS  57          HB2       HIS  57  33.558  -7.966   4.016
  410   2HB   HIS  57          HB3       HIS  57  32.751  -8.039   5.576
  411    HD1  HIS  57           HD1      HIS  57  36.045  -9.876   4.450
  412    HD2  HIS  57           HD2      HIS  57  34.471  -7.227   7.339
  413    HE1  HIS  57           HE1      HIS  57  37.904  -9.427   6.113
  414    H    GLY  58           H        GLY  58  30.867 -10.403   6.102
  415   1HA   GLY  58          HA2       GLY  58  31.802 -12.667   7.596
  416   2HA   GLY  58          HA3       GLY  58  31.806 -11.172   8.561
  417    H    ALA  59           H        ALA  59  30.070 -12.785   9.587
  418    HA   ALA  59           HA       ALA  59  27.987 -13.546   9.925
  419   1HB   ALA  59          HB1       ALA  59  27.186 -10.773   8.963
  420   2HB   ALA  59          HB2       ALA  59  26.196 -11.877   9.941
  421   3HB   ALA  59          HB3       ALA  59  27.695 -11.208  10.612
  422    H    GLY  60           H        GLY  60  29.012 -14.604   7.726
  423   1HA   GLY  60          HA2       GLY  60  26.834 -15.128   5.863
  424   2HA   GLY  60          HA3       GLY  60  28.152 -14.130   5.217
  425    H    ASP  61           H        ASP  61  29.050 -15.590   3.892
  426    HA   ASP  61           HA       ASP  61  29.713 -17.422   2.835
  427   1HB   ASP  61          HB2       ASP  61  31.631 -16.387   3.533
  428   2HB   ASP  61          HB3       ASP  61  31.453 -16.946   5.185
  429    H    ILE  62           H        ILE  62  29.277 -18.544   6.242
  430    HA   ILE  62           HA       ILE  62  29.600 -21.281   5.687
  431    HB   ILE  62           HB       ILE  62  28.028 -19.886   7.883
  432   1HG1  ILE  62          HG12      ILE  62  30.826 -21.098   7.838
  433   2HG1  ILE  62          HG13      ILE  62  30.463 -19.375   7.772
  434   1HG2  ILE  62          HG21      ILE  62  28.110 -22.016   9.119
  435   2HG2  ILE  62          HG22      ILE  62  27.226 -22.232   7.623
  436   3HG2  ILE  62          HG23      ILE  62  28.903 -22.808   7.740
  437   1HD1  ILE  62          HD11      ILE  62  29.358 -19.547  10.018
  438   2HD1  ILE  62          HD12      ILE  62  29.961 -21.221  10.127
  439   3HD1  ILE  62          HD13      ILE  62  31.101 -19.877  10.007
  440    HA   PRO  63           HA       PRO  63  25.029 -21.790   4.534
  441   1HB   PRO  63          HB2       PRO  63  23.189 -19.796   4.510
  442   2HB   PRO  63          HB3       PRO  63  23.747 -20.525   6.039
  443   1HG   PRO  63          HG2       PRO  63  24.806 -17.994   4.725
  444   2HG   PRO  63          HG3       PRO  63  24.194 -18.190   6.404
  445   1HD   PRO  63          HD2       PRO  63  26.836 -18.346   5.817
  446   2HD   PRO  63          HD3       PRO  63  26.088 -19.393   7.059
  447    H    ASP  64           H        ASP  64  27.264 -21.013   2.941
  448    HA   ASP  64           HA       ASP  64  28.038 -20.228   1.008
  449   1HB   ASP  64          HB2       ASP  64  26.502 -21.990   0.179
  450   2HB   ASP  64          HB3       ASP  64  25.258 -20.764  -0.081
  451    H    ASN  65           H        ASN  65  27.067 -18.376   2.849
  452    HA   ASN  65           HA       ASN  65  26.608 -16.295   3.344
  453   1HB   ASN  65          HB2       ASN  65  28.394 -15.983   1.429
  454   2HB   ASN  65          HB3       ASN  65  27.068 -15.202   0.587
  455   1HD2  ASN  65          HD22      ASN  65  25.839 -13.644   2.517
  456   2HD2  ASN  65          HD21      ASN  65  27.040 -12.643   3.312
  457    H    LEU  66           H        LEU  66  24.698 -17.673   0.801
  458    HA   LEU  66           HA       LEU  66  22.342 -16.134   1.659
  459   1HB   LEU  66          HB2       LEU  66  23.084 -16.478  -1.291
  460   2HB   LEU  66          HB3       LEU  66  21.589 -15.851  -0.632
  461    HG   LEU  66           HG       LEU  66  23.315 -14.066   0.477
  462   1HD1  LEU  66          HD11      LEU  66  25.099 -13.478  -1.016
  463   2HD1  LEU  66          HD12      LEU  66  25.261 -15.218  -0.734
  464   3HD1  LEU  66          HD13      LEU  66  24.559 -14.650  -2.243
  465   1HD2  LEU  66          HD21      LEU  66  22.179 -13.938  -2.341
  466   2HD2  LEU  66          HD22      LEU  66  21.333 -13.497  -0.850
  467   3HD2  LEU  66          HD23      LEU  66  22.714 -12.543  -1.362
  468    H    SER  67           H        SER  67  20.791 -17.818   2.078
  469    HA   SER  67           HA       SER  67  21.677 -20.477   1.288
  470   1HB   SER  67          HB2       SER  67  19.335 -20.767   2.724
  471   2HB   SER  67          HB3       SER  67  20.986 -20.836   3.343
  472    HG   SER  67           HG       SER  67  19.714 -19.395   4.536
  473    HA   PRO  68           HA       PRO  68  17.824 -20.364  -1.412
  474   1HB   PRO  68          HB2       PRO  68  15.731 -18.713  -1.037
  475   2HB   PRO  68          HB3       PRO  68  16.139 -19.950   0.190
  476   1HG   PRO  68          HG2       PRO  68  16.814 -16.997   0.275
  477   2HG   PRO  68          HG3       PRO  68  16.167 -18.026   1.578
  478   1HD   PRO  68          HD2       PRO  68  18.824 -17.492   1.343
  479   2HD   PRO  68          HD3       PRO  68  18.110 -18.950   2.091
  480    H    PHE  69           H        PHE  69  18.693 -16.983  -0.783
  481    HA   PHE  69           HA       PHE  69  17.549 -15.845  -3.041
  482   1HB   PHE  69          HB2       PHE  69  19.602 -15.007  -1.057
  483   2HB   PHE  69          HB3       PHE  69  19.636 -14.144  -2.590
  484    HD1  PHE  69           HD1      PHE  69  17.829 -12.707  -3.308
  485    HD2  PHE  69           HD2      PHE  69  17.638 -14.811   0.458
  486    HE1  PHE  69           HE1      PHE  69  15.891 -11.324  -2.627
  487    HE2  PHE  69           HE2      PHE  69  15.680 -13.446   1.120
  488    HZ   PHE  69           HZ       PHE  69  14.784 -11.718  -0.446
  489    H    TYR  70           H        TYR  70  21.000 -16.805  -2.721
  490    HA   TYR  70           HA       TYR  70  21.589 -15.923  -5.356
  491   1HB   TYR  70          HB2       TYR  70  23.281 -16.216  -3.597
  492   2HB   TYR  70          HB3       TYR  70  23.090 -17.960  -3.723
  493    HD1  TYR  70           HD1      TYR  70  24.969 -18.923  -4.772
  494    HD2  TYR  70           HD2      TYR  70  23.504 -15.127  -6.222
  495    HE1  TYR  70           HE1      TYR  70  26.689 -18.932  -6.553
  496    HE2  TYR  70           HE2      TYR  70  25.226 -15.122  -7.977
  497    HH   TYR  70           HH       TYR  70  26.924 -16.318  -9.007
  498    H    GLU  71           H        GLU  71  20.643 -19.178  -4.140
  499    HA   GLU  71           HA       GLU  71  20.951 -20.524  -6.622
  500   1HB   GLU  71          HB2       GLU  71  18.925 -21.107  -4.418
  501   2HB   GLU  71          HB3       GLU  71  19.438 -22.201  -5.710
  502   1HG   GLU  71          HG2       GLU  71  21.819 -21.875  -4.767
  503   2HG   GLU  71          HG3       GLU  71  21.049 -21.188  -3.342
  504    H    ALA  72           H        ALA  72  18.045 -18.923  -5.162
  505    HA   ALA  72           HA       ALA  72  16.340 -19.400  -7.381
  506   1HB   ALA  72          HB1       ALA  72  14.941 -17.619  -6.417
  507   2HB   ALA  72          HB2       ALA  72  15.526 -18.717  -5.148
  508   3HB   ALA  72          HB3       ALA  72  16.277 -17.115  -5.359
  509    H    LEU  73           H        LEU  73  18.598 -16.654  -6.751
  510    HA   LEU  73           HA       LEU  73  17.691 -14.939  -8.771
  511   1HB   LEU  73          HB2       LEU  73  20.364 -15.423  -7.424
  512   2HB   LEU  73          HB3       LEU  73  20.313 -14.360  -8.800
  513    HG   LEU  73           HG       LEU  73  18.681 -14.046  -6.250
  514   1HD1  LEU  73          HD11      LEU  73  20.180 -12.143  -5.783
  515   2HD1  LEU  73          HD12      LEU  73  21.064 -13.667  -5.917
  516   3HD1  LEU  73          HD13      LEU  73  21.103 -12.505  -7.263
  517   1HD2  LEU  73          HD21      LEU  73  17.428 -12.973  -8.061
  518   2HD2  LEU  73          HD22      LEU  73  18.201 -11.724  -7.104
  519   3HD2  LEU  73          HD23      LEU  73  18.906 -12.193  -8.669
  520    H    GLN  74           H        GLN  74  20.301 -17.371  -8.984
  521    HA   GLN  74           HA       GLN  74  20.575 -16.873 -11.821
  522   1HB   GLN  74          HB2       GLN  74  21.720 -19.382 -10.567
  523   2HB   GLN  74          HB3       GLN  74  22.256 -18.438 -11.941
  524   1HG   GLN  74          HG2       GLN  74  22.760 -16.556 -10.322
  525   2HG   GLN  74          HG3       GLN  74  22.343 -17.670  -9.012
  526   1HE2  GLN  74          HE22      GLN  74  24.566 -17.060 -11.682
  527   2HE2  GLN  74          HE21      GLN  74  25.776 -18.248 -11.201
  528    H    GLU  75           H        GLU  75  18.422 -18.872 -10.035
  529    HA   GLU  75           HA       GLU  75  17.819 -20.694 -12.158
  530   1HB   GLU  75          HB2       GLU  75  17.223 -21.049  -9.735
  531   2HB   GLU  75          HB3       GLU  75  16.021 -19.778  -9.906
  532   1HG   GLU  75          HG2       GLU  75  14.843 -21.784 -10.074
  533   2HG   GLU  75          HG3       GLU  75  14.890 -21.139 -11.701
  534    H    GLN  76           H        GLN  76  16.266 -17.618 -11.081
  535    HA   GLN  76           HA       GLN  76  14.554 -17.735 -13.499
  536   1HB   GLN  76          HB2       GLN  76  13.306 -15.852 -12.368
  537   2HB   GLN  76          HB3       GLN  76  13.177 -17.466 -11.689
  538   1HG   GLN  76          HG2       GLN  76  14.330 -16.948  -9.769
  539   2HG   GLN  76          HG3       GLN  76  15.257 -15.644 -10.516
  540   1HE2  GLN  76          HE22      GLN  76  14.732 -14.364  -8.600
  541   2HE2  GLN  76          HE21      GLN  76  13.195 -13.522  -8.520
  542    H    LYS  77           H        LYS  77  17.209 -15.797 -12.303
  543    HA   LYS  77           HA       LYS  77  17.906 -13.682 -12.779
  544   1HB   LYS  77          HB2       LYS  77  18.146 -15.128 -15.413
  545   2HB   LYS  77          HB3       LYS  77  18.973 -13.607 -15.031
  546   1HG   LYS  77          HG2       LYS  77  20.055 -14.678 -13.109
  547   2HG   LYS  77          HG3       LYS  77  19.277 -16.216 -13.498
  548   1HD   LYS  77          HD2       LYS  77  21.194 -14.774 -15.364
  549   2HD   LYS  77          HD3       LYS  77  21.678 -16.027 -14.210
  550   1HE   LYS  77          HE2       LYS  77  20.106 -17.598 -15.294
  551   2HE   LYS  77          HE3       LYS  77  19.657 -16.365 -16.477
  552   1HZ   LYS  77          HZ1       LYS  77  22.373 -17.515 -16.159
  553   2HZ   LYS  77          HZ2       LYS  77  21.328 -17.869 -17.355
  554   3HZ   LYS  77          HZ3       LYS  77  21.959 -16.372 -17.254
  555    HA   PRO  78           HA       PRO  78  13.874 -12.225 -14.522
  556   1HB   PRO  78          HB2       PRO  78  13.289 -10.329 -12.551
  557   2HB   PRO  78          HB3       PRO  78  12.757 -12.021 -12.584
  558   1HG   PRO  78          HG2       PRO  78  15.081 -10.784 -11.120
  559   2HG   PRO  78          HG3       PRO  78  13.953 -12.032 -10.526
  560   1HD   PRO  78          HD2       PRO  78  16.474 -12.626 -11.440
  561   2HD   PRO  78          HD3       PRO  78  15.102 -13.729 -11.698
  562    H    ASP  79           H        ASP  79  13.146 -10.080 -15.141
  563    HA   ASP  79           HA       ASP  79  15.392  -8.676 -16.391
  564   1HB   ASP  79          HB2       ASP  79  13.464  -9.349 -17.737
  565   2HB   ASP  79          HB3       ASP  79  12.382  -8.382 -16.728
  566    H    LEU  80           H        LEU  80  16.073  -8.003 -14.174
  567    HA   LEU  80           HA       LEU  80  14.611  -5.974 -12.747
  568   1HB   LEU  80          HB2       LEU  80  17.532  -6.762 -12.680
  569   2HB   LEU  80          HB3       LEU  80  16.863  -5.567 -11.638
  570    HG   LEU  80           HG       LEU  80  16.598  -6.983 -10.072
  571   1HD1  LEU  80          HD11      LEU  80  14.272  -6.928 -10.684
  572   2HD1  LEU  80          HD12      LEU  80  14.478  -8.335 -11.765
  573   3HD1  LEU  80          HD13      LEU  80  14.695  -8.498 -10.009
  574   1HD2  LEU  80          HD21      LEU  80  16.958  -9.383 -10.233
  575   2HD2  LEU  80          HD22      LEU  80  16.937  -9.279 -12.006
  576   3HD2  LEU  80          HD23      LEU  80  18.215  -8.465 -11.061
  577    H    SER  81           H        SER  81  15.666  -5.460 -15.775
  578    HA   SER  81           HA       SER  81  17.345  -3.261 -15.796
  579   1HB   SER  81          HB2       SER  81  15.181  -4.145 -17.752
  580   2HB   SER  81          HB3       SER  81  16.723  -3.366 -18.087
  581    HG   SER  81           HG       SER  81  16.123  -5.953 -17.923
  582    H    ALA  82           H        ALA  82  14.234  -3.455 -14.567
  583    HA   ALA  82           HA       ALA  82  13.596  -0.599 -15.179
  584   1HB   ALA  82          HB1       ALA  82  11.239  -1.177 -14.806
  585   2HB   ALA  82          HB2       ALA  82  11.927  -2.149 -16.120
  586   3HB   ALA  82          HB3       ALA  82  11.683  -2.870 -14.512
  587    H    VAL  83           H        VAL  83  15.122  -2.373 -12.873
  588    HA   VAL  83           HA       VAL  83  14.155  -0.490 -10.800
  589    HB   VAL  83           HB       VAL  83  13.061  -2.454 -10.213
  590   1HG1  VAL  83          HG11      VAL  83  14.106  -4.656  -9.830
  591   2HG1  VAL  83          HG12      VAL  83  14.224  -4.155 -11.520
  592   3HG1  VAL  83          HG13      VAL  83  15.642  -4.026 -10.464
  593   1HG2  VAL  83          HG21      VAL  83  13.721  -2.913  -8.068
  594   2HG2  VAL  83          HG22      VAL  83  15.459  -2.776  -8.412
  595   3HG2  VAL  83          HG23      VAL  83  14.450  -1.336  -8.324
  596    H    ARG  84           H        ARG  84  15.659   0.227  -9.299
  597    HA   ARG  84           HA       ARG  84  18.508  -0.250 -10.063
  598   1HB   ARG  84          HB2       ARG  84  19.056   1.689  -8.688
  599   2HB   ARG  84          HB3       ARG  84  18.114   2.098 -10.111
  600   1HG   ARG  84          HG2       ARG  84  16.337   2.887  -8.925
  601   2HG   ARG  84          HG3       ARG  84  16.475   1.684  -7.648
  602   1HD   ARG  84          HD2       ARG  84  16.948   4.091  -6.926
  603   2HD   ARG  84          HD3       ARG  84  18.152   2.876  -6.498
  604    HE   ARG  84           HE       ARG  84  19.688   3.770  -7.915
  605   1HH1  ARG  84          HH11      ARG  84  16.640   5.519  -8.500
  606   2HH1  ARG  84          HH12      ARG  84  17.319   6.534  -9.718
  607   1HH2  ARG  84          HH22      ARG  84  20.537   5.004  -9.500
  608   2HH2  ARG  84          HH21      ARG  84  19.646   6.282 -10.276
  609    H    PHE  85           H        PHE  85  19.995  -0.609  -8.327
  610    HA   PHE  85           HA       PHE  85  18.809  -2.134  -6.050
  611   1HB   PHE  85          HB2       PHE  85  19.594  -3.733  -7.556
  612   2HB   PHE  85          HB3       PHE  85  20.911  -2.731  -8.120
  613    HD1  PHE  85           HD1      PHE  85  22.945  -3.721  -7.818
  614    HD2  PHE  85           HD2      PHE  85  19.966  -4.139  -4.719
  615    HE1  PHE  85           HE1      PHE  85  24.551  -5.014  -6.450
  616    HE2  PHE  85           HE2      PHE  85  21.599  -5.410  -3.351
  617    HZ   PHE  85           HZ       PHE  85  23.877  -5.872  -4.216
  618    H    GLY  86           H        GLY  86  20.009  -1.912  -4.076
  619   1HA   GLY  86          HA2       GLY  86  22.474  -0.298  -4.094
  620   2HA   GLY  86          HA3       GLY  86  21.152   0.242  -3.050
  621    H    ALA  87           H        ALA  87  23.816  -0.916  -2.289
  622    HA   ALA  87           HA       ALA  87  22.998  -3.468  -0.970
  623   1HB   ALA  87          HB1       ALA  87  25.691  -2.722  -2.192
  624   2HB   ALA  87          HB2       ALA  87  25.313  -4.225  -1.347
  625   3HB   ALA  87          HB3       ALA  87  24.527  -3.864  -2.893
  626    H    ILE  88           H        ILE  88  23.433  -3.548   1.170
  627    HA   ILE  88           HA       ILE  88  24.870  -1.275   2.440
  628    HB   ILE  88           HB       ILE  88  22.167  -2.453   3.206
  629   1HG1  ILE  88          HG12      ILE  88  22.776   0.132   1.728
  630   2HG1  ILE  88          HG13      ILE  88  21.805  -1.223   1.179
  631   1HG2  ILE  88          HG21      ILE  88  23.543   0.010   4.362
  632   2HG2  ILE  88          HG22      ILE  88  22.030  -0.741   4.888
  633   3HG2  ILE  88          HG23      ILE  88  23.539  -1.597   5.112
  634   1HD1  ILE  88          HD11      ILE  88  21.035   0.716   3.384
  635   2HD1  ILE  88          HD12      ILE  88  20.376   0.616   1.749
  636   3HD1  ILE  88          HD13      ILE  88  20.089  -0.705   2.892
  637    H    GLY  89           H        GLY  89  26.324  -1.987   3.895
  638   1HA   GLY  89          HA2       GLY  89  27.270  -3.257   5.594
  639   2HA   GLY  89          HA3       GLY  89  25.876  -4.344   5.563
  640    H    ILE  90           H        ILE  90  26.317  -4.675   2.558
  641    HA   ILE  90           HA       ILE  90  27.931  -6.959   2.321
  642    HB   ILE  90           HB       ILE  90  27.230  -4.807   0.298
  643   1HG1  ILE  90          HG12      ILE  90  25.160  -5.575   1.232
  644   2HG1  ILE  90          HG13      ILE  90  25.322  -6.255  -0.367
  645   1HG2  ILE  90          HG21      ILE  90  27.414  -6.473  -1.459
  646   2HG2  ILE  90          HG22      ILE  90  28.957  -6.277  -0.635
  647   3HG2  ILE  90          HG23      ILE  90  27.940  -7.696  -0.296
  648   1HD1  ILE  90          HD11      ILE  90  25.813  -7.779   2.222
  649   2HD1  ILE  90          HD12      ILE  90  24.378  -7.870   1.192
  650   3HD1  ILE  90          HD13      ILE  90  25.931  -8.446   0.573
  651    H    GLY  91           H        GLY  91  30.085  -7.274   1.709
  652   1HA   GLY  91          HA2       GLY  91  31.953  -4.944   2.001
  653   2HA   GLY  91          HA3       GLY  91  32.148  -6.446   2.894
  654    H    SER  92           H        SER  92  31.188  -7.944   0.359
  655    HA   SER  92           HA       SER  92  33.578  -8.662  -0.906
  656   1HB   SER  92          HB2       SER  92  31.808  -9.365  -2.736
  657   2HB   SER  92          HB3       SER  92  31.833 -10.141  -1.149
  658    HG   SER  92           HG       SER  92  29.913  -8.552  -2.298
  659    H    ARG  93           H        ARG  93  31.550  -5.866  -1.469
  660    HA   ARG  93           HA       ARG  93  32.466  -5.348  -4.139
  661   1HB   ARG  93          HB2       ARG  93  31.101  -3.631  -2.024
  662   2HB   ARG  93          HB3       ARG  93  31.392  -3.057  -3.659
  663   1HG   ARG  93          HG2       ARG  93  29.900  -5.656  -3.329
  664   2HG   ARG  93          HG3       ARG  93  29.074  -4.178  -2.911
  665   1HD   ARG  93          HD2       ARG  93  28.645  -4.898  -5.256
  666   2HD   ARG  93          HD3       ARG  93  29.274  -3.264  -5.082
  667    HE   ARG  93           HE       ARG  93  30.979  -3.794  -6.428
  668   1HH1  ARG  93          HH11      ARG  93  30.076  -6.972  -4.891
  669   2HH1  ARG  93          HH12      ARG  93  31.086  -7.809  -6.041
  670   1HH2  ARG  93          HH21      ARG  93  32.329  -5.150  -7.795
  671   2HH2  ARG  93          HH22      ARG  93  32.305  -6.879  -7.502
  672    H    GLU  94           H        GLU  94  33.857  -4.540  -1.012
  673    HA   GLU  94           HA       GLU  94  35.867  -2.824  -2.416
  674   1HB   GLU  94          HB2       GLU  94  34.224  -2.032  -0.018
  675   2HB   GLU  94          HB3       GLU  94  35.543  -1.074  -0.693
  676   1HG   GLU  94          HG2       GLU  94  34.261  -0.807  -2.812
  677   2HG   GLU  94          HG3       GLU  94  32.897  -1.667  -2.078
  678    H    TYR  95           H        TYR  95  35.154  -4.873   0.352
  679    HA   TYR  95           HA       TYR  95  37.871  -4.246   1.458
  680   1HB   TYR  95          HB2       TYR  95  35.824  -3.309   2.643
  681   2HB   TYR  95          HB3       TYR  95  35.399  -4.965   3.054
  682    HD1  TYR  95           HD1      TYR  95  37.897  -2.245   3.501
  683    HD2  TYR  95           HD2      TYR  95  36.637  -6.160   4.811
  684    HE1  TYR  95           HE1      TYR  95  39.412  -2.071   5.448
  685    HE2  TYR  95           HE2      TYR  95  38.152  -5.995   6.764
  686    HH   TYR  95           HH       TYR  95  40.221  -3.118   7.370
  687    H    ASP  96           H        ASP  96  35.453  -6.873   0.954
  688    HA   ASP  96           HA       ASP  96  37.330  -8.799   2.124
  689   1HB   ASP  96          HB2       ASP  96  34.759  -8.890   2.312
  690   2HB   ASP  96          HB3       ASP  96  34.765  -9.460   0.646
  691    H    THR  97           H        THR  97  37.784  -7.228  -0.436
  692    HA   THR  97           HA       THR  97  37.641  -8.972  -2.651
  693    HB   THR  97           HB       THR  97  39.028  -6.966  -3.664
  694    HG1  THR  97           HG1      THR  97  39.247  -5.227  -2.342
  695   1HG2  THR  97          HG21      THR  97  36.556  -7.145  -3.857
  696   2HG2  THR  97          HG22      THR  97  36.371  -6.373  -2.268
  697   3HG2  THR  97          HG23      THR  97  37.075  -5.470  -3.627
  698    H    PHE  98           H        PHE  98  39.498  -9.592  -0.306
  699    HA   PHE  98           HA       PHE  98  42.059 -10.197  -1.661
  700   1HB   PHE  98          HB2       PHE  98  42.014  -9.572   0.745
  701   2HB   PHE  98          HB3       PHE  98  41.010 -10.975   1.094
  702    HD1  PHE  98           HD1      PHE  98  42.043 -13.078   1.587
  703    HD2  PHE  98           HD2      PHE  98  44.348  -9.964  -0.315
  704    HE1  PHE  98           HE1      PHE  98  44.101 -14.434   1.856
  705    HE2  PHE  98           HE2      PHE  98  46.405 -11.325  -0.041
  706    HZ   PHE  98           HZ       PHE  98  46.286 -13.563   1.043
  707    H    CYS  99           H        CYS  99  39.050 -11.841  -0.542
  708    HA   CYS  99           HA       CYS  99  39.551 -14.081  -2.370
  709   1HB   CYS  99          HB2       CYS  99  39.326 -15.744  -0.484
  710   2HB   CYS  99          HB3       CYS  99  40.815 -14.800  -0.420
  711    HG   CYS  99           HG       CYS  99  39.902 -15.204   2.005
  712    H    GLY 100           H        GLY 100  37.540 -11.892  -1.832
  713   1HA   GLY 100          HA2       GLY 100  35.173 -13.085  -0.772
  714   2HA   GLY 100          HA3       GLY 100  35.326 -11.488  -1.515
  715    H    ALA 101           H        ALA 101  35.568 -14.920  -2.619
  716    HA   ALA 101           HA       ALA 101  34.643 -14.509  -5.241
  717   1HB   ALA 101          HB1       ALA 101  34.234 -16.939  -5.261
  718   2HB   ALA 101          HB2       ALA 101  35.774 -16.561  -4.466
  719   3HB   ALA 101          HB3       ALA 101  34.347 -16.988  -3.490
  720    H    ILE 102           H        ILE 102  32.729 -14.600  -2.275
  721    HA   ILE 102           HA       ILE 102  30.226 -15.181  -3.467
  722    HB   ILE 102           HB       ILE 102  29.174 -14.436  -1.528
  723   1HG1  ILE 102          HG12      ILE 102  30.126 -12.268  -1.109
  724   2HG1  ILE 102          HG13      ILE 102  30.136 -13.270   0.331
  725   1HG2  ILE 102          HG21      ILE 102  31.819 -15.738  -0.742
  726   2HG2  ILE 102          HG22      ILE 102  30.338 -15.713   0.218
  727   3HG2  ILE 102          HG23      ILE 102  30.360 -16.547  -1.343
  728   1HD1  ILE 102          HD11      ILE 102  32.530 -12.526  -1.374
  729   2HD1  ILE 102          HD12      ILE 102  32.171 -11.999   0.271
  730   3HD1  ILE 102          HD13      ILE 102  32.601 -13.688  -0.021
  731    H    ASP 103           H        ASP 103  32.195 -12.446  -3.963
  732    HA   ASP 103           HA       ASP 103  30.593 -10.285  -4.601
  733   1HB   ASP 103          HB2       ASP 103  32.916 -10.086  -4.918
  734   2HB   ASP 103          HB3       ASP 103  33.027 -11.607  -5.802
  735    H    LYS 104           H        LYS 104  30.704 -13.408  -6.220
  736    HA   LYS 104           HA       LYS 104  29.520 -12.756  -8.679
  737   1HB   LYS 104          HB2       LYS 104  29.370 -15.289  -7.013
  738   2HB   LYS 104          HB3       LYS 104  28.792 -15.148  -8.680
  739   1HG   LYS 104          HG2       LYS 104  30.984 -14.666  -9.484
  740   2HG   LYS 104          HG3       LYS 104  31.660 -14.531  -7.870
  741   1HD   LYS 104          HD2       LYS 104  32.315 -16.649  -8.827
  742   2HD   LYS 104          HD3       LYS 104  31.235 -16.925  -7.452
  743   1HE   LYS 104          HE2       LYS 104  29.339 -17.308  -9.002
  744   2HE   LYS 104          HE3       LYS 104  30.385 -16.963 -10.387
  745   1HZ   LYS 104          HZ1       LYS 104  31.696 -18.918  -9.793
  746   2HZ   LYS 104          HZ2       LYS 104  30.730 -19.232  -8.510
  747   3HZ   LYS 104          HZ3       LYS 104  30.140 -19.335 -10.024
  748    H    LEU 105           H        LEU 105  27.994 -12.769  -5.490
  749    HA   LEU 105           HA       LEU 105  25.285 -13.155  -6.372
  750   1HB   LEU 105          HB2       LEU 105  25.899 -13.395  -4.062
  751   2HB   LEU 105          HB3       LEU 105  26.536 -11.776  -3.966
  752    HG   LEU 105           HG       LEU 105  24.387 -12.138  -2.835
  753   1HD1  LEU 105          HD11      LEU 105  23.323 -10.099  -3.318
  754   2HD1  LEU 105          HD12      LEU 105  25.056  -9.848  -3.574
  755   3HD1  LEU 105          HD13      LEU 105  23.956 -10.043  -4.964
  756   1HD2  LEU 105          HD21      LEU 105  22.289 -12.274  -4.095
  757   2HD2  LEU 105          HD22      LEU 105  23.181 -12.339  -5.623
  758   3HD2  LEU 105          HD23      LEU 105  23.331 -13.665  -4.442
  759    H    GLU 106           H        GLU 106  27.048 -10.061  -5.491
  760    HA   GLU 106           HA       GLU 106  25.219  -8.350  -6.667
  761   1HB   GLU 106          HB2       GLU 106  28.232  -7.929  -6.636
  762   2HB   GLU 106          HB3       GLU 106  26.957  -6.720  -6.670
  763   1HG   GLU 106          HG2       GLU 106  27.397  -6.659  -4.502
  764   2HG   GLU 106          HG3       GLU 106  26.168  -7.884  -4.402
  765    H    ALA 107           H        ALA 107  27.957 -10.064  -8.170
  766    HA   ALA 107           HA       ALA 107  27.904  -8.753 -10.673
  767   1HB   ALA 107          HB1       ALA 107  28.568 -11.693 -10.280
  768   2HB   ALA 107          HB2       ALA 107  29.136 -10.617 -11.558
  769   3HB   ALA 107          HB3       ALA 107  29.693 -10.361  -9.891
  770    H    GLU 108           H        GLU 108  26.085 -11.732  -9.624
  771    HA   GLU 108           HA       GLU 108  24.733 -12.077 -12.130
  772   1HB   GLU 108          HB2       GLU 108  24.216 -12.999  -9.304
  773   2HB   GLU 108          HB3       GLU 108  23.100 -13.338 -10.607
  774   1HG   GLU 108          HG2       GLU 108  25.988 -14.299 -10.481
  775   2HG   GLU 108          HG3       GLU 108  24.522 -15.216 -10.201
  776    H    LEU 109           H        LEU 109  23.907 -10.173  -9.187
  777    HA   LEU 109           HA       LEU 109  21.260  -9.489 -10.038
  778   1HB   LEU 109          HB2       LEU 109  23.298  -8.193  -8.187
  779   2HB   LEU 109          HB3       LEU 109  21.795  -7.361  -8.572
  780    HG   LEU 109           HG       LEU 109  21.974 -10.110  -7.275
  781   1HD1  LEU 109          HD11      LEU 109  21.299  -8.955  -5.224
  782   2HD1  LEU 109          HD12      LEU 109  22.786  -8.226  -5.846
  783   3HD1  LEU 109          HD13      LEU 109  21.240  -7.398  -6.081
  784   1HD2  LEU 109          HD21      LEU 109  19.846  -9.905  -8.483
  785   2HD2  LEU 109          HD22      LEU 109  19.547  -9.709  -6.758
  786   3HD2  LEU 109          HD23      LEU 109  19.580  -8.282  -7.812
  787    H    LYS 110           H        LYS 110  24.404  -7.819 -10.583
  788    HA   LYS 110           HA       LYS 110  23.301  -5.644 -12.046
  789   1HB   LYS 110          HB2       LYS 110  26.082  -6.897 -12.005
  790   2HB   LYS 110          HB3       LYS 110  25.693  -5.344 -12.765
  791   1HG   LYS 110          HG2       LYS 110  25.091  -4.353 -10.651
  792   2HG   LYS 110          HG3       LYS 110  25.082  -5.871  -9.827
  793   1HD   LYS 110          HD2       LYS 110  27.039  -4.972  -9.072
  794   2HD   LYS 110          HD3       LYS 110  27.602  -6.077 -10.303
  795   1HE   LYS 110          HE2       LYS 110  27.171  -3.080 -10.772
  796   2HE   LYS 110          HE3       LYS 110  28.686  -3.757 -10.184
  797   1HZ   LYS 110          HZ1       LYS 110  28.849  -5.048 -12.238
  798   2HZ   LYS 110          HZ2       LYS 110  27.479  -4.355 -12.820
  799   3HZ   LYS 110          HZ3       LYS 110  28.798  -3.452 -12.535
  800    H    ASN 111           H        ASN 111  24.507  -8.842 -12.985
  801    HA   ASN 111           HA       ASN 111  24.336  -8.522 -15.827
  802   1HB   ASN 111          HB2       ASN 111  25.573 -10.343 -15.389
  803   2HB   ASN 111          HB3       ASN 111  24.851 -10.640 -13.844
  804   1HD2  ASN 111          HD21      ASN 111  22.901 -11.849 -13.604
  805   2HD2  ASN 111          HD22      ASN 111  22.617 -13.123 -14.751
  806    H    SER 112           H        SER 112  21.965  -9.410 -13.330
  807    HA   SER 112           HA       SER 112  20.037 -10.437 -15.174
  808   1HB   SER 112          HB2       SER 112  19.686  -9.448 -12.348
  809   2HB   SER 112          HB3       SER 112  18.488 -10.370 -13.278
  810    HG   SER 112           HG       SER 112  21.057 -11.191 -12.405
  811    H    GLY 113           H        GLY 113  20.693  -7.130 -13.988
  812   1HA   GLY 113          HA2       GLY 113  19.871  -5.838 -16.165
  813   2HA   GLY 113          HA3       GLY 113  18.306  -6.089 -15.397
  814    H    ALA 114           H        ALA 114  19.381  -5.718 -12.606
  815    HA   ALA 114           HA       ALA 114  18.976  -2.878 -12.525
  816   1HB   ALA 114          HB1       ALA 114  18.131  -4.184 -10.680
  817   2HB   ALA 114          HB2       ALA 114  19.745  -4.879 -10.354
  818   3HB   ALA 114          HB3       ALA 114  19.400  -3.161 -10.060
  819    H    LYS 115           H        LYS 115  20.557  -1.500 -11.118
  820    HA   LYS 115           HA       LYS 115  23.392  -2.242 -11.483
  821   1HB   LYS 115          HB2       LYS 115  23.954   0.101 -12.057
  822   2HB   LYS 115          HB3       LYS 115  23.024  -0.719 -13.312
  823   1HG   LYS 115          HG2       LYS 115  20.973   0.481 -12.630
  824   2HG   LYS 115          HG3       LYS 115  21.828   1.221 -11.277
  825   1HD   LYS 115          HD2       LYS 115  21.626   2.833 -13.044
  826   2HD   LYS 115          HD3       LYS 115  23.332   2.399 -12.863
  827   1HE   LYS 115          HE2       LYS 115  23.146   0.864 -14.813
  828   2HE   LYS 115          HE3       LYS 115  21.430   1.258 -14.967
  829   1HZ   LYS 115          HZ1       LYS 115  22.066   3.548 -15.451
  830   2HZ   LYS 115          HZ2       LYS 115  23.655   3.186 -15.302
  831   3HZ   LYS 115          HZ3       LYS 115  22.777   2.534 -16.508
  832    H    GLN 116           H        GLN 116  24.646  -1.615  -9.699
  833    HA   GLN 116           HA       GLN 116  23.146  -0.877  -7.303
  834   1HB   GLN 116          HB2       GLN 116  25.073  -2.529  -7.289
  835   2HB   GLN 116          HB3       GLN 116  26.144  -1.146  -7.543
  836   1HG   GLN 116          HG2       GLN 116  25.115  -0.068  -5.490
  837   2HG   GLN 116          HG3       GLN 116  24.188  -1.548  -5.226
  838   1HE2  GLN 116          HE22      GLN 116  26.516  -0.072  -3.724
  839   2HE2  GLN 116          HE21      GLN 116  27.638  -1.378  -3.391
  840    H    THR 117           H        THR 117  22.588   1.256  -7.095
  841    HA   THR 117           HA       THR 117  24.052   3.357  -8.538
  842    HB   THR 117           HB       THR 117  21.819   3.477  -6.474
  843    HG1  THR 117           HG1      THR 117  21.621   2.422  -8.696
  844   1HG2  THR 117          HG21      THR 117  22.756   5.588  -8.478
  845   2HG2  THR 117          HG22      THR 117  21.340   5.718  -7.406
  846   3HG2  THR 117          HG23      THR 117  22.958   5.684  -6.716
  847    H    GLY 118           H        GLY 118  25.279   5.028  -7.533
  848   1HA   GLY 118          HA2       GLY 118  26.368   6.196  -5.903
  849   2HA   GLY 118          HA3       GLY 118  25.544   5.232  -4.687
  850    H    GLU 119           H        GLU 119  26.523   3.547  -3.760
  851    HA   GLU 119           HA       GLU 119  28.951   2.221  -4.508
  852   1HB   GLU 119          HB2       GLU 119  30.408   3.080  -2.767
  853   2HB   GLU 119          HB3       GLU 119  29.984   4.369  -3.880
  854   1HG   GLU 119          HG2       GLU 119  28.256   5.172  -2.220
  855   2HG   GLU 119          HG3       GLU 119  28.821   3.925  -1.103
  856    H    THR 120           H        THR 120  29.648   1.070  -2.240
  857    HA   THR 120           HA       THR 120  27.147  -0.200  -1.309
  858    HB   THR 120           HB       THR 120  30.003  -0.885  -0.533
  859    HG1  THR 120           HG1      THR 120  29.994  -1.172  -2.675
  860   1HG2  THR 120          HG21      THR 120  27.405  -2.488  -0.609
  861   2HG2  THR 120          HG22      THR 120  29.011  -3.130  -0.216
  862   3HG2  THR 120          HG23      THR 120  28.238  -1.948   0.861
  863    H    LEU 121           H        LEU 121  26.151   0.262   0.576
  864    HA   LEU 121           HA       LEU 121  27.071   2.588   2.112
  865   1HB   LEU 121          HB2       LEU 121  24.652   1.866   1.247
  866   2HB   LEU 121          HB3       LEU 121  24.639   0.891   2.702
  867    HG   LEU 121           HG       LEU 121  24.959   3.882   2.547
  868   1HD1  LEU 121          HD11      LEU 121  22.701   2.967   1.914
  869   2HD1  LEU 121          HD12      LEU 121  22.542   2.435   3.604
  870   3HD1  LEU 121          HD13      LEU 121  22.744   4.165   3.209
  871   1HD2  LEU 121          HD21      LEU 121  25.983   3.405   4.589
  872   2HD2  LEU 121          HD22      LEU 121  24.346   3.829   5.027
  873   3HD2  LEU 121          HD23      LEU 121  24.806   2.113   4.975
  874    H    LYS 122           H        LYS 122  27.489   2.320   4.521
  875    HA   LYS 122           HA       LYS 122  27.599  -0.478   5.520
  876   1HB   LYS 122          HB2       LYS 122  29.665   1.643   6.223
  877   2HB   LYS 122          HB3       LYS 122  29.601  -0.013   6.773
  878   1HG   LYS 122          HG2       LYS 122  30.339   1.035   4.055
  879   2HG   LYS 122          HG3       LYS 122  31.400   0.259   5.203
  880   1HD   LYS 122          HD2       LYS 122  30.829  -1.871   4.566
  881   2HD   LYS 122          HD3       LYS 122  29.163  -1.460   4.209
  882   1HE   LYS 122          HE2       LYS 122  30.318  -2.005   2.142
  883   2HE   LYS 122          HE3       LYS 122  29.839  -0.305   2.148
  884   1HZ   LYS 122          HZ1       LYS 122  32.572  -1.347   2.617
  885   2HZ   LYS 122          HZ2       LYS 122  32.056  -0.455   1.331
  886   3HZ   LYS 122          HZ3       LYS 122  32.155   0.229   2.797
  887    H    ILE 123           H        ILE 123  26.883  -0.657   7.647
  888    HA   ILE 123           HA       ILE 123  26.321   1.808   9.188
  889    HB   ILE 123           HB       ILE 123  24.150   0.507   9.849
  890   1HG1  ILE 123          HG12      ILE 123  23.089  -0.763   8.064
  891   2HG1  ILE 123          HG13      ILE 123  24.507  -0.675   7.055
  892   1HG2  ILE 123          HG21      ILE 123  24.240   2.683   8.687
  893   2HG2  ILE 123          HG22      ILE 123  24.306   1.836   7.132
  894   3HG2  ILE 123          HG23      ILE 123  22.879   1.680   8.173
  895   1HD1  ILE 123          HD11      ILE 123  25.717  -2.190   8.514
  896   2HD1  ILE 123          HD12      ILE 123  24.455  -2.075   9.765
  897   3HD1  ILE 123          HD13      ILE 123  24.120  -2.880   8.217
  898    H    ASN 124           H        ASN 124  25.729   1.280  11.399
  899    HA   ASN 124           HA       ASN 124  25.431   0.019  13.232
  900   1HB   ASN 124          HB2       ASN 124  26.147  -2.024  13.723
  901   2HB   ASN 124          HB3       ASN 124  26.368  -2.167  12.001
  902   1HD2  ASN 124          HD22      ASN 124  28.621  -1.911  11.204
  903   2HD2  ASN 124          HD21      ASN 124  29.967  -2.366  12.254
  904    H    ILE 125           H        ILE 125  26.175   0.576  15.193
  905    HA   ILE 125           HA       ILE 125  28.998   1.303  15.597
  906    HB   ILE 125           HB       ILE 125  28.505   3.292  16.809
  907   1HG1  ILE 125          HG12      ILE 125  26.356   2.899  17.819
  908   2HG1  ILE 125          HG13      ILE 125  26.386   4.422  16.963
  909   1HG2  ILE 125          HG21      ILE 125  28.901   3.529  14.419
  910   2HG2  ILE 125          HG22      ILE 125  27.154   3.508  14.102
  911   3HG2  ILE 125          HG23      ILE 125  27.870   4.821  15.053
  912   1HD1  ILE 125          HD11      ILE 125  24.953   1.885  16.086
  913   2HD1  ILE 125          HD12      ILE 125  24.241   3.400  16.644
  914   3HD1  ILE 125          HD13      ILE 125  25.078   3.357  15.086
  915    H    LEU 126           H        LEU 126  26.698  -0.807  16.370
  916    HA   LEU 126           HA       LEU 126  26.186  -0.512  19.139
  917   1HB   LEU 126          HB2       LEU 126  24.861  -1.858  17.553
  918   2HB   LEU 126          HB3       LEU 126  26.176  -3.003  17.368
  919    HG   LEU 126           HG       LEU 126  24.247  -3.713  18.781
  920   1HD1  LEU 126          HD11      LEU 126  26.801  -3.787  20.415
  921   2HD1  LEU 126          HD12      LEU 126  25.459  -4.933  20.404
  922   3HD1  LEU 126          HD13      LEU 126  26.498  -4.792  18.979
  923   1HD2  LEU 126          HD21      LEU 126  23.964  -2.940  21.051
  924   2HD2  LEU 126          HD22      LEU 126  25.319  -1.807  20.897
  925   3HD2  LEU 126          HD23      LEU 126  23.834  -1.563  19.946
  926    H    ASP 127           H        ASP 127  28.579  -2.540  17.399
  927    HA   ASP 127           HA       ASP 127  30.451  -2.214  19.669
  928   1HB   ASP 127          HB2       ASP 127  29.247  -4.404  19.929
  929   2HB   ASP 127          HB3       ASP 127  29.863  -4.894  18.352
  930    H    HIS 128           H        HIS 128  29.989  -1.200  16.824
  931    HA   HIS 128           HA       HIS 128  30.985  -0.889  14.836
  932   1HB   HIS 128          HB2       HIS 128  33.410  -0.821  16.653
  933   2HB   HIS 128          HB3       HIS 128  33.458  -0.407  14.941
  934    HD1  HIS 128           HD1      HIS 128  32.704   1.970  14.262
  935    HD2  HIS 128           HD2      HIS 128  31.693   0.857  18.197
  936    HE1  HIS 128           HE1      HIS 128  31.731   4.058  15.378
  937    H    ASP 129           H        ASP 129  30.073  -3.195  14.738
  938    HA   ASP 129           HA       ASP 129  31.875  -5.387  14.269
  939   1HB   ASP 129          HB2       ASP 129  29.062  -5.012  13.200
  940   2HB   ASP 129          HB3       ASP 129  29.943  -6.510  13.283
  941    H    ILE 130           H        ILE 130  31.250  -6.389  12.006
  942    HA   ILE 130           HA       ILE 130  32.934  -6.476  10.298
  943    HB   ILE 130           HB       ILE 130  30.094  -5.942   9.481
  944   1HG1  ILE 130          HG12      ILE 130  31.677  -8.484   9.824
  945   2HG1  ILE 130          HG13      ILE 130  30.572  -7.823  11.023
  946   1HG2  ILE 130          HG21      ILE 130  31.588  -5.615   7.435
  947   2HG2  ILE 130          HG22      ILE 130  32.226  -7.245   7.734
  948   3HG2  ILE 130          HG23      ILE 130  30.518  -6.990   7.317
  949   1HD1  ILE 130          HD11      ILE 130  28.695  -8.030   9.385
  950   2HD1  ILE 130          HD12      ILE 130  29.814  -8.894   8.297
  951   3HD1  ILE 130          HD13      ILE 130  29.431  -9.564   9.889
  952    HA   PRO 131           HA       PRO 131  33.290  -2.783   7.482
  953   1HB   PRO 131          HB2       PRO 131  31.674  -0.593   7.495
  954   2HB   PRO 131          HB3       PRO 131  31.165  -2.145   6.765
  955   1HG   PRO 131          HG2       PRO 131  30.564  -1.255   9.625
  956   2HG   PRO 131          HG3       PRO 131  29.395  -1.694   8.383
  957   1HD   PRO 131          HD2       PRO 131  30.172  -3.599  10.030
  958   2HD   PRO 131          HD3       PRO 131  30.141  -3.957   8.285
  959    H    GLU 132           H        GLU 132  32.164  -1.855  10.635
  960    HA   GLU 132           HA       GLU 132  33.247  -1.169  12.479
  961   1HB   GLU 132          HB2       GLU 132  35.366  -2.028  11.343
  962   2HB   GLU 132          HB3       GLU 132  35.704  -0.344  10.907
  963   1HG   GLU 132          HG2       GLU 132  35.715   0.271  13.308
  964   2HG   GLU 132          HG3       GLU 132  35.325  -1.395  13.739
  965    H    ASP 133           H        ASP 133  32.708   0.820   9.731
  966    HA   ASP 133           HA       ASP 133  32.353   3.217  11.442
  967   1HB   ASP 133          HB2       ASP 133  34.583   3.447  10.522
  968   2HB   ASP 133          HB3       ASP 133  34.016   3.030   8.906
  969    HA   PRO 134           HA       PRO 134  28.705   2.849   8.766
  970   1HB   PRO 134          HB2       PRO 134  27.142   4.829   9.809
  971   2HB   PRO 134          HB3       PRO 134  27.461   3.301  10.688
  972   1HG   PRO 134          HG2       PRO 134  28.909   5.952  11.001
  973   2HG   PRO 134          HG3       PRO 134  28.191   4.932  12.285
  974   1HD   PRO 134          HD2       PRO 134  30.835   4.795  11.659
  975   2HD   PRO 134          HD3       PRO 134  29.922   3.319  12.092
  976    H    ALA 135           H        ALA 135  27.544   4.226   7.201
  977    HA   ALA 135           HA       ALA 135  28.995   6.664   6.293
  978   1HB   ALA 135          HB1       ALA 135  29.869   4.706   5.056
  979   2HB   ALA 135          HB2       ALA 135  28.215   4.266   4.574
  980   3HB   ALA 135          HB3       ALA 135  28.939   5.780   3.995
  981    H    GLU 136           H        GLU 136  26.760   6.947   7.794
  982    HA   GLU 136           HA       GLU 136  24.279   6.664   6.508
  983   1HB   GLU 136          HB2       GLU 136  23.406   8.167   8.199
  984   2HB   GLU 136          HB3       GLU 136  24.543   7.021   8.906
  985   1HG   GLU 136          HG2       GLU 136  26.311   8.782   8.913
  986   2HG   GLU 136          HG3       GLU 136  25.168   9.929   8.213
  987    H    GLU 137           H        GLU 137  26.729   9.075   5.893
  988    HA   GLU 137           HA       GLU 137  25.146  11.146   4.738
  989   1HB   GLU 137          HB2       GLU 137  27.973  10.203   4.110
  990   2HB   GLU 137          HB3       GLU 137  27.262  11.723   3.546
  991   1HG   GLU 137          HG2       GLU 137  26.919  12.425   5.924
  992   2HG   GLU 137          HG3       GLU 137  27.741  10.958   6.460
  993    H    TRP 138           H        TRP 138  26.032   7.977   3.531
  994    HA   TRP 138           HA       TRP 138  25.708   8.161   0.742
  995   1HB   TRP 138          HB2       TRP 138  26.232   6.212   2.330
  996   2HB   TRP 138          HB3       TRP 138  24.552   6.019   2.548
  997    HD1  TRP 138           HD1      TRP 138  27.321   4.981   0.400
  998    HE1  TRP 138           HE1      TRP 138  26.489   3.254  -1.296
  999    HE3  TRP 138           HE3      TRP 138  22.265   5.690   0.848
 1000    HZ2  TRP 138           HZ2      TRP 138  24.010   2.420  -2.465
 1001    HZ3  TRP 138           HZ3      TRP 138  20.699   4.312  -0.475
 1002    HH2  TRP 138           HH2      TRP 138  21.547   2.705  -2.163
 1003    H    LEU 139           H        LEU 139  23.373   7.553   3.268
 1004    HA   LEU 139           HA       LEU 139  21.040   7.296   1.737
 1005   1HB   LEU 139          HB2       LEU 139  21.619   7.261   4.441
 1006   2HB   LEU 139          HB3       LEU 139  20.715   8.743   4.345
 1007    HG   LEU 139           HG       LEU 139  18.829   7.501   3.218
 1008   1HD1  LEU 139          HD11      LEU 139  19.983   5.518   2.321
 1009   2HD1  LEU 139          HD12      LEU 139  20.525   5.062   3.950
 1010   3HD1  LEU 139          HD13      LEU 139  18.807   4.993   3.524
 1011   1HD2  LEU 139          HD21      LEU 139  18.069   6.418   5.323
 1012   2HD2  LEU 139          HD22      LEU 139  19.733   6.506   5.955
 1013   3HD2  LEU 139          HD23      LEU 139  18.822   7.994   5.627
 1014    H    GLY 140           H        GLY 140  22.138  10.269   3.369
 1015   1HA   GLY 140          HA2       GLY 140  20.194  12.010   2.272
 1016   2HA   GLY 140          HA3       GLY 140  21.781  12.506   2.882
 1017    H    SER 141           H        SER 141  23.514  11.176   0.977
 1018    HA   SER 141           HA       SER 141  23.585  12.945  -1.164
 1019   1HB   SER 141          HB2       SER 141  24.759  10.201  -0.510
 1020   2HB   SER 141          HB3       SER 141  25.244  11.189  -1.840
 1021    HG   SER 141           HG       SER 141  25.532  11.588   0.913
 1022    H    TRP 142           H        TRP 142  22.876   9.435  -1.165
 1023    HA   TRP 142           HA       TRP 142  22.074   9.135  -3.804
 1024   1HB   TRP 142          HB2       TRP 142  22.705   7.348  -2.299
 1025   2HB   TRP 142          HB3       TRP 142  21.322   7.681  -1.270
 1026    HD1  TRP 142           HD1      TRP 142  21.978   6.444  -4.865
 1027    HE1  TRP 142           HE1      TRP 142  20.134   4.767  -5.494
 1028    HE3  TRP 142           HE3      TRP 142  19.214   6.688  -0.575
 1029    HZ2  TRP 142           HZ2      TRP 142  17.796   3.588  -4.223
 1030    HZ3  TRP 142           HZ3      TRP 142  17.190   5.252  -0.307
 1031    HH2  TRP 142           HH2      TRP 142  16.488   3.711  -2.112
 1032    H    VAL 143           H        VAL 143  19.958   9.793  -0.939
 1033    HA   VAL 143           HA       VAL 143  17.507   9.786  -2.356
 1034    HB   VAL 143           HB       VAL 143  18.443  11.055   0.234
 1035   1HG1  VAL 143          HG11      VAL 143  16.143  11.578   0.827
 1036   2HG1  VAL 143          HG12      VAL 143  16.626  12.520  -0.567
 1037   3HG1  VAL 143          HG13      VAL 143  15.585  11.091  -0.798
 1038   1HG2  VAL 143          HG21      VAL 143  16.480   8.784  -0.374
 1039   2HG2  VAL 143          HG22      VAL 143  18.153   8.568   0.146
 1040   3HG2  VAL 143          HG23      VAL 143  16.995   9.327   1.240
 1041    H    ASN 144           H        ASN 144  19.607  12.666  -1.482
 1042    HA   ASN 144           HA       ASN 144  17.817  14.340  -2.948
 1043   1HB   ASN 144          HB2       ASN 144  18.899  16.145  -2.267
 1044   2HB   ASN 144          HB3       ASN 144  19.435  15.030  -1.019
 1045   1HD2  ASN 144          HD22      ASN 144  21.602  13.995  -1.390
 1046   2HD2  ASN 144          HD21      ASN 144  22.791  14.851  -2.351
 1047    H    LEU 145           H        LEU 145  20.416  12.333  -4.019
 1048    HA   LEU 145           HA       LEU 145  20.793  13.727  -6.556
 1049   1HB   LEU 145          HB2       LEU 145  21.843  11.233  -5.282
 1050   2HB   LEU 145          HB3       LEU 145  21.649  11.165  -7.021
 1051    HG   LEU 145           HG       LEU 145  23.021  13.144  -7.357
 1052   1HD1  LEU 145          HD11      LEU 145  24.342  14.163  -5.567
 1053   2HD1  LEU 145          HD12      LEU 145  22.622  14.366  -5.223
 1054   3HD1  LEU 145          HD13      LEU 145  23.557  13.132  -4.357
 1055   1HD2  LEU 145          HD21      LEU 145  24.357  11.053  -5.582
 1056   2HD2  LEU 145          HD22      LEU 145  24.061  10.910  -7.328
 1057   3HD2  LEU 145          HD23      LEU 145  25.183  12.138  -6.725
 1058    H    LEU 146           H        LEU 146  18.945  10.751  -5.514
 1059    HA   LEU 146           HA       LEU 146  17.989  10.322  -8.165
 1060   1HB   LEU 146          HB2       LEU 146  16.848   8.535  -7.308
 1061   2HB   LEU 146          HB3       LEU 146  18.360   8.590  -6.443
 1062    HG   LEU 146           HG       LEU 146  16.832   9.773  -4.581
 1063   1HD1  LEU 146          HD11      LEU 146  14.579   8.721  -4.476
 1064   2HD1  LEU 146          HD12      LEU 146  14.693   9.815  -5.847
 1065   3HD1  LEU 146          HD13      LEU 146  14.808   8.065  -6.106
 1066   1HD2  LEU 146          HD21      LEU 146  16.783   6.780  -5.129
 1067   2HD2  LEU 146          HD22      LEU 146  18.073   7.674  -4.302
 1068   3HD2  LEU 146          HD23      LEU 146  16.475   7.562  -3.562
 1069    H    LYS 147           H        LYS 147  16.744  12.104  -5.421
 1070    HA   LYS 147           HA       LYS 147  14.091  12.618  -6.216
 1071   1HB   LYS 147          HB2       LYS 147  16.181  14.107  -4.612
 1072   2HB   LYS 147          HB3       LYS 147  14.696  14.939  -5.073
 1073   1HG   LYS 147          HG2       LYS 147  13.320  13.197  -4.013
 1074   2HG   LYS 147          HG3       LYS 147  14.777  12.311  -3.532
 1075   1HD   LYS 147          HD2       LYS 147  15.525  14.280  -2.206
 1076   2HD   LYS 147          HD3       LYS 147  14.057  15.155  -2.648
 1077   1HE   LYS 147          HE2       LYS 147  14.107  12.497  -1.144
 1078   2HE   LYS 147          HE3       LYS 147  14.058  14.071  -0.355
 1079   1HZ   LYS 147          HZ1       LYS 147  11.957  13.049  -2.176
 1080   2HZ   LYS 147          HZ2       LYS 147  11.900  13.063  -0.540
 1081   3HZ   LYS 147          HZ3       LYS 147  11.921  14.479  -1.369
  Start of MODEL    6
    1   1H    MET   1          H1        MET   1   1.515  -3.309   0.273
    2   2H    MET   1          H2        MET   1   3.040  -3.166   0.878
    3   3H    MET   1          H3        MET   1   1.878  -2.124   1.361
    4    HA   MET   1           HA       MET   1   3.014  -2.365  -1.323
    5   1HB   MET   1          HB2       MET   1   1.745  -0.429  -2.003
    6   2HB   MET   1          HB3       MET   1   0.660  -1.706  -1.474
    7   1HG   MET   1          HG2       MET   1   0.343  -0.519   0.699
    8   2HG   MET   1          HG3       MET   1   1.421   0.767   0.138
    9   1HE   MET   1          HE1       MET   1  -2.065   2.526   0.180
   10   2HE   MET   1          HE2       MET   1  -1.469   1.297   1.317
   11   3HE   MET   1          HE3       MET   1  -0.379   2.579   0.740
   12    H    ALA   2           H        ALA   2   4.655  -0.895  -1.874
   13    HA   ALA   2           HA       ALA   2   5.570   1.127   0.005
   14   1HB   ALA   2          HB1       ALA   2   7.165  -1.432  -0.524
   15   2HB   ALA   2          HB2       ALA   2   7.811   0.023   0.242
   16   3HB   ALA   2          HB3       ALA   2   6.521  -0.895   1.047
   17    H    ASP   3           H        ASP   3   7.616   2.170  -0.951
   18    HA   ASP   3           HA       ASP   3   7.565   2.155  -3.910
   19   1HB   ASP   3          HB2       ASP   3   7.526   4.359  -2.631
   20   2HB   ASP   3          HB3       ASP   3   9.103   3.943  -1.988
   21    H    ILE   4           H        ILE   4   9.457   1.276  -1.079
   22    HA   ILE   4           HA       ILE   4  11.553   0.087  -2.847
   23    HB   ILE   4           HB       ILE   4  11.975   1.342  -0.121
   24   1HG1  ILE   4          HG12      ILE   4  12.559   2.581  -2.834
   25   2HG1  ILE   4          HG13      ILE   4  11.335   3.139  -1.691
   26   1HG2  ILE   4          HG21      ILE   4  13.617  -0.407  -0.840
   27   2HG2  ILE   4          HG22      ILE   4  13.967   0.542  -2.291
   28   3HG2  ILE   4          HG23      ILE   4  14.358   1.170  -0.669
   29   1HD1  ILE   4          HD11      ILE   4  13.125   3.664  -0.039
   30   2HD1  ILE   4          HD12      ILE   4  14.333   3.316  -1.304
   31   3HD1  ILE   4          HD13      ILE   4  13.173   4.628  -1.526
   32    H    THR   5           H        THR   5  12.030  -2.024  -2.458
   33    HA   THR   5           HA       THR   5  10.843  -3.382  -0.105
   34    HB   THR   5           HB       THR   5  10.479  -4.401  -2.301
   35    HG1  THR   5           HG1      THR   5  10.656  -5.828  -0.636
   36   1HG2  THR   5          HG21      THR   5  12.233  -5.433  -3.624
   37   2HG2  THR   5          HG22      THR   5  12.355  -3.672  -3.608
   38   3HG2  THR   5          HG23      THR   5  13.470  -4.646  -2.628
   39    H    LEU   6           H        LEU   6  12.141  -3.856   1.658
   40    HA   LEU   6           HA       LEU   6  15.082  -3.301   1.461
   41   1HB   LEU   6          HB2       LEU   6  13.059  -3.121   3.681
   42   2HB   LEU   6          HB3       LEU   6  14.717  -3.480   4.083
   43    HG   LEU   6           HG       LEU   6  14.019  -1.093   4.305
   44   1HD1  LEU   6          HD11      LEU   6  16.364  -1.676   4.283
   45   2HD1  LEU   6          HD12      LEU   6  16.399  -1.680   2.508
   46   3HD1  LEU   6          HD13      LEU   6  16.129  -0.165   3.396
   47   1HD2  LEU   6          HD21      LEU   6  13.876   0.370   2.403
   48   2HD2  LEU   6          HD22      LEU   6  14.258  -0.953   1.286
   49   3HD2  LEU   6          HD23      LEU   6  12.713  -0.949   2.159
   50    H    ILE   7           H        ILE   7  15.747  -5.167   0.687
   51    HA   ILE   7           HA       ILE   7  14.645  -7.750   1.557
   52    HB   ILE   7           HB       ILE   7  16.796  -7.134  -0.517
   53   1HG1  ILE   7          HG12      ILE   7  13.863  -7.679  -1.133
   54   2HG1  ILE   7          HG13      ILE   7  14.525  -6.052  -1.033
   55   1HG2  ILE   7          HG21      ILE   7  16.342  -9.390  -1.365
   56   2HG2  ILE   7          HG22      ILE   7  16.716  -9.506   0.346
   57   3HG2  ILE   7          HG23      ILE   7  15.028  -9.607  -0.196
   58   1HD1  ILE   7          HD11      ILE   7  15.485  -8.154  -3.005
   59   2HD1  ILE   7          HD12      ILE   7  14.444  -6.771  -3.349
   60   3HD1  ILE   7          HD13      ILE   7  16.119  -6.504  -2.830
   61    H    SER   8           H        SER   8  15.424  -7.546   3.826
   62    HA   SER   8           HA       SER   8  18.319  -7.396   4.215
   63   1HB   SER   8          HB2       SER   8  16.464  -6.623   5.859
   64   2HB   SER   8          HB3       SER   8  16.333  -8.339   6.296
   65    HG   SER   8           HG       SER   8  17.872  -7.057   7.551
   66    H    GLY   9           H        GLY   9  19.646  -9.108   4.920
   67   1HA   GLY   9          HA2       GLY   9  20.046 -11.240   5.727
   68   2HA   GLY   9          HA3       GLY   9  18.460 -11.798   5.178
   69    H    SER  10           H        SER  10  20.056 -13.521   4.790
   70    HA   SER  10           HA       SER  10  21.032 -13.544   1.986
   71   1HB   SER  10          HB2       SER  10  23.151 -14.586   3.078
   72   2HB   SER  10          HB3       SER  10  22.948 -12.829   3.207
   73    HG   SER  10           HG       SER  10  23.548 -13.817   5.196
   74    H    THR  11           H        THR  11  20.764 -15.396   5.046
   75    HA   THR  11           HA       THR  11  19.787 -17.743   3.506
   76    HB   THR  11           HB       THR  11  21.518 -17.730   5.984
   77    HG1  THR  11           HG1      THR  11  22.784 -17.169   4.348
   78   1HG2  THR  11          HG21      THR  11  20.170 -19.807   5.853
   79   2HG2  THR  11          HG22      THR  11  20.606 -19.999   4.144
   80   3HG2  THR  11          HG23      THR  11  21.849 -20.134   5.405
   81    H    LEU  12           H        LEU  12  17.904 -16.163   3.803
   82    HA   LEU  12           HA       LEU  12  15.967 -15.521   4.671
   83   1HB   LEU  12          HB2       LEU  12  15.711 -17.922   4.035
   84   2HB   LEU  12          HB3       LEU  12  15.822 -18.348   5.742
   85    HG   LEU  12           HG       LEU  12  13.765 -16.903   6.159
   86   1HD1  LEU  12          HD11      LEU  12  12.350 -16.311   4.216
   87   2HD1  LEU  12          HD12      LEU  12  13.863 -15.401   4.196
   88   3HD1  LEU  12          HD13      LEU  12  13.656 -16.787   3.111
   89   1HD2  LEU  12          HD21      LEU  12  12.184 -18.527   5.216
   90   2HD2  LEU  12          HD22      LEU  12  13.442 -19.141   4.119
   91   3HD2  LEU  12          HD23      LEU  12  13.607 -19.345   5.877
   92    H    GLY  13           H        GLY  13  17.813 -14.490   6.122
   93   1HA   GLY  13          HA2       GLY  13  16.581 -13.596   8.472
   94   2HA   GLY  13          HA3       GLY  13  17.816 -14.790   8.945
   95    H    GLY  14           H        GLY  14  17.978 -11.860   9.431
   96   1HA   GLY  14          HA2       GLY  14  20.515 -11.187   8.219
   97   2HA   GLY  14          HA3       GLY  14  19.143 -10.386   7.433
   98    H    ALA  15           H        ALA  15  20.588  -8.607   8.196
   99    HA   ALA  15           HA       ALA  15  20.450  -7.766  10.970
  100   1HB   ALA  15          HB1       ALA  15  21.407  -6.326   8.451
  101   2HB   ALA  15          HB2       ALA  15  21.678  -5.808  10.128
  102   3HB   ALA  15          HB3       ALA  15  22.421  -7.304   9.540
  103    H    GLU  16           H        GLU  16  17.915  -8.152  10.597
  104    HA   GLU  16           HA       GLU  16  16.350  -6.254   9.223
  105   1HB   GLU  16          HB2       GLU  16  15.759  -7.848  11.742
  106   2HB   GLU  16          HB3       GLU  16  14.559  -6.878  10.872
  107   1HG   GLU  16          HG2       GLU  16  14.936  -8.215   8.819
  108   2HG   GLU  16          HG3       GLU  16  16.126  -9.202   9.668
  109    H    TYR  17           H        TYR  17  18.018  -5.880  12.336
  110    HA   TYR  17           HA       TYR  17  16.728  -3.515  13.247
  111   1HB   TYR  17          HB2       TYR  17  18.273  -4.754  14.645
  112   2HB   TYR  17          HB3       TYR  17  19.587  -4.527  13.496
  113    HD1  TYR  17           HD1      TYR  17  21.003  -2.602  13.592
  114    HD2  TYR  17           HD2      TYR  17  17.326  -2.688  15.856
  115    HE1  TYR  17           HE1      TYR  17  21.674  -0.522  14.752
  116    HE2  TYR  17           HE2      TYR  17  17.988  -0.608  17.021
  117    HH   TYR  17           HH       TYR  17  19.613   1.047  17.250
  118    H    VAL  18           H        VAL  18  19.369  -3.983  10.841
  119    HA   VAL  18           HA       VAL  18  19.871  -1.129  10.522
  120    HB   VAL  18           HB       VAL  18  20.668  -3.565   8.856
  121   1HG1  VAL  18          HG11      VAL  18  21.727  -0.718   8.675
  122   2HG1  VAL  18          HG12      VAL  18  22.317  -2.139   7.769
  123   3HG1  VAL  18          HG13      VAL  18  20.701  -1.523   7.469
  124   1HG2  VAL  18          HG21      VAL  18  21.676  -3.561  11.133
  125   2HG2  VAL  18          HG22      VAL  18  22.888  -3.272   9.887
  126   3HG2  VAL  18          HG23      VAL  18  22.277  -1.915  10.859
  127    H    ALA  19           H        ALA  19  18.026  -3.718   8.852
  128    HA   ALA  19           HA       ALA  19  17.133  -2.132   6.678
  129   1HB   ALA  19          HB1       ALA  19  15.662  -4.450   7.989
  130   2HB   ALA  19          HB2       ALA  19  15.459  -3.850   6.334
  131   3HB   ALA  19          HB3       ALA  19  16.988  -4.611   6.809
  132    H    GLU  20           H        GLU  20  15.668  -2.612   9.938
  133    HA   GLU  20           HA       GLU  20  13.362  -1.011   9.426
  134   1HB   GLU  20          HB2       GLU  20  13.634  -2.722  11.234
  135   2HB   GLU  20          HB3       GLU  20  14.720  -1.612  12.086
  136   1HG   GLU  20          HG2       GLU  20  12.872   0.063  12.194
  137   2HG   GLU  20          HG3       GLU  20  11.816  -1.049  11.324
  138    H    HIS  21           H        HIS  21  16.601  -0.194  10.828
  139    HA   HIS  21           HA       HIS  21  15.983   2.518  11.444
  140   1HB   HIS  21          HB2       HIS  21  17.977   1.377  12.294
  141   2HB   HIS  21          HB3       HIS  21  18.620   1.202  10.660
  142    HD1  HIS  21           HD1      HIS  21  20.037   3.251   9.760
  143    HD2  HIS  21           HD2      HIS  21  17.761   4.028  13.218
  144    HE1  HIS  21           HE1      HIS  21  20.693   5.581  10.539
  145    H    LEU  22           H        LEU  22  17.313   1.003   8.483
  146    HA   LEU  22           HA       LEU  22  17.594   3.326   6.880
  147   1HB   LEU  22          HB2       LEU  22  17.020   0.394   6.329
  148   2HB   LEU  22          HB3       LEU  22  17.061   1.540   5.015
  149    HG   LEU  22           HG       LEU  22  19.375   1.210   6.986
  150   1HD1  LEU  22          HD11      LEU  22  20.413  -0.209   5.272
  151   2HD1  LEU  22          HD12      LEU  22  18.943  -0.946   5.914
  152   3HD1  LEU  22          HD13      LEU  22  18.905  -0.174   4.316
  153   1HD2  LEU  22          HD21      LEU  22  19.431   3.307   5.670
  154   2HD2  LEU  22          HD22      LEU  22  20.720   2.208   5.177
  155   3HD2  LEU  22          HD23      LEU  22  19.267   2.373   4.166
  156    H    ALA  23           H        ALA  23  14.880   1.005   7.055
  157    HA   ALA  23           HA       ALA  23  13.047   2.242   5.395
  158   1HB   ALA  23          HB1       ALA  23  12.565   0.729   7.996
  159   2HB   ALA  23          HB2       ALA  23  11.308   1.137   6.838
  160   3HB   ALA  23          HB3       ALA  23  12.631   0.056   6.354
  161    H    GLU  24           H        GLU  24  13.554   2.959   8.913
  162    HA   GLU  24           HA       GLU  24  11.534   4.885   9.176
  163   1HB   GLU  24          HB2       GLU  24  13.096   3.856  10.951
  164   2HB   GLU  24          HB3       GLU  24  14.259   5.095  10.535
  165   1HG   GLU  24          HG2       GLU  24  12.609   6.839  11.064
  166   2HG   GLU  24          HG3       GLU  24  11.400   5.614  11.454
  167    H    LYS  25           H        LYS  25  15.013   5.463   8.446
  168    HA   LYS  25           HA       LYS  25  14.769   8.235   7.970
  169   1HB   LYS  25          HB2       LYS  25  16.696   6.147   6.846
  170   2HB   LYS  25          HB3       LYS  25  16.926   7.868   6.683
  171   1HG   LYS  25          HG2       LYS  25  16.824   6.245   9.278
  172   2HG   LYS  25          HG3       LYS  25  18.229   6.949   8.553
  173   1HD   LYS  25          HD2       LYS  25  15.977   8.300  10.022
  174   2HD   LYS  25          HD3       LYS  25  17.694   8.294  10.408
  175   1HE   LYS  25          HE2       LYS  25  18.065   9.654   8.269
  176   2HE   LYS  25          HE3       LYS  25  16.301   9.803   8.153
  177   1HZ   LYS  25          HZ1       LYS  25  17.269  11.707   9.262
  178   2HZ   LYS  25          HZ2       LYS  25  16.325  10.904  10.320
  179   3HZ   LYS  25          HZ3       LYS  25  17.953  10.779  10.410
  180    H    LEU  26           H        LEU  26  14.448   5.557   5.662
  181    HA   LEU  26           HA       LEU  26  14.186   7.202   3.328
  182   1HB   LEU  26          HB2       LEU  26  13.269   4.393   3.992
  183   2HB   LEU  26          HB3       LEU  26  13.073   5.094   2.383
  184    HG   LEU  26           HG       LEU  26  15.796   4.926   3.743
  185   1HD1  LEU  26          HD11      LEU  26  16.237   2.883   2.527
  186   2HD1  LEU  26          HD12      LEU  26  14.832   2.646   3.569
  187   3HD1  LEU  26          HD13      LEU  26  14.601   2.889   1.822
  188   1HD2  LEU  26          HD21      LEU  26  15.655   6.489   1.836
  189   2HD2  LEU  26          HD22      LEU  26  16.656   5.086   1.456
  190   3HD2  LEU  26          HD23      LEU  26  15.001   5.194   0.815
  191    H    GLU  27           H        GLU  27  11.708   5.936   5.658
  192    HA   GLU  27           HA       GLU  27   9.500   7.055   4.241
  193   1HB   GLU  27          HB2       GLU  27   9.936   6.200   7.125
  194   2HB   GLU  27          HB3       GLU  27   8.420   6.870   6.535
  195   1HG   GLU  27          HG2       GLU  27   8.321   5.084   4.785
  196   2HG   GLU  27          HG3       GLU  27   9.741   4.329   5.477
  197    H    GLU  28           H        GLU  28  11.681   8.428   6.791
  198    HA   GLU  28           HA       GLU  28  10.380  10.950   6.940
  199   1HB   GLU  28          HB2       GLU  28  13.247  10.026   7.391
  200   2HB   GLU  28          HB3       GLU  28  12.735  11.669   7.659
  201   1HG   GLU  28          HG2       GLU  28  11.519   9.274   9.085
  202   2HG   GLU  28          HG3       GLU  28  12.858  10.234   9.699
  203    H    ALA  29           H        ALA  29  12.604   9.576   4.520
  204    HA   ALA  29           HA       ALA  29  13.199  12.119   3.256
  205   1HB   ALA  29          HB1       ALA  29  14.205  10.754   1.497
  206   2HB   ALA  29          HB2       ALA  29  14.742  10.193   3.092
  207   3HB   ALA  29          HB3       ALA  29  13.518   9.283   2.177
  208    H    GLY  30           H        GLY  30  10.512   9.894   3.122
  209   1HA   GLY  30          HA2       GLY  30   8.463  10.912   2.421
  210   2HA   GLY  30          HA3       GLY  30   9.282  11.637   1.038
  211    H    PHE  31           H        PHE  31  10.074   8.274   1.698
  212    HA   PHE  31           HA       PHE  31   8.178   7.416  -0.455
  213   1HB   PHE  31          HB2       PHE  31  10.905   6.180  -0.251
  214   2HB   PHE  31          HB3       PHE  31   9.804   6.250  -1.602
  215    HD1  PHE  31           HD1      PHE  31  12.581   7.892   0.110
  216    HD2  PHE  31           HD2      PHE  31   9.537   8.436  -2.900
  217    HE1  PHE  31           HE1      PHE  31  13.791   9.876  -0.762
  218    HE2  PHE  31           HE2      PHE  31  10.748  10.425  -3.762
  219    HZ   PHE  31           HZ       PHE  31  12.873  11.151  -2.692
  220    H    THR  32           H        THR  32   7.367   5.202  -0.190
  221    HA   THR  32           HA       THR  32   7.382   4.453   2.646
  222    HB   THR  32           HB       THR  32   5.650   2.779   1.702
  223    HG1  THR  32           HG1      THR  32   4.687   3.574  -0.263
  224   1HG2  THR  32          HG21      THR  32   3.875   4.493   1.767
  225   2HG2  THR  32          HG22      THR  32   5.079   4.768   3.036
  226   3HG2  THR  32          HG23      THR  32   5.091   5.779   1.572
  227    H    THR  33           H        THR  33   7.964   2.374   3.306
  228    HA   THR  33           HA       THR  33   9.555   0.762   1.388
  229    HB   THR  33           HB       THR  33  11.315   0.584   2.989
  230    HG1  THR  33           HG1      THR  33  10.124   0.898   4.930
  231   1HG2  THR  33          HG21      THR  33  11.226   2.658   1.440
  232   2HG2  THR  33          HG22      THR  33  10.726   3.561   2.877
  233   3HG2  THR  33          HG23      THR  33  12.299   2.719   2.843
  234    H    GLU  34           H        GLU  34   9.742  -1.555   2.013
  235    HA   GLU  34           HA       GLU  34   7.996  -2.331   4.268
  236   1HB   GLU  34          HB2       GLU  34   7.695  -2.805   1.455
  237   2HB   GLU  34          HB3       GLU  34   8.318  -4.276   2.131
  238   1HG   GLU  34          HG2       GLU  34   6.519  -4.079   3.916
  239   2HG   GLU  34          HG3       GLU  34   5.928  -2.630   3.134
  240    H    THR  35           H        THR  35   9.450  -2.722   5.836
  241    HA   THR  35           HA       THR  35  12.072  -3.741   5.442
  242    HB   THR  35           HB       THR  35  10.451  -3.950   7.999
  243    HG1  THR  35           HG1      THR  35  10.747  -1.841   8.363
  244   1HG2  THR  35          HG21      THR  35  13.364  -3.242   7.447
  245   2HG2  THR  35          HG22      THR  35  12.633  -3.580   9.036
  246   3HG2  THR  35          HG23      THR  35  12.805  -4.879   7.836
  247    H    LEU  36           H        LEU  36  12.614  -5.842   4.981
  248    HA   LEU  36           HA       LEU  36  10.857  -8.092   5.825
  249   1HB   LEU  36          HB2       LEU  36  11.893  -7.487   3.016
  250   2HB   LEU  36          HB3       LEU  36  11.118  -8.987   3.480
  251    HG   LEU  36           HG       LEU  36   9.735  -6.292   3.617
  252   1HD1  LEU  36          HD11      LEU  36   8.630  -6.932   1.532
  253   2HD1  LEU  36          HD12      LEU  36  10.383  -6.810   1.318
  254   3HD1  LEU  36          HD13      LEU  36   9.621  -8.412   1.442
  255   1HD2  LEU  36          HD21      LEU  36   7.666  -7.642   3.695
  256   2HD2  LEU  36          HD22      LEU  36   8.621  -9.139   3.682
  257   3HD2  LEU  36          HD23      LEU  36   8.705  -8.032   5.067
  258    H    HIS  37           H        HIS  37  11.948 -10.191   5.489
  259    HA   HIS  37           HA       HIS  37  14.918 -10.032   5.446
  260   1HB   HIS  37          HB2       HIS  37  14.931 -12.120   6.715
  261   2HB   HIS  37          HB3       HIS  37  14.140 -10.815   7.581
  262    HD1  HIS  37           HD1      HIS  37  12.958 -13.767   5.346
  263    HD2  HIS  37           HD2      HIS  37  11.919 -11.528   8.748
  264    HE1  HIS  37           HE1      HIS  37  10.856 -14.870   6.320
  265    H    GLY  38           H        GLY  38  13.537  -9.781   3.110
  266   1HA   GLY  38          HA2       GLY  38  12.999 -10.623   1.061
  267   2HA   GLY  38          HA3       GLY  38  14.482 -11.554   1.271
  268    HA   PRO  39           HA       PRO  39  11.330 -14.728   2.830
  269   1HB   PRO  39          HB2       PRO  39   8.626 -14.239   2.993
  270   2HB   PRO  39          HB3       PRO  39   9.784 -13.836   4.296
  271   1HG   PRO  39          HG2       PRO  39   8.703 -12.006   2.131
  272   2HG   PRO  39          HG3       PRO  39   8.803 -11.699   3.895
  273   1HD   PRO  39          HD2       PRO  39  10.694 -10.769   2.172
  274   2HD   PRO  39          HD3       PRO  39  11.133 -11.377   3.802
  275    H    LEU  40           H        LEU  40  10.340 -12.709   0.097
  276    HA   LEU  40           HA       LEU  40   9.710 -15.116  -1.508
  277   1HB   LEU  40          HB2       LEU  40   8.608 -12.259  -1.457
  278   2HB   LEU  40          HB3       LEU  40   8.341 -13.362  -2.775
  279    HG   LEU  40           HG       LEU  40   7.405 -13.833   0.082
  280   1HD1  LEU  40          HD11      LEU  40   5.844 -13.026  -2.410
  281   2HD1  LEU  40          HD12      LEU  40   5.157 -13.370  -0.805
  282   3HD1  LEU  40          HD13      LEU  40   6.225 -11.976  -1.027
  283   1HD2  LEU  40          HD21      LEU  40   6.020 -15.653  -0.918
  284   2HD2  LEU  40          HD22      LEU  40   6.859 -15.421  -2.468
  285   3HD2  LEU  40          HD23      LEU  40   7.746 -15.986  -1.034
  286    H    LEU  41           H        LEU  41  12.251 -13.456  -0.800
  287    HA   LEU  41           HA       LEU  41  14.044 -12.460  -1.650
  288   1HB   LEU  41          HB2       LEU  41  13.891 -14.518  -3.147
  289   2HB   LEU  41          HB3       LEU  41  13.223 -13.447  -4.378
  290    HG   LEU  41           HG       LEU  41  15.333 -12.016  -4.129
  291   1HD1  LEU  41          HD11      LEU  41  17.332 -13.249  -3.214
  292   2HD1  LEU  41          HD12      LEU  41  16.187 -12.718  -1.984
  293   3HD1  LEU  41          HD13      LEU  41  16.198 -14.415  -2.489
  294   1HD2  LEU  41          HD21      LEU  41  16.711 -13.635  -5.457
  295   2HD2  LEU  41          HD22      LEU  41  15.528 -14.896  -5.074
  296   3HD2  LEU  41          HD23      LEU  41  15.040 -13.484  -6.030
  297    H    GLU  42           H        GLU  42  11.024 -11.575  -3.184
  298    HA   GLU  42           HA       GLU  42  11.887  -8.803  -3.644
  299   1HB   GLU  42          HB2       GLU  42  11.389  -9.004  -6.104
  300   2HB   GLU  42          HB3       GLU  42  12.873  -9.759  -5.566
  301   1HG   GLU  42          HG2       GLU  42  11.794 -11.999  -5.662
  302   2HG   GLU  42          HG3       GLU  42  10.317 -11.263  -6.270
  303    H    ASP  43           H        ASP  43  10.209  -8.382  -2.128
  304    HA   ASP  43           HA       ASP  43   7.481  -9.245  -2.588
  305   1HB   ASP  43          HB2       ASP  43   8.088  -8.466  -0.401
  306   2HB   ASP  43          HB3       ASP  43   8.600  -6.890  -1.040
  307    H    LEU  44           H        LEU  44   9.393  -6.329  -3.520
  308    HA   LEU  44           HA       LEU  44   7.157  -5.464  -5.283
  309   1HB   LEU  44          HB2       LEU  44   9.912  -4.241  -4.951
  310   2HB   LEU  44          HB3       LEU  44   8.664  -3.606  -5.954
  311    HG   LEU  44           HG       LEU  44   8.505  -3.767  -2.925
  312   1HD1  LEU  44          HD11      LEU  44  10.027  -2.022  -3.896
  313   2HD1  LEU  44          HD12      LEU  44   8.653  -1.370  -4.802
  314   3HD1  LEU  44          HD13      LEU  44   8.635  -1.344  -3.027
  315   1HD2  LEU  44          HD21      LEU  44   6.251  -4.061  -3.813
  316   2HD2  LEU  44          HD22      LEU  44   6.423  -2.427  -3.175
  317   3HD2  LEU  44          HD23      LEU  44   6.475  -2.693  -4.931
  318    HA   PRO  45           HA       PRO  45   8.697  -7.862  -8.604
  319   1HB   PRO  45          HB2       PRO  45   8.122  -6.268 -10.839
  320   2HB   PRO  45          HB3       PRO  45   6.977  -7.259  -9.930
  321   1HG   PRO  45          HG2       PRO  45   7.549  -4.293  -9.741
  322   2HG   PRO  45          HG3       PRO  45   5.965  -5.110  -9.653
  323   1HD   PRO  45          HD2       PRO  45   7.375  -4.223  -7.434
  324   2HD   PRO  45          HD3       PRO  45   6.249  -5.616  -7.392
  325    H    ALA  46           H        ALA  46   9.886  -7.618 -10.751
  326    HA   ALA  46           HA       ALA  46  12.568  -6.548 -10.359
  327   1HB   ALA  46          HB1       ALA  46  12.961  -7.558 -12.611
  328   2HB   ALA  46          HB2       ALA  46  12.184  -8.708 -11.510
  329   3HB   ALA  46          HB3       ALA  46  11.228  -7.883 -12.768
  330    H    SER  47           H        SER  47  10.658  -4.475 -10.207
  331    HA   SER  47           HA       SER  47  11.587  -2.576 -12.119
  332   1HB   SER  47          HB2       SER  47   8.637  -3.257 -12.117
  333   2HB   SER  47          HB3       SER  47   9.378  -1.896 -12.974
  334    HG   SER  47           HG       SER  47  10.587  -4.260 -13.557
  335    H    GLY  48           H        GLY  48  11.865  -0.790 -10.760
  336   1HA   GLY  48          HA2       GLY  48  10.441   0.666  -9.139
  337   2HA   GLY  48          HA3       GLY  48  10.393  -0.812  -8.168
  338    H    ILE  49           H        ILE  49  11.588   0.028  -6.442
  339    HA   ILE  49           HA       ILE  49  14.462   0.603  -6.941
  340    HB   ILE  49           HB       ILE  49  12.621   1.648  -4.770
  341   1HG1  ILE  49          HG12      ILE  49  11.799   2.675  -6.801
  342   2HG1  ILE  49          HG13      ILE  49  12.566   3.854  -5.768
  343   1HG2  ILE  49          HG21      ILE  49  14.362   3.267  -4.230
  344   2HG2  ILE  49          HG22      ILE  49  15.018   1.631  -4.138
  345   3HG2  ILE  49          HG23      ILE  49  15.378   2.671  -5.538
  346   1HD1  ILE  49          HD11      ILE  49  14.511   3.989  -7.214
  347   2HD1  ILE  49          HD12      ILE  49  13.927   2.631  -8.206
  348   3HD1  ILE  49          HD13      ILE  49  13.051   4.170  -8.188
  349    H    TRP  50           H        TRP  50  15.780  -0.909  -5.854
  350    HA   TRP  50           HA       TRP  50  14.531  -2.585  -3.714
  351   1HB   TRP  50          HB2       TRP  50  16.512  -3.217  -5.937
  352   2HB   TRP  50          HB3       TRP  50  16.411  -4.178  -4.491
  353    HD1  TRP  50           HD1      TRP  50  13.040  -3.173  -5.981
  354    HE1  TRP  50           HE1      TRP  50  11.989  -5.176  -7.185
  355    HE3  TRP  50           HE3      TRP  50  16.999  -6.416  -5.755
  356    HZ2  TRP  50           HZ2      TRP  50  12.733  -7.871  -7.871
  357    HZ3  TRP  50           HZ3      TRP  50  16.792  -8.703  -6.690
  358    HH2  TRP  50           HH2      TRP  50  14.664  -9.443  -7.744
  359    H    LEU  51           H        LEU  51  15.870  -3.018  -1.942
  360    HA   LEU  51           HA       LEU  51  18.637  -1.968  -1.907
  361   1HB   LEU  51          HB2       LEU  51  16.482  -1.436   0.184
  362   2HB   LEU  51          HB3       LEU  51  18.203  -1.259   0.495
  363    HG   LEU  51           HG       LEU  51  16.559   0.392  -1.485
  364   1HD1  LEU  51          HD11      LEU  51  16.141   0.867   0.913
  365   2HD1  LEU  51          HD12      LEU  51  17.874   1.148   1.161
  366   3HD1  LEU  51          HD13      LEU  51  16.938   2.219   0.093
  367   1HD2  LEU  51          HD21      LEU  51  18.899   0.182  -2.294
  368   2HD2  LEU  51          HD22      LEU  51  18.571   1.816  -1.704
  369   3HD2  LEU  51          HD23      LEU  51  19.507   0.680  -0.711
  370    H    VAL  52           H        VAL  52  19.973  -3.481  -0.860
  371    HA   VAL  52           HA       VAL  52  18.605  -5.848   0.313
  372    HB   VAL  52           HB       VAL  52  18.807  -6.247  -2.043
  373   1HG1  VAL  52          HG11      VAL  52  20.910  -6.413  -3.254
  374   2HG1  VAL  52          HG12      VAL  52  20.698  -4.772  -2.640
  375   3HG1  VAL  52          HG13      VAL  52  21.818  -5.888  -1.825
  376   1HG2  VAL  52          HG21      VAL  52  20.884  -7.907  -0.581
  377   2HG2  VAL  52          HG22      VAL  52  19.127  -8.156  -0.506
  378   3HG2  VAL  52          HG23      VAL  52  19.985  -8.364  -2.040
  379    H    ILE  53           H        ILE  53  19.604  -6.774   1.998
  380    HA   ILE  53           HA       ILE  53  22.178  -5.573   2.884
  381    HB   ILE  53           HB       ILE  53  19.946  -6.174   4.842
  382   1HG1  ILE  53          HG12      ILE  53  19.752  -3.530   4.867
  383   2HG1  ILE  53          HG13      ILE  53  20.208  -3.671   3.176
  384   1HG2  ILE  53          HG21      ILE  53  21.217  -4.638   6.255
  385   2HG2  ILE  53          HG22      ILE  53  22.256  -5.938   5.668
  386   3HG2  ILE  53          HG23      ILE  53  22.363  -4.330   4.931
  387   1HD1  ILE  53          HD11      ILE  53  17.781  -3.539   3.483
  388   2HD1  ILE  53          HD12      ILE  53  18.208  -5.092   2.768
  389   3HD1  ILE  53          HD13      ILE  53  17.804  -4.989   4.498
  390    H    SER  54           H        SER  54  22.884  -7.551   1.720
  391    HA   SER  54           HA       SER  54  22.594 -10.043   3.307
  392   1HB   SER  54          HB2       SER  54  23.722  -9.661   0.510
  393   2HB   SER  54          HB3       SER  54  23.325 -11.191   1.309
  394    HG   SER  54           HG       SER  54  21.147 -10.446   1.424
  395    H    SER  55           H        SER  55  24.408  -7.620   3.848
  396    HA   SER  55           HA       SER  55  26.829  -7.291   3.877
  397   1HB   SER  55          HB2       SER  55  25.654  -8.456   6.413
  398   2HB   SER  55          HB3       SER  55  26.967  -7.263   6.274
  399    HG   SER  55           HG       SER  55  24.852  -6.349   6.685
  400    H    THR  56           H        THR  56  28.024  -8.701   2.529
  401    HA   THR  56           HA       THR  56  28.298 -11.425   3.019
  402    HB   THR  56           HB       THR  56  30.089 -11.085   1.197
  403    HG1  THR  56           HG1      THR  56  30.464  -9.081   0.553
  404   1HG2  THR  56          HG21      THR  56  27.371  -9.762   0.804
  405   2HG2  THR  56          HG22      THR  56  28.538 -10.084  -0.484
  406   3HG2  THR  56          HG23      THR  56  27.855 -11.422   0.416
  407    H    HIS  57           H        HIS  57  30.523  -8.725   3.724
  408    HA   HIS  57           HA       HIS  57  32.151 -10.386   5.531
  409   1HB   HIS  57          HB2       HIS  57  33.114  -8.582   4.045
  410   2HB   HIS  57          HB3       HIS  57  32.306  -7.387   5.065
  411    HD1  HIS  57           HD1      HIS  57  33.402  -7.007   7.521
  412    HD2  HIS  57           HD2      HIS  57  35.207  -9.949   5.101
  413    HE1  HIS  57           HE1      HIS  57  35.612  -7.598   8.637
  414    H    GLY  58           H        GLY  58  29.859 -10.846   6.501
  415   1HA   GLY  58          HA2       GLY  58  29.504  -9.351   9.000
  416   2HA   GLY  58          HA3       GLY  58  28.218  -9.136   7.795
  417    H    ALA  59           H        ALA  59  30.218 -11.794   9.163
  418    HA   ALA  59           HA       ALA  59  29.869 -13.976   9.466
  419   1HB   ALA  59          HB1       ALA  59  28.647 -13.092  11.409
  420   2HB   ALA  59          HB2       ALA  59  27.130 -13.131  10.478
  421   3HB   ALA  59          HB3       ALA  59  27.988 -14.642  10.851
  422    H    GLY  60           H        GLY  60  29.613 -13.198   6.881
  423   1HA   GLY  60          HA2       GLY  60  27.405 -14.662   5.555
  424   2HA   GLY  60          HA3       GLY  60  28.660 -13.676   4.831
  425    H    ASP  61           H        ASP  61  29.647 -14.976   3.557
  426    HA   ASP  61           HA       ASP  61  30.503 -16.689   2.425
  427   1HB   ASP  61          HB2       ASP  61  32.384 -15.707   3.311
  428   2HB   ASP  61          HB3       ASP  61  32.053 -16.309   4.915
  429    H    ILE  62           H        ILE  62  30.038 -18.098   5.727
  430    HA   ILE  62           HA       ILE  62  30.661 -20.701   5.000
  431    HB   ILE  62           HB       ILE  62  28.871 -19.695   7.237
  432   1HG1  ILE  62          HG12      ILE  62  31.814 -20.492   7.186
  433   2HG1  ILE  62          HG13      ILE  62  31.211 -18.838   7.218
  434   1HG2  ILE  62          HG21      ILE  62  28.416 -22.109   6.821
  435   2HG2  ILE  62          HG22      ILE  62  30.157 -22.448   6.932
  436   3HG2  ILE  62          HG23      ILE  62  29.245 -21.867   8.342
  437   1HD1  ILE  62          HD11      ILE  62  31.878 -19.384   9.430
  438   2HD1  ILE  62          HD12      ILE  62  30.105 -19.308   9.420
  439   3HD1  ILE  62          HD13      ILE  62  30.941 -20.882   9.442
  440    HA   PRO  63           HA       PRO  63  26.254 -21.907   3.804
  441   1HB   PRO  63          HB2       PRO  63  24.094 -20.276   3.865
  442   2HB   PRO  63          HB3       PRO  63  24.804 -20.922   5.368
  443   1HG   PRO  63          HG2       PRO  63  25.339 -18.218   4.093
  444   2HG   PRO  63          HG3       PRO  63  24.832 -18.554   5.779
  445   1HD   PRO  63          HD2       PRO  63  27.449 -18.210   5.084
  446   2HD   PRO  63          HD3       PRO  63  26.946 -19.359   6.360
  447    H    ASP  64           H        ASP  64  28.238 -20.976   2.152
  448    HA   ASP  64           HA       ASP  64  28.894 -20.015   0.220
  449   1HB   ASP  64          HB2       ASP  64  27.551 -21.873  -0.681
  450   2HB   ASP  64          HB3       ASP  64  26.139 -20.814  -0.775
  451    H    ASN  65           H        ASN  65  28.216 -18.358   2.059
  452    HA   ASN  65           HA       ASN  65  27.691 -16.366   2.803
  453   1HB   ASN  65          HB2       ASN  65  28.909 -15.559   0.750
  454   2HB   ASN  65          HB3       ASN  65  27.333 -15.318  -0.002
  455   1HD2  ASN  65          HD22      ASN  65  25.861 -13.690   1.182
  456   2HD2  ASN  65          HD21      ASN  65  26.634 -12.544   2.239
  457    H    LEU  66           H        LEU  66  25.395 -17.246   0.229
  458    HA   LEU  66           HA       LEU  66  23.148 -16.670   1.983
  459   1HB   LEU  66          HB2       LEU  66  22.087 -15.083   0.599
  460   2HB   LEU  66          HB3       LEU  66  23.676 -14.455   0.964
  461    HG   LEU  66           HG       LEU  66  22.681 -15.546  -1.679
  462   1HD1  LEU  66          HD11      LEU  66  23.459 -12.734  -0.838
  463   2HD1  LEU  66          HD12      LEU  66  22.807 -13.275  -2.402
  464   3HD1  LEU  66          HD13      LEU  66  21.799 -13.343  -0.958
  465   1HD2  LEU  66          HD21      LEU  66  25.410 -14.306  -1.039
  466   2HD2  LEU  66          HD22      LEU  66  25.126 -15.989  -1.554
  467   3HD2  LEU  66          HD23      LEU  66  24.795 -14.665  -2.663
  468    H    SER  67           H        SER  67  22.019 -18.598   1.785
  469    HA   SER  67           HA       SER  67  22.850 -20.278  -0.510
  470   1HB   SER  67          HB2       SER  67  21.501 -20.843   2.129
  471   2HB   SER  67          HB3       SER  67  21.446 -22.016   0.800
  472    HG   SER  67           HG       SER  67  23.886 -20.833   1.611
  473    HA   PRO  68           HA       PRO  68  18.196 -20.576  -1.306
  474   1HB   PRO  68          HB2       PRO  68  16.399 -18.860  -0.096
  475   2HB   PRO  68          HB3       PRO  68  16.903 -20.435   0.573
  476   1HG   PRO  68          HG2       PRO  68  17.927 -17.706   1.340
  477   2HG   PRO  68          HG3       PRO  68  17.477 -19.069   2.407
  478   1HD   PRO  68          HD2       PRO  68  20.049 -18.535   1.680
  479   2HD   PRO  68          HD3       PRO  68  19.477 -20.197   1.975
  480    H    PHE  69           H        PHE  69  19.213 -17.279  -0.448
  481    HA   PHE  69           HA       PHE  69  17.739 -15.927  -2.435
  482   1HB   PHE  69          HB2       PHE  69  20.250 -15.256  -0.871
  483   2HB   PHE  69          HB3       PHE  69  19.586 -14.160  -2.056
  484    HD1  PHE  69           HD1      PHE  69  19.525 -12.459  -0.288
  485    HD2  PHE  69           HD2      PHE  69  17.058 -16.003  -0.050
  486    HE1  PHE  69           HE1      PHE  69  18.110 -11.382   1.431
  487    HE2  PHE  69           HE2      PHE  69  15.695 -14.928   1.696
  488    HZ   PHE  69           HZ       PHE  69  16.232 -12.624   2.462
  489    H    TYR  70           H        TYR  70  21.194 -16.985  -2.548
  490    HA   TYR  70           HA       TYR  70  21.686 -15.927  -5.110
  491   1HB   TYR  70          HB2       TYR  70  23.421 -16.575  -3.476
  492   2HB   TYR  70          HB3       TYR  70  23.030 -18.258  -3.755
  493    HD1  TYR  70           HD1      TYR  70  24.624 -19.358  -5.100
  494    HD2  TYR  70           HD2      TYR  70  23.793 -15.181  -5.820
  495    HE1  TYR  70           HE1      TYR  70  26.332 -19.327  -6.891
  496    HE2  TYR  70           HE2      TYR  70  25.484 -15.146  -7.606
  497    HH   TYR  70           HH       TYR  70  27.089 -16.372  -8.795
  498    H    GLU  71           H        GLU  71  20.713 -19.324  -4.166
  499    HA   GLU  71           HA       GLU  71  20.624 -20.264  -6.827
  500   1HB   GLU  71          HB2       GLU  71  18.964 -21.125  -4.414
  501   2HB   GLU  71          HB3       GLU  71  19.119 -22.009  -5.943
  502   1HG   GLU  71          HG2       GLU  71  21.676 -21.871  -5.496
  503   2HG   GLU  71          HG3       GLU  71  21.260 -21.476  -3.855
  504    H    ALA  72           H        ALA  72  18.036 -18.705  -4.841
  505    HA   ALA  72           HA       ALA  72  16.019 -18.931  -6.852
  506   1HB   ALA  72          HB1       ALA  72  15.547 -18.515  -4.451
  507   2HB   ALA  72          HB2       ALA  72  16.375 -16.941  -4.573
  508   3HB   ALA  72          HB3       ALA  72  14.851 -17.224  -5.454
  509    H    LEU  73           H        LEU  73  18.623 -16.520  -6.528
  510    HA   LEU  73           HA       LEU  73  17.483 -14.723  -8.498
  511   1HB   LEU  73          HB2       LEU  73  20.328 -15.323  -7.534
  512   2HB   LEU  73          HB3       LEU  73  20.009 -14.230  -8.839
  513    HG   LEU  73           HG       LEU  73  19.077 -13.899  -5.959
  514   1HD1  LEU  73          HD11      LEU  73  20.661 -12.019  -5.942
  515   2HD1  LEU  73          HD12      LEU  73  21.482 -13.554  -6.267
  516   3HD1  LEU  73          HD13      LEU  73  21.177 -12.412  -7.594
  517   1HD2  LEU  73          HD21      LEU  73  18.378 -11.606  -6.660
  518   2HD2  LEU  73          HD22      LEU  73  18.761 -12.004  -8.352
  519   3HD2  LEU  73          HD23      LEU  73  17.434 -12.824  -7.508
  520    H    GLN  74           H        GLN  74  20.044 -17.245  -8.768
  521    HA   GLN  74           HA       GLN  74  20.013 -16.927 -11.610
  522   1HB   GLN  74          HB2       GLN  74  21.437 -19.228 -10.222
  523   2HB   GLN  74          HB3       GLN  74  21.796 -18.447 -11.742
  524   1HG   GLN  74          HG2       GLN  74  22.356 -16.360 -10.480
  525   2HG   GLN  74          HG3       GLN  74  21.965 -17.214  -8.973
  526   1HE2  GLN  74          HE22      GLN  74  24.395 -16.652 -11.341
  527   2HE2  GLN  74          HE21      GLN  74  25.476 -17.956 -10.845
  528    H    GLU  75           H        GLU  75  18.076 -18.781  -9.632
  529    HA   GLU  75           HA       GLU  75  17.345 -20.893 -11.393
  530   1HB   GLU  75          HB2       GLU  75  16.749 -20.876  -9.022
  531   2HB   GLU  75          HB3       GLU  75  15.724 -19.460  -9.276
  532   1HG   GLU  75          HG2       GLU  75  14.194 -20.783 -10.668
  533   2HG   GLU  75          HG3       GLU  75  15.284 -22.172 -10.590
  534    H    GLN  76           H        GLN  76  16.296 -17.510 -11.140
  535    HA   GLN  76           HA       GLN  76  14.500 -17.926 -13.498
  536   1HB   GLN  76          HB2       GLN  76  13.332 -15.833 -12.500
  537   2HB   GLN  76          HB3       GLN  76  13.017 -17.425 -11.819
  538   1HG   GLN  76          HG2       GLN  76  14.213 -17.034  -9.889
  539   2HG   GLN  76          HG3       GLN  76  15.218 -15.771 -10.608
  540   1HE2  GLN  76          HE22      GLN  76  14.713 -14.832  -8.462
  541   2HE2  GLN  76          HE21      GLN  76  13.418 -13.627  -8.471
  542    H    LYS  77           H        LYS  77  17.082 -15.872 -12.244
  543    HA   LYS  77           HA       LYS  77  17.694 -13.731 -12.838
  544   1HB   LYS  77          HB2       LYS  77  18.341 -15.171 -15.405
  545   2HB   LYS  77          HB3       LYS  77  19.059 -13.672 -14.797
  546   1HG   LYS  77          HG2       LYS  77  19.674 -15.101 -12.707
  547   2HG   LYS  77          HG3       LYS  77  19.345 -16.490 -13.765
  548   1HD   LYS  77          HD2       LYS  77  21.024 -15.000 -15.364
  549   2HD   LYS  77          HD3       LYS  77  21.589 -14.518 -13.750
  550   1HE   LYS  77          HE2       LYS  77  21.742 -16.994 -13.213
  551   2HE   LYS  77          HE3       LYS  77  21.412 -17.332 -14.917
  552   1HZ   LYS  77          HZ1       LYS  77  23.763 -17.334 -14.544
  553   2HZ   LYS  77          HZ2       LYS  77  23.443 -15.995 -15.415
  554   3HZ   LYS  77          HZ3       LYS  77  23.738 -15.882 -13.788
  555    HA   PRO  78           HA       PRO  78  13.867 -12.500 -15.183
  556   1HB   PRO  78          HB2       PRO  78  13.266 -10.366 -13.408
  557   2HB   PRO  78          HB3       PRO  78  12.494 -11.966 -13.486
  558   1HG   PRO  78          HG2       PRO  78  14.479 -10.953 -11.534
  559   2HG   PRO  78          HG3       PRO  78  13.318 -12.285 -11.368
  560   1HD   PRO  78          HD2       PRO  78  16.087 -12.555 -11.812
  561   2HD   PRO  78          HD3       PRO  78  14.865 -13.826 -12.056
  562    H    ASP  79           H        ASP  79  13.338 -10.146 -15.983
  563    HA   ASP  79           HA       ASP  79  15.841  -8.811 -16.841
  564   1HB   ASP  79          HB2       ASP  79  14.156  -9.051 -18.537
  565   2HB   ASP  79          HB3       ASP  79  12.918  -8.336 -17.493
  566    H    LEU  80           H        LEU  80  16.717  -7.920 -15.002
  567    HA   LEU  80           HA       LEU  80  15.031  -6.231 -13.266
  568   1HB   LEU  80          HB2       LEU  80  17.967  -6.934 -13.223
  569   2HB   LEU  80          HB3       LEU  80  17.237  -5.850 -12.091
  570    HG   LEU  80           HG       LEU  80  17.720  -7.981 -11.096
  571   1HD1  LEU  80          HD11      LEU  80  15.518  -8.405 -10.026
  572   2HD1  LEU  80          HD12      LEU  80  15.974  -6.700 -10.049
  573   3HD1  LEU  80          HD13      LEU  80  14.760  -7.317 -11.199
  574   1HD2  LEU  80          HD21      LEU  80  15.489  -9.189 -12.734
  575   2HD2  LEU  80          HD22      LEU  80  17.204  -9.331 -13.140
  576   3HD2  LEU  80          HD23      LEU  80  16.617  -9.999 -11.609
  577    H    SER  81           H        SER  81  16.135  -5.528 -16.277
  578    HA   SER  81           HA       SER  81  17.827  -3.267 -15.745
  579   1HB   SER  81          HB2       SER  81  17.697  -2.798 -18.113
  580   2HB   SER  81          HB3       SER  81  18.003  -4.517 -17.834
  581    HG   SER  81           HG       SER  81  15.896  -4.987 -18.318
  582    H    ALA  82           H        ALA  82  14.659  -3.653 -15.086
  583    HA   ALA  82           HA       ALA  82  13.858  -0.826 -15.599
  584   1HB   ALA  82          HB1       ALA  82  12.319  -2.503 -16.525
  585   2HB   ALA  82          HB2       ALA  82  12.189  -3.286 -14.935
  586   3HB   ALA  82          HB3       ALA  82  11.558  -1.642 -15.176
  587    H    VAL  83           H        VAL  83  15.435  -2.603 -13.278
  588    HA   VAL  83           HA       VAL  83  14.382  -0.800 -11.169
  589    HB   VAL  83           HB       VAL  83  13.373  -2.780 -10.576
  590   1HG1  VAL  83          HG11      VAL  83  14.403  -4.982 -10.389
  591   2HG1  VAL  83          HG12      VAL  83  14.453  -4.390 -12.047
  592   3HG1  VAL  83          HG13      VAL  83  15.923  -4.330 -11.041
  593   1HG2  VAL  83          HG21      VAL  83  14.585  -1.852  -8.602
  594   2HG2  VAL  83          HG22      VAL  83  14.318  -3.588  -8.540
  595   3HG2  VAL  83          HG23      VAL  83  15.921  -2.974  -8.937
  596    H    ARG  84           H        ARG  84  15.811  -0.296  -9.464
  597    HA   ARG  84           HA       ARG  84  18.708  -0.556 -10.123
  598   1HB   ARG  84          HB2       ARG  84  19.090   1.563  -9.013
  599   2HB   ARG  84          HB3       ARG  84  18.078   1.785 -10.422
  600   1HG   ARG  84          HG2       ARG  84  16.279   2.526  -9.261
  601   2HG   ARG  84          HG3       ARG  84  16.499   1.437  -7.919
  602   1HD   ARG  84          HD2       ARG  84  17.946   4.043  -8.400
  603   2HD   ARG  84          HD3       ARG  84  16.788   3.699  -7.124
  604    HE   ARG  84           HE       ARG  84  19.606   3.212  -7.186
  605   1HH1  ARG  84          HH11      ARG  84  16.836   1.385  -6.012
  606   2HH1  ARG  84          HH12      ARG  84  17.652   0.696  -4.655
  607   1HH2  ARG  84          HH22      ARG  84  20.672   2.461  -5.317
  608   2HH2  ARG  84          HH21      ARG  84  19.852   1.444  -4.190
  609    H    PHE  85           H        PHE  85  20.036  -1.024  -8.302
  610    HA   PHE  85           HA       PHE  85  18.539  -1.727  -5.824
  611   1HB   PHE  85          HB2       PHE  85  19.470  -3.772  -5.557
  612   2HB   PHE  85          HB3       PHE  85  19.101  -3.764  -7.263
  613    HD1  PHE  85           HD1      PHE  85  21.084  -3.234  -8.904
  614    HD2  PHE  85           HD2      PHE  85  21.661  -4.242  -4.756
  615    HE1  PHE  85           HE1      PHE  85  23.347  -4.064  -9.424
  616    HE2  PHE  85           HE2      PHE  85  23.963  -5.000  -5.268
  617    HZ   PHE  85           HZ       PHE  85  24.807  -4.943  -7.601
  618    H    GLY  86           H        GLY  86  19.789  -1.668  -3.909
  619   1HA   GLY  86          HA2       GLY  86  22.490  -0.383  -4.104
  620   2HA   GLY  86          HA3       GLY  86  21.303   0.177  -2.913
  621    H    ALA  87           H        ALA  87  23.866  -1.878  -3.355
  622    HA   ALA  87           HA       ALA  87  23.089  -4.015  -1.499
  623   1HB   ALA  87          HB1       ALA  87  25.580  -4.442  -1.560
  624   2HB   ALA  87          HB2       ALA  87  24.811  -4.507  -3.157
  625   3HB   ALA  87          HB3       ALA  87  25.753  -3.079  -2.669
  626    H    ILE  88           H        ILE  88  23.670  -4.060   0.690
  627    HA   ILE  88           HA       ILE  88  24.687  -1.544   1.907
  628    HB   ILE  88           HB       ILE  88  22.233  -3.139   2.688
  629   1HG1  ILE  88          HG12      ILE  88  22.503  -0.532   1.171
  630   2HG1  ILE  88          HG13      ILE  88  21.598  -1.974   0.747
  631   1HG2  ILE  88          HG21      ILE  88  21.827  -1.598   4.437
  632   2HG2  ILE  88          HG22      ILE  88  23.486  -2.094   4.623
  633   3HG2  ILE  88          HG23      ILE  88  23.131  -0.509   3.911
  634   1HD1  ILE  88          HD11      ILE  88  20.097  -0.184   1.331
  635   2HD1  ILE  88          HD12      ILE  88  19.961  -1.472   2.541
  636   3HD1  ILE  88          HD13      ILE  88  20.862   0.028   2.899
  637    H    GLY  89           H        GLY  89  26.215  -1.966   3.394
  638   1HA   GLY  89          HA2       GLY  89  27.428  -3.013   5.046
  639   2HA   GLY  89          HA3       GLY  89  26.116  -4.190   5.230
  640    H    ILE  90           H        ILE  90  26.678  -4.545   2.090
  641    HA   ILE  90           HA       ILE  90  28.264  -6.894   2.206
  642    HB   ILE  90           HB       ILE  90  27.387  -5.050  -0.043
  643   1HG1  ILE  90          HG12      ILE  90  26.350  -7.589   1.212
  644   2HG1  ILE  90          HG13      ILE  90  25.511  -6.081   0.905
  645   1HG2  ILE  90          HG21      ILE  90  28.029  -6.735  -1.653
  646   2HG2  ILE  90          HG22      ILE  90  29.444  -6.170  -0.792
  647   3HG2  ILE  90          HG23      ILE  90  28.723  -7.751  -0.392
  648   1HD1  ILE  90          HD11      ILE  90  25.577  -6.658  -1.573
  649   2HD1  ILE  90          HD12      ILE  90  26.208  -8.249  -1.101
  650   3HD1  ILE  90          HD13      ILE  90  24.607  -7.730  -0.552
  651    H    GLY  91           H        GLY  91  30.374  -7.248   1.992
  652   1HA   GLY  91          HA2       GLY  91  32.220  -4.890   2.057
  653   2HA   GLY  91          HA3       GLY  91  32.349  -6.260   3.153
  654    H    SER  92           H        SER  92  31.347  -7.163  -0.015
  655    HA   SER  92           HA       SER  92  33.628  -8.742  -0.534
  656   1HB   SER  92          HB2       SER  92  31.384  -7.911  -2.370
  657   2HB   SER  92          HB3       SER  92  32.439  -9.344  -2.524
  658    HG   SER  92           HG       SER  92  30.611 -10.043  -1.501
  659    H    ARG  93           H        ARG  93  33.276  -5.407  -0.969
  660    HA   ARG  93           HA       ARG  93  35.633  -5.095  -2.579
  661   1HB   ARG  93          HB2       ARG  93  34.416  -3.617  -4.284
  662   2HB   ARG  93          HB3       ARG  93  34.231  -5.353  -4.473
  663   1HG   ARG  93          HG2       ARG  93  31.991  -5.325  -3.601
  664   2HG   ARG  93          HG3       ARG  93  32.136  -3.652  -3.058
  665   1HD   ARG  93          HD2       ARG  93  30.779  -3.937  -5.149
  666   2HD   ARG  93          HD3       ARG  93  32.129  -2.813  -5.293
  667    HE   ARG  93           HE       ARG  93  33.102  -4.123  -6.873
  668   1HH1  ARG  93          HH11      ARG  93  30.579  -6.174  -5.289
  669   2HH1  ARG  93          HH12      ARG  93  30.870  -7.466  -6.447
  670   1HH2  ARG  93          HH21      ARG  93  33.346  -5.977  -8.302
  671   2HH2  ARG  93          HH22      ARG  93  32.341  -7.382  -8.003
  672    H    GLU  94           H        GLU  94  35.948  -2.646  -2.839
  673    HA   GLU  94           HA       GLU  94  35.926  -0.484  -2.321
  674   1HB   GLU  94          HB2       GLU  94  33.558  -0.998  -0.536
  675   2HB   GLU  94          HB3       GLU  94  34.239   0.577  -0.924
  676   1HG   GLU  94          HG2       GLU  94  33.752   0.247  -3.321
  677   2HG   GLU  94          HG3       GLU  94  33.063  -1.342  -2.978
  678    H    TYR  95           H        TYR  95  35.837  -2.836   0.203
  679    HA   TYR  95           HA       TYR  95  37.926  -1.322   1.706
  680   1HB   TYR  95          HB2       TYR  95  35.250  -2.267   2.611
  681   2HB   TYR  95          HB3       TYR  95  36.565  -2.724   3.653
  682    HD1  TYR  95           HD1      TYR  95  34.191  -0.232   3.174
  683    HD2  TYR  95           HD2      TYR  95  38.388  -0.707   4.044
  684    HE1  TYR  95           HE1      TYR  95  34.236   2.032   4.205
  685    HE2  TYR  95           HE2      TYR  95  38.450   1.551   5.043
  686    HH   TYR  95           HH       TYR  95  37.238   3.474   5.552
  687    H    ASP  96           H        ASP  96  36.745  -4.514   0.630
  688    HA   ASP  96           HA       ASP  96  39.441  -5.539   1.161
  689   1HB   ASP  96          HB2       ASP  96  38.143  -6.062   3.229
  690   2HB   ASP  96          HB3       ASP  96  37.019  -7.018   2.263
  691    H    THR  97           H        THR  97  39.630  -5.464  -1.117
  692    HA   THR  97           HA       THR  97  37.680  -6.795  -2.741
  693    HB   THR  97           HB       THR  97  39.517  -6.202  -4.544
  694    HG1  THR  97           HG1      THR  97  41.060  -4.784  -3.838
  695   1HG2  THR  97          HG21      THR  97  38.227  -3.990  -2.871
  696   2HG2  THR  97          HG22      THR  97  38.848  -3.824  -4.529
  697   3HG2  THR  97          HG23      THR  97  37.462  -4.876  -4.214
  698    H    PHE  98           H        PHE  98  39.557  -8.235  -0.768
  699    HA   PHE  98           HA       PHE  98  40.327 -10.490  -2.570
  700   1HB   PHE  98          HB2       PHE  98  40.841 -10.245   0.412
  701   2HB   PHE  98          HB3       PHE  98  41.361 -11.535  -0.645
  702    HD1  PHE  98           HD1      PHE  98  43.036 -11.076  -2.498
  703    HD2  PHE  98           HD2      PHE  98  42.125  -8.184   0.572
  704    HE1  PHE  98           HE1      PHE  98  45.126  -9.847  -3.032
  705    HE2  PHE  98           HE2      PHE  98  44.215  -6.958   0.034
  706    HZ   PHE  98           HZ       PHE  98  45.721  -7.787  -1.769
  707    H    CYS  99           H        CYS  99  37.805  -9.336  -0.423
  708    HA   CYS  99           HA       CYS  99  36.505 -11.925  -0.190
  709   1HB   CYS  99          HB2       CYS  99  35.563  -9.068   0.329
  710   2HB   CYS  99          HB3       CYS  99  34.590 -10.512   0.661
  711    HG   CYS  99           HG       CYS  99  35.616  -9.491   2.865
  712    H    GLY 100           H        GLY 100  37.258 -10.806  -2.904
  713   1HA   GLY 100          HA2       GLY 100  34.958 -10.309  -4.492
  714   2HA   GLY 100          HA3       GLY 100  36.463 -11.073  -5.033
  715    H    ALA 101           H        ALA 101  36.287 -13.306  -3.091
  716    HA   ALA 101           HA       ALA 101  34.838 -15.233  -4.525
  717   1HB   ALA 101          HB1       ALA 101  35.698 -15.263  -1.598
  718   2HB   ALA 101          HB2       ALA 101  35.272 -16.680  -2.579
  719   3HB   ALA 101          HB3       ALA 101  36.710 -15.729  -2.990
  720    H    ILE 102           H        ILE 102  33.537 -12.876  -2.300
  721    HA   ILE 102           HA       ILE 102  30.950 -14.333  -2.279
  722    HB   ILE 102           HB       ILE 102  30.512 -13.401  -0.034
  723   1HG1  ILE 102          HG12      ILE 102  33.488 -12.723   0.023
  724   2HG1  ILE 102          HG13      ILE 102  32.164 -11.555  -0.005
  725   1HG2  ILE 102          HG21      ILE 102  31.689 -15.144   1.136
  726   2HG2  ILE 102          HG22      ILE 102  31.292 -15.745  -0.473
  727   3HG2  ILE 102          HG23      ILE 102  32.950 -15.224  -0.107
  728   1HD1  ILE 102          HD11      ILE 102  32.934 -13.461   2.229
  729   2HD1  ILE 102          HD12      ILE 102  32.895 -11.692   2.252
  730   3HD1  ILE 102          HD13      ILE 102  31.376 -12.611   2.202
  731    H    ASP 103           H        ASP 103  32.235 -12.139  -4.031
  732    HA   ASP 103           HA       ASP 103  30.296  -9.959  -3.707
  733   1HB   ASP 103          HB2       ASP 103  31.694  -8.835  -4.954
  734   2HB   ASP 103          HB3       ASP 103  32.789 -10.180  -4.940
  735    H    LYS 104           H        LYS 104  29.890 -13.060  -4.557
  736    HA   LYS 104           HA       LYS 104  28.854 -13.284  -7.070
  737   1HB   LYS 104          HB2       LYS 104  27.783 -14.722  -4.604
  738   2HB   LYS 104          HB3       LYS 104  27.656 -15.251  -6.277
  739   1HG   LYS 104          HG2       LYS 104  30.121 -15.462  -6.361
  740   2HG   LYS 104          HG3       LYS 104  30.207 -15.039  -4.639
  741   1HD   LYS 104          HD2       LYS 104  28.718 -16.990  -4.118
  742   2HD   LYS 104          HD3       LYS 104  28.730 -17.427  -5.840
  743   1HE   LYS 104          HE2       LYS 104  31.230 -17.635  -5.723
  744   2HE   LYS 104          HE3       LYS 104  31.152 -17.288  -3.991
  745   1HZ   LYS 104          HZ1       LYS 104  31.249 -19.652  -4.392
  746   2HZ   LYS 104          HZ2       LYS 104  29.805 -19.301  -3.709
  747   3HZ   LYS 104          HZ3       LYS 104  29.906 -19.624  -5.316
  748    H    LEU 105           H        LEU 105  27.034 -12.196  -4.191
  749    HA   LEU 105           HA       LEU 105  24.442 -12.186  -5.372
  750   1HB   LEU 105          HB2       LEU 105  24.775 -12.036  -2.993
  751   2HB   LEU 105          HB3       LEU 105  25.692 -10.554  -3.119
  752    HG   LEU 105           HG       LEU 105  23.361 -10.366  -2.241
  753   1HD1  LEU 105          HD11      LEU 105  22.890  -8.243  -3.174
  754   2HD1  LEU 105          HD12      LEU 105  24.653  -8.418  -3.238
  755   3HD1  LEU 105          HD13      LEU 105  23.682  -8.632  -4.706
  756   1HD2  LEU 105          HD21      LEU 105  22.441 -10.643  -5.129
  757   2HD2  LEU 105          HD22      LEU 105  22.203 -11.878  -3.894
  758   3HD2  LEU 105          HD23      LEU 105  21.442 -10.295  -3.708
  759    H    GLU 106           H        GLU 106  26.817  -9.480  -4.947
  760    HA   GLU 106           HA       GLU 106  25.175  -7.616  -6.373
  761   1HB   GLU 106          HB2       GLU 106  28.225  -7.563  -6.167
  762   2HB   GLU 106          HB3       GLU 106  27.171  -6.215  -6.572
  763   1HG   GLU 106          HG2       GLU 106  26.163  -6.300  -4.306
  764   2HG   GLU 106          HG3       GLU 106  27.249  -7.629  -3.875
  765    H    ALA 107           H        ALA 107  27.744  -9.857  -7.428
  766    HA   ALA 107           HA       ALA 107  28.082  -8.881 -10.051
  767   1HB   ALA 107          HB1       ALA 107  29.611 -10.500  -8.995
  768   2HB   ALA 107          HB2       ALA 107  28.339 -11.741  -9.009
  769   3HB   ALA 107          HB3       ALA 107  28.996 -11.123 -10.537
  770    H    GLU 108           H        GLU 108  25.823 -11.486  -8.800
  771    HA   GLU 108           HA       GLU 108  24.790 -11.906 -11.450
  772   1HB   GLU 108          HB2       GLU 108  23.978 -12.822  -8.696
  773   2HB   GLU 108          HB3       GLU 108  22.974 -13.124 -10.102
  774   1HG   GLU 108          HG2       GLU 108  25.816 -14.124  -9.688
  775   2HG   GLU 108          HG3       GLU 108  24.322 -15.049  -9.706
  776    H    LEU 109           H        LEU 109  23.767  -9.722  -8.775
  777    HA   LEU 109           HA       LEU 109  21.214  -9.139  -9.971
  778   1HB   LEU 109          HB2       LEU 109  23.024  -7.474  -8.172
  779   2HB   LEU 109          HB3       LEU 109  21.445  -6.925  -8.717
  780    HG   LEU 109           HG       LEU 109  21.953  -9.388  -7.007
  781   1HD1  LEU 109          HD11      LEU 109  22.262  -7.204  -5.851
  782   2HD1  LEU 109          HD12      LEU 109  20.621  -6.732  -6.328
  783   3HD1  LEU 109          HD13      LEU 109  20.873  -8.107  -5.227
  784   1HD2  LEU 109          HD21      LEU 109  19.982  -9.828  -8.342
  785   2HD2  LEU 109          HD22      LEU 109  19.474  -9.408  -6.710
  786   3HD2  LEU 109          HD23      LEU 109  19.336  -8.202  -8.009
  787    H    LYS 110           H        LYS 110  24.452  -7.612 -10.426
  788    HA   LYS 110           HA       LYS 110  23.495  -5.604 -12.225
  789   1HB   LYS 110          HB2       LYS 110  26.264  -6.847 -11.952
  790   2HB   LYS 110          HB3       LYS 110  25.883  -5.326 -12.787
  791   1HG   LYS 110          HG2       LYS 110  25.310  -4.210 -10.762
  792   2HG   LYS 110          HG3       LYS 110  25.198  -5.685  -9.858
  793   1HD   LYS 110          HD2       LYS 110  27.180  -4.987  -9.062
  794   2HD   LYS 110          HD3       LYS 110  27.765  -5.985 -10.371
  795   1HE   LYS 110          HE2       LYS 110  27.371  -2.949 -10.502
  796   2HE   LYS 110          HE3       LYS 110  28.892  -3.742 -10.100
  797   1HZ   LYS 110          HZ1       LYS 110  28.881  -3.135 -12.397
  798   2HZ   LYS 110          HZ2       LYS 110  28.881  -4.757 -12.313
  799   3HZ   LYS 110          HZ3       LYS 110  27.510  -3.947 -12.711
  800    H    ASN 111           H        ASN 111  24.721  -8.917 -12.673
  801    HA   ASN 111           HA       ASN 111  24.739  -8.925 -15.530
  802   1HB   ASN 111          HB2       ASN 111  25.977 -10.654 -14.836
  803   2HB   ASN 111          HB3       ASN 111  25.250 -10.724 -13.287
  804   1HD2  ASN 111          HD22      ASN 111  23.186 -11.847 -12.968
  805   2HD2  ASN 111          HD21      ASN 111  23.349 -13.441 -13.621
  806    H    SER 112           H        SER 112  22.192  -9.510 -13.127
  807    HA   SER 112           HA       SER 112  20.353 -10.552 -15.113
  808   1HB   SER 112          HB2       SER 112  19.698  -9.631 -12.319
  809   2HB   SER 112          HB3       SER 112  18.750 -10.694 -13.387
  810    HG   SER 112           HG       SER 112  21.221 -11.232 -12.138
  811    H    GLY 113           H        GLY 113  21.327  -7.373 -14.065
  812   1HA   GLY 113          HA2       GLY 113  20.821  -5.835 -15.962
  813   2HA   GLY 113          HA3       GLY 113  19.113  -6.155 -15.665
  814    H    ALA 114           H        ALA 114  20.011  -6.089 -12.535
  815    HA   ALA 114           HA       ALA 114  18.861  -3.478 -12.313
  816   1HB   ALA 114          HB1       ALA 114  19.140  -3.699  -9.910
  817   2HB   ALA 114          HB2       ALA 114  18.453  -5.181 -10.538
  818   3HB   ALA 114          HB3       ALA 114  20.179  -5.139 -10.123
  819    H    LYS 115           H        LYS 115  19.838  -1.497 -11.785
  820    HA   LYS 115           HA       LYS 115  22.762  -1.422 -12.318
  821   1HB   LYS 115          HB2       LYS 115  22.490   1.013 -12.475
  822   2HB   LYS 115          HB3       LYS 115  21.515   0.117 -13.638
  823   1HG   LYS 115          HG2       LYS 115  19.485   0.502 -12.252
  824   2HG   LYS 115          HG3       LYS 115  20.473   1.352 -11.058
  825   1HD   LYS 115          HD2       LYS 115  19.329   2.980 -12.392
  826   2HD   LYS 115          HD3       LYS 115  21.056   3.065 -12.765
  827   1HE   LYS 115          HE2       LYS 115  20.673   1.721 -14.828
  828   2HE   LYS 115          HE3       LYS 115  18.955   1.591 -14.429
  829   1HZ   LYS 115          HZ1       LYS 115  20.379   4.122 -15.025
  830   2HZ   LYS 115          HZ2       LYS 115  19.367   3.343 -16.034
  831   3HZ   LYS 115          HZ3       LYS 115  18.788   4.001 -14.661
  832    H    GLN 116           H        GLN 116  24.239  -1.065 -10.711
  833    HA   GLN 116           HA       GLN 116  23.236  -0.800  -7.955
  834   1HB   GLN 116          HB2       GLN 116  25.055  -2.403  -8.549
  835   2HB   GLN 116          HB3       GLN 116  26.099  -1.029  -8.904
  836   1HG   GLN 116          HG2       GLN 116  25.945  -0.222  -6.616
  837   2HG   GLN 116          HG3       GLN 116  24.657  -1.371  -6.242
  838   1HE2  GLN 116          HE22      GLN 116  26.673  -1.368  -4.484
  839   2HE2  GLN 116          HE21      GLN 116  27.515  -2.908  -4.629
  840    H    THR 117           H        THR 117  22.556   1.289  -7.553
  841    HA   THR 117           HA       THR 117  23.827   3.565  -8.845
  842    HB   THR 117           HB       THR 117  21.935   3.631  -6.475
  843    HG1  THR 117           HG1      THR 117  21.354   3.143  -9.196
  844   1HG2  THR 117          HG21      THR 117  22.712   5.829  -7.113
  845   2HG2  THR 117          HG22      THR 117  22.384   5.506  -8.832
  846   3HG2  THR 117          HG23      THR 117  21.042   5.652  -7.683
  847    H    GLY 118           H        GLY 118  25.084   5.188  -7.857
  848   1HA   GLY 118          HA2       GLY 118  26.304   6.317  -6.306
  849   2HA   GLY 118          HA3       GLY 118  25.472   5.410  -5.055
  850    H    GLU 119           H        GLU 119  26.286   3.522  -4.281
  851    HA   GLU 119           HA       GLU 119  28.678   2.158  -4.953
  852   1HB   GLU 119          HB2       GLU 119  30.108   2.874  -3.078
  853   2HB   GLU 119          HB3       GLU 119  29.862   4.177  -4.226
  854   1HG   GLU 119          HG2       GLU 119  28.140   5.176  -2.698
  855   2HG   GLU 119          HG3       GLU 119  28.441   3.871  -1.553
  856    H    THR 120           H        THR 120  29.222   0.732  -2.824
  857    HA   THR 120           HA       THR 120  26.771  -0.413  -1.834
  858    HB   THR 120           HB       THR 120  29.553  -0.662  -0.615
  859    HG1  THR 120           HG1      THR 120  29.847  -1.013  -2.726
  860   1HG2  THR 120          HG21      THR 120  27.142  -2.522  -0.783
  861   2HG2  THR 120          HG22      THR 120  28.755  -3.028  -0.255
  862   3HG2  THR 120          HG23      THR 120  27.864  -1.816   0.677
  863    H    LEU 121           H        LEU 121  25.635   0.108   0.005
  864    HA   LEU 121           HA       LEU 121  26.316   2.570   1.480
  865   1HB   LEU 121          HB2       LEU 121  23.946   1.647   0.790
  866   2HB   LEU 121          HB3       LEU 121  24.111   0.614   2.206
  867    HG   LEU 121           HG       LEU 121  24.427   3.615   2.305
  868   1HD1  LEU 121          HD11      LEU 121  22.166   3.951   2.817
  869   2HD1  LEU 121          HD12      LEU 121  22.191   2.950   1.368
  870   3HD1  LEU 121          HD13      LEU 121  21.836   2.196   2.931
  871   1HD2  LEU 121          HD21      LEU 121  23.822   1.615   4.505
  872   2HD2  LEU 121          HD22      LEU 121  25.220   2.711   4.377
  873   3HD2  LEU 121          HD23      LEU 121  23.632   3.367   4.686
  874    H    LYS 122           H        LYS 122  27.156   2.442   3.676
  875    HA   LYS 122           HA       LYS 122  27.990  -0.283   4.565
  876   1HB   LYS 122          HB2       LYS 122  29.703   2.210   4.371
  877   2HB   LYS 122          HB3       LYS 122  30.185   0.753   5.211
  878   1HG   LYS 122          HG2       LYS 122  30.183  -0.538   3.200
  879   2HG   LYS 122          HG3       LYS 122  29.438   0.729   2.246
  880   1HD   LYS 122          HD2       LYS 122  32.151   1.037   3.563
  881   2HD   LYS 122          HD3       LYS 122  31.951   0.387   1.936
  882   1HE   LYS 122          HE2       LYS 122  30.995   3.157   2.802
  883   2HE   LYS 122          HE3       LYS 122  32.539   2.830   2.008
  884   1HZ   LYS 122          HZ1       LYS 122  29.886   2.287   0.791
  885   2HZ   LYS 122          HZ2       LYS 122  30.883   3.517   0.393
  886   3HZ   LYS 122          HZ3       LYS 122  31.317   1.971   0.085
  887    H    ILE 123           H        ILE 123  27.948  -0.545   6.728
  888    HA   ILE 123           HA       ILE 123  27.041   1.653   8.494
  889    HB   ILE 123           HB       ILE 123  25.153   0.592   9.283
  890   1HG1  ILE 123          HG12      ILE 123  25.832  -1.714   9.504
  891   2HG1  ILE 123          HG13      ILE 123  24.268  -1.566   8.760
  892   1HG2  ILE 123          HG21      ILE 123  24.774   1.735   7.152
  893   2HG2  ILE 123          HG22      ILE 123  24.948   0.200   6.276
  894   3HG2  ILE 123          HG23      ILE 123  23.619   0.424   7.424
  895   1HD1  ILE 123          HD11      ILE 123  26.857  -2.259   7.316
  896   2HD1  ILE 123          HD12      ILE 123  25.522  -3.352   7.712
  897   3HD1  ILE 123          HD13      ILE 123  25.267  -2.063   6.528
  898    H    ASN 124           H        ASN 124  26.944   0.822  10.770
  899    HA   ASN 124           HA       ASN 124  28.600  -1.514  11.433
  900   1HB   ASN 124          HB2       ASN 124  29.348   1.357  12.040
  901   2HB   ASN 124          HB3       ASN 124  29.464   0.214  13.357
  902   1HD2  ASN 124          HD22      ASN 124  30.274  -0.603   9.897
  903   2HD2  ASN 124          HD21      ASN 124  31.989  -0.757  10.241
  904    H    ILE 125           H        ILE 125  28.088  -2.131  13.719
  905    HA   ILE 125           HA       ILE 125  25.712  -0.806  14.874
  906    HB   ILE 125           HB       ILE 125  24.670  -2.996  15.312
  907   1HG1  ILE 125          HG12      ILE 125  26.678  -4.171  13.336
  908   2HG1  ILE 125          HG13      ILE 125  26.713  -4.420  15.082
  909   1HG2  ILE 125          HG21      ILE 125  24.003  -1.541  13.376
  910   2HG2  ILE 125          HG22      ILE 125  25.014  -2.549  12.320
  911   3HG2  ILE 125          HG23      ILE 125  23.618  -3.248  13.160
  912   1HD1  ILE 125          HD11      ILE 125  24.448  -5.483  14.948
  913   2HD1  ILE 125          HD12      ILE 125  24.541  -5.361  13.172
  914   3HD1  ILE 125          HD13      ILE 125  25.714  -6.348  14.054
  915    H    LEU 126           H        LEU 126  25.389  -1.570  17.164
  916    HA   LEU 126           HA       LEU 126  27.759  -1.138  18.615
  917   1HB   LEU 126          HB2       LEU 126  25.477  -0.658  19.435
  918   2HB   LEU 126          HB3       LEU 126  25.122  -2.386  19.495
  919    HG   LEU 126           HG       LEU 126  26.822  -2.696  21.271
  920   1HD1  LEU 126          HD11      LEU 126  27.795  -0.697  22.405
  921   2HD1  LEU 126          HD12      LEU 126  28.409  -0.884  20.764
  922   3HD1  LEU 126          HD13      LEU 126  27.162   0.337  21.105
  923   1HD2  LEU 126          HD21      LEU 126  24.826  -0.476  21.867
  924   2HD2  LEU 126          HD22      LEU 126  24.482  -2.219  21.859
  925   3HD2  LEU 126          HD23      LEU 126  25.597  -1.548  23.059
  926    H    ASP 127           H        ASP 127  26.173  -4.180  17.654
  927    HA   ASP 127           HA       ASP 127  27.576  -5.918  19.386
  928   1HB   ASP 127          HB2       ASP 127  25.539  -6.567  18.199
  929   2HB   ASP 127          HB3       ASP 127  26.372  -6.445  16.646
  930    H    HIS 128           H        HIS 128  28.413  -4.845  16.022
  931    HA   HIS 128           HA       HIS 128  31.203  -5.351  16.399
  932   1HB   HIS 128          HB2       HIS 128  30.043  -7.718  15.982
  933   2HB   HIS 128          HB3       HIS 128  29.915  -7.164  14.324
  934    HD1  HIS 128           HD1      HIS 128  32.307  -6.970  12.993
  935    HD2  HIS 128           HD2      HIS 128  32.438  -8.335  16.977
  936    HE1  HIS 128           HE1      HIS 128  34.628  -7.978  13.333
  937    H    ASP 129           H        ASP 129  32.414  -4.745  14.394
  938    HA   ASP 129           HA       ASP 129  31.063  -2.808  12.728
  939   1HB   ASP 129          HB2       ASP 129  33.163  -2.340  11.791
  940   2HB   ASP 129          HB3       ASP 129  33.484  -2.583  13.502
  941    H    ILE 130           H        ILE 130  30.912  -3.100  10.410
  942    HA   ILE 130           HA       ILE 130  30.541  -5.966   9.677
  943    HB   ILE 130           HB       ILE 130  28.874  -3.630   8.758
  944   1HG1  ILE 130          HG12      ILE 130  28.393  -4.097  11.072
  945   2HG1  ILE 130          HG13      ILE 130  27.069  -4.543  10.022
  946   1HG2  ILE 130          HG21      ILE 130  28.597  -6.620   8.216
  947   2HG2  ILE 130          HG22      ILE 130  27.457  -5.346   7.716
  948   3HG2  ILE 130          HG23      ILE 130  29.085  -5.415   7.032
  949   1HD1  ILE 130          HD11      ILE 130  27.625  -6.938  10.264
  950   2HD1  ILE 130          HD12      ILE 130  29.028  -6.520  11.277
  951   3HD1  ILE 130          HD13      ILE 130  27.388  -6.166  11.837
  952    HA   PRO 131           HA       PRO 131  32.640  -4.913   5.753
  953   1HB   PRO 131          HB2       PRO 131  32.775  -2.458   4.549
  954   2HB   PRO 131          HB3       PRO 131  31.370  -3.556   4.386
  955   1HG   PRO 131          HG2       PRO 131  31.664  -1.186   6.265
  956   2HG   PRO 131          HG3       PRO 131  30.272  -1.641   5.239
  957   1HD   PRO 131          HD2       PRO 131  30.437  -2.263   7.894
  958   2HD   PRO 131          HD3       PRO 131  29.589  -3.294   6.694
  959    H    GLU 132           H        GLU 132  33.007  -1.789   7.435
  960    HA   GLU 132           HA       GLU 132  35.403  -2.489   8.788
  961   1HB   GLU 132          HB2       GLU 132  36.412  -2.097   6.494
  962   2HB   GLU 132          HB3       GLU 132  35.727  -0.480   6.504
  963   1HG   GLU 132          HG2       GLU 132  38.067  -0.362   7.074
  964   2HG   GLU 132          HG3       GLU 132  37.129   0.095   8.483
  965    H    ASP 133           H        ASP 133  33.627   0.313   7.295
  966    HA   ASP 133           HA       ASP 133  33.338   1.643   9.932
  967   1HB   ASP 133          HB2       ASP 133  35.549   2.221   8.865
  968   2HB   ASP 133          HB3       ASP 133  34.685   2.790   7.445
  969    HA   PRO 134           HA       PRO 134  29.474   2.453   7.861
  970   1HB   PRO 134          HB2       PRO 134  28.353   4.452   9.368
  971   2HB   PRO 134          HB3       PRO 134  28.580   2.788   9.977
  972   1HG   PRO 134          HG2       PRO 134  30.379   5.182  10.420
  973   2HG   PRO 134          HG3       PRO 134  29.754   4.025  11.639
  974   1HD   PRO 134          HD2       PRO 134  32.230   3.783  10.556
  975   2HD   PRO 134          HD3       PRO 134  31.257   2.345  10.941
  976    H    ALA 135           H        ALA 135  28.240   4.032   6.618
  977    HA   ALA 135           HA       ALA 135  29.483   6.612   5.948
  978   1HB   ALA 135          HB1       ALA 135  29.526   6.086   3.547
  979   2HB   ALA 135          HB2       ALA 135  30.579   4.965   4.429
  980   3HB   ALA 135          HB3       ALA 135  28.971   4.431   3.869
  981    H    GLU 136           H        GLU 136  27.214   6.338   7.436
  982    HA   GLU 136           HA       GLU 136  24.789   5.825   6.093
  983   1HB   GLU 136          HB2       GLU 136  23.709   6.893   7.981
  984   2HB   GLU 136          HB3       GLU 136  25.019   5.846   8.521
  985   1HG   GLU 136          HG2       GLU 136  26.486   7.829   8.841
  986   2HG   GLU 136          HG3       GLU 136  25.190   8.886   8.278
  987    H    GLU 137           H        GLU 137  26.826   8.638   5.819
  988    HA   GLU 137           HA       GLU 137  25.024  10.630   4.934
  989   1HB   GLU 137          HB2       GLU 137  27.807  10.014   3.858
  990   2HB   GLU 137          HB3       GLU 137  26.931  11.535   3.724
  991   1HG   GLU 137          HG2       GLU 137  28.164  12.150   5.490
  992   2HG   GLU 137          HG3       GLU 137  26.919  11.335   6.424
  993    H    TRP 138           H        TRP 138  25.996   7.659   3.371
  994    HA   TRP 138           HA       TRP 138  25.473   7.947   0.667
  995   1HB   TRP 138          HB2       TRP 138  25.950   5.884   2.153
  996   2HB   TRP 138          HB3       TRP 138  24.262   5.748   2.350
  997    HD1  TRP 138           HD1      TRP 138  27.021   4.895   0.042
  998    HE1  TRP 138           HE1      TRP 138  26.143   3.474  -1.899
  999    HE3  TRP 138           HE3      TRP 138  21.982   5.638   0.637
 1000    HZ2  TRP 138           HZ2      TRP 138  23.635   2.847  -3.132
 1001    HZ3  TRP 138           HZ3      TRP 138  20.377   4.534  -0.879
 1002    HH2  TRP 138           HH2      TRP 138  21.178   3.165  -2.779
 1003    H    LEU 139           H        LEU 139  23.128   7.212   3.178
 1004    HA   LEU 139           HA       LEU 139  20.791   7.107   1.695
 1005   1HB   LEU 139          HB2       LEU 139  21.464   6.752   4.314
 1006   2HB   LEU 139          HB3       LEU 139  20.742   8.308   4.489
 1007    HG   LEU 139           HG       LEU 139  19.099   6.674   5.001
 1008   1HD1  LEU 139          HD11      LEU 139  18.452   7.685   2.216
 1009   2HD1  LEU 139          HD12      LEU 139  17.302   7.292   3.517
 1010   3HD1  LEU 139          HD13      LEU 139  18.397   8.683   3.684
 1011   1HD2  LEU 139          HD21      LEU 139  18.359   4.906   3.527
 1012   2HD2  LEU 139          HD22      LEU 139  19.456   5.430   2.236
 1013   3HD2  LEU 139          HD23      LEU 139  20.110   4.773   3.749
 1014    H    GLY 140           H        GLY 140  21.893   9.886   3.609
 1015   1HA   GLY 140          HA2       GLY 140  19.966  11.747   2.758
 1016   2HA   GLY 140          HA3       GLY 140  21.584  12.167   3.354
 1017    H    SER 141           H        SER 141  23.295  11.234   1.414
 1018    HA   SER 141           HA       SER 141  23.064  13.323  -0.491
 1019   1HB   SER 141          HB2       SER 141  25.164  12.235   0.435
 1020   2HB   SER 141          HB3       SER 141  24.853  10.850  -0.626
 1021    HG   SER 141           HG       SER 141  26.305  12.404  -1.521
 1022    H    TRP 142           H        TRP 142  22.579   9.760  -0.832
 1023    HA   TRP 142           HA       TRP 142  22.024   9.721  -3.609
 1024   1HB   TRP 142          HB2       TRP 142  22.656   7.750  -2.353
 1025   2HB   TRP 142          HB3       TRP 142  21.257   7.932  -1.307
 1026    HD1  TRP 142           HD1      TRP 142  22.034   6.956  -4.964
 1027    HE1  TRP 142           HE1      TRP 142  20.082   5.540  -5.839
 1028    HE3  TRP 142           HE3      TRP 142  19.078   7.021  -0.789
 1029    HZ2  TRP 142           HZ2      TRP 142  17.538   4.527  -4.825
 1030    HZ3  TRP 142           HZ3      TRP 142  16.898   5.825  -0.773
 1031    HH2  TRP 142           HH2      TRP 142  16.130   4.572  -2.773
 1032    H    VAL 143           H        VAL 143  19.862  10.126  -0.751
 1033    HA   VAL 143           HA       VAL 143  17.417  10.315  -2.198
 1034    HB   VAL 143           HB       VAL 143  18.390  11.243   0.515
 1035   1HG1  VAL 143          HG11      VAL 143  15.616  11.747  -0.587
 1036   2HG1  VAL 143          HG12      VAL 143  16.122  11.933   1.117
 1037   3HG1  VAL 143          HG13      VAL 143  16.805  12.990  -0.106
 1038   1HG2  VAL 143          HG21      VAL 143  16.777   9.573   1.302
 1039   2HG2  VAL 143          HG22      VAL 143  16.192   9.301  -0.355
 1040   3HG2  VAL 143          HG23      VAL 143  17.833   8.828   0.099
 1041    H    ASN 144           H        ASN 144  19.742  12.920  -1.163
 1042    HA   ASN 144           HA       ASN 144  18.276  15.032  -2.327
 1043   1HB   ASN 144          HB2       ASN 144  21.303  14.805  -2.044
 1044   2HB   ASN 144          HB3       ASN 144  20.423  16.290  -2.356
 1045   1HD2  ASN 144          HD21      ASN 144  22.216  15.556  -0.083
 1046   2HD2  ASN 144          HD22      ASN 144  21.261  15.709   1.362
 1047    H    LEU 145           H        LEU 145  20.445  12.685  -3.785
 1048    HA   LEU 145           HA       LEU 145  20.827  14.147  -6.252
 1049   1HB   LEU 145          HB2       LEU 145  21.721  11.548  -5.110
 1050   2HB   LEU 145          HB3       LEU 145  21.411  11.497  -6.836
 1051    HG   LEU 145           HG       LEU 145  22.915  13.399  -7.226
 1052   1HD1  LEU 145          HD11      LEU 145  23.650  13.187  -4.273
 1053   2HD1  LEU 145          HD12      LEU 145  24.441  14.212  -5.487
 1054   3HD1  LEU 145          HD13      LEU 145  22.770  14.538  -5.010
 1055   1HD2  LEU 145          HD21      LEU 145  23.751  11.083  -7.367
 1056   2HD2  LEU 145          HD22      LEU 145  25.017  12.180  -6.796
 1057   3HD2  LEU 145          HD23      LEU 145  24.178  11.117  -5.643
 1058    H    LEU 146           H        LEU 146  18.771  11.304  -5.292
 1059    HA   LEU 146           HA       LEU 146  17.651  11.093  -7.911
 1060   1HB   LEU 146          HB2       LEU 146  16.399   9.373  -7.069
 1061   2HB   LEU 146          HB3       LEU 146  17.945   9.257  -6.272
 1062    HG   LEU 146           HG       LEU 146  16.586  10.538  -4.322
 1063   1HD1  LEU 146          HD11      LEU 146  14.281   9.619  -4.148
 1064   2HD1  LEU 146          HD12      LEU 146  14.413  10.723  -5.513
 1065   3HD1  LEU 146          HD13      LEU 146  14.412   8.972  -5.791
 1066   1HD2  LEU 146          HD21      LEU 146  16.343   7.560  -4.897
 1067   2HD2  LEU 146          HD22      LEU 146  17.707   8.368  -4.100
 1068   3HD2  LEU 146          HD23      LEU 146  16.128   8.339  -3.312
 1069    H    LYS 147           H        LYS 147  16.700  12.831  -5.004
 1070    HA   LYS 147           HA       LYS 147  14.059  13.569  -5.692
 1071   1HB   LYS 147          HB2       LYS 147  16.246  14.747  -3.961
 1072   2HB   LYS 147          HB3       LYS 147  14.817  15.717  -4.323
 1073   1HG   LYS 147          HG2       LYS 147  13.328  13.935  -3.473
 1074   2HG   LYS 147          HG3       LYS 147  14.736  12.941  -3.066
 1075   1HD   LYS 147          HD2       LYS 147  15.532  14.716  -1.523
 1076   2HD   LYS 147          HD3       LYS 147  14.118  15.703  -1.896
 1077   1HE   LYS 147          HE2       LYS 147  13.983  12.893  -0.706
 1078   2HE   LYS 147          HE3       LYS 147  14.023  14.361   0.269
 1079   1HZ   LYS 147          HZ1       LYS 147  11.800  13.492  -0.079
 1080   2HZ   LYS 147          HZ2       LYS 147  11.927  15.016  -0.673
 1081   3HZ   LYS 147          HZ3       LYS 147  11.893  13.733  -1.694
  Start of MODEL    7
    1   1H    MET   1          H1        MET   1   3.197  -2.476   1.353
    2   2H    MET   1          H2        MET   1   2.109  -1.429   1.983
    3   3H    MET   1          H3        MET   1   1.597  -2.622   0.970
    4    HA   MET   1           HA       MET   1   2.773  -1.687  -0.859
    5   1HB   MET   1          HB2       MET   1   0.475  -0.875  -0.518
    6   2HB   MET   1          HB3       MET   1   1.056   0.400   0.562
    7   1HG   MET   1          HG2       MET   1   0.588   1.228  -1.714
    8   2HG   MET   1          HG3       MET   1   2.270   1.464  -1.256
    9   1HE   MET   1          HE1       MET   1   2.652   0.987  -5.083
   10   2HE   MET   1          HE2       MET   1   1.400   1.881  -4.192
   11   3HE   MET   1          HE3       MET   1   3.096   1.954  -3.659
   12    H    ALA   2           H        ALA   2   4.594  -0.632  -1.541
   13    HA   ALA   2           HA       ALA   2   5.935   1.344   0.157
   14   1HB   ALA   2          HB1       ALA   2   7.998  -0.105   0.222
   15   2HB   ALA   2          HB2       ALA   2   6.661  -0.790   1.167
   16   3HB   ALA   2          HB3       ALA   2   7.048  -1.445  -0.432
   17    H    ASP   3           H        ASP   3   7.880   2.146  -0.922
   18    HA   ASP   3           HA       ASP   3   7.841   1.998  -3.877
   19   1HB   ASP   3          HB2       ASP   3   7.816   4.255  -2.658
   20   2HB   ASP   3          HB3       ASP   3   9.383   3.837  -2.005
   21    H    ILE   4           H        ILE   4   9.620   1.098  -0.986
   22    HA   ILE   4           HA       ILE   4  11.812  -0.046  -2.640
   23    HB   ILE   4           HB       ILE   4  12.164   1.161   0.114
   24   1HG1  ILE   4          HG12      ILE   4  12.748   2.630  -2.486
   25   2HG1  ILE   4          HG13      ILE   4  11.463   3.036  -1.346
   26   1HG2  ILE   4          HG21      ILE   4  13.837  -0.519  -0.768
   27   2HG2  ILE   4          HG22      ILE   4  14.170   0.578  -2.112
   28   3HG2  ILE   4          HG23      ILE   4  14.535   1.057  -0.441
   29   1HD1  ILE   4          HD11      ILE   4  13.272   4.557  -1.021
   30   2HD1  ILE   4          HD12      ILE   4  13.161   3.504   0.400
   31   3HD1  ILE   4          HD13      ILE   4  14.437   3.245  -0.811
   32    H    THR   5           H        THR   5  12.078  -2.199  -2.264
   33    HA   THR   5           HA       THR   5  10.888  -3.452   0.140
   34    HB   THR   5           HB       THR   5  10.438  -4.518  -2.018
   35    HG1  THR   5           HG1      THR   5  10.571  -5.960  -0.427
   36   1HG2  THR   5          HG21      THR   5  12.306  -3.881  -3.395
   37   2HG2  THR   5          HG22      THR   5  13.420  -4.852  -2.405
   38   3HG2  THR   5          HG23      THR   5  12.145  -5.638  -3.350
   39    H    LEU   6           H        LEU   6  12.199  -3.856   1.915
   40    HA   LEU   6           HA       LEU   6  15.148  -3.360   1.686
   41   1HB   LEU   6          HB2       LEU   6  13.173  -3.189   3.978
   42   2HB   LEU   6          HB3       LEU   6  14.872  -3.392   4.277
   43    HG   LEU   6           HG       LEU   6  13.982  -1.076   4.497
   44   1HD1  LEU   6          HD11      LEU   6  16.292  -1.460   2.572
   45   2HD1  LEU   6          HD12      LEU   6  15.937   0.025   3.476
   46   3HD1  LEU   6          HD13      LEU   6  16.358  -1.448   4.350
   47   1HD2  LEU   6          HD21      LEU   6  12.538  -1.036   2.462
   48   2HD2  LEU   6          HD22      LEU   6  13.645   0.347   2.576
   49   3HD2  LEU   6          HD23      LEU   6  14.009  -0.987   1.468
   50    H    ILE   7           H        ILE   7  15.816  -5.314   1.012
   51    HA   ILE   7           HA       ILE   7  14.518  -7.771   1.976
   52    HB   ILE   7           HB       ILE   7  16.771  -7.534  -0.059
   53   1HG1  ILE   7          HG12      ILE   7  13.837  -7.583  -0.875
   54   2HG1  ILE   7          HG13      ILE   7  14.718  -6.070  -0.731
   55   1HG2  ILE   7          HG21      ILE   7  15.852  -9.692  -0.853
   56   2HG2  ILE   7          HG22      ILE   7  16.191  -9.790   0.880
   57   3HG2  ILE   7          HG23      ILE   7  14.525  -9.574   0.305
   58   1HD1  ILE   7          HD11      ILE   7  14.727  -6.821  -3.040
   59   2HD1  ILE   7          HD12      ILE   7  16.372  -6.765  -2.379
   60   3HD1  ILE   7          HD13      ILE   7  15.546  -8.323  -2.590
   61    H    SER   8           H        SER   8  15.355  -8.710   3.809
   62    HA   SER   8           HA       SER   8  18.237  -8.286   4.471
   63   1HB   SER   8          HB2       SER   8  16.101  -8.500   6.571
   64   2HB   SER   8          HB3       SER   8  17.636  -7.622   6.604
   65    HG   SER   8           HG       SER   8  15.199  -6.968   5.328
   66    H    GLY   9           H        GLY   9  19.026  -9.865   6.194
   67   1HA   GLY   9          HA2       GLY   9  19.245 -11.959   7.117
   68   2HA   GLY   9          HA3       GLY   9  17.508 -12.202   6.819
   69    H    SER  10           H        SER  10  20.037 -11.568   4.398
   70    HA   SER  10           HA       SER  10  18.998 -13.232   2.488
   71   1HB   SER  10          HB2       SER  10  21.834 -12.163   2.745
   72   2HB   SER  10          HB3       SER  10  20.945 -12.495   1.244
   73    HG   SER  10           HG       SER  10  21.057 -10.256   2.118
   74    H    THR  11           H        THR  11  20.536 -14.534   5.135
   75    HA   THR  11           HA       THR  11  21.443 -16.962   3.647
   76    HB   THR  11           HB       THR  11  22.558 -16.117   6.326
   77    HG1  THR  11           HG1      THR  11  24.166 -15.380   4.289
   78   1HG2  THR  11          HG21      THR  11  23.164 -18.355   5.485
   79   2HG2  THR  11          HG22      THR  11  23.740 -17.654   3.963
   80   3HG2  THR  11          HG23      THR  11  24.578 -17.297   5.492
   81    H    LEU  12           H        LEU  12  18.767 -16.229   4.572
   82    HA   LEU  12           HA       LEU  12  17.020 -16.841   5.744
   83   1HB   LEU  12          HB2       LEU  12  17.445 -19.008   4.713
   84   2HB   LEU  12          HB3       LEU  12  18.405 -19.515   6.104
   85    HG   LEU  12           HG       LEU  12  16.394 -19.379   7.559
   86   1HD1  LEU  12          HD11      LEU  12  14.919 -18.602   5.004
   87   2HD1  LEU  12          HD12      LEU  12  14.141 -19.110   6.518
   88   3HD1  LEU  12          HD13      LEU  12  15.080 -17.622   6.481
   89   1HD2  LEU  12          HD21      LEU  12  15.202 -21.300   6.613
   90   2HD2  LEU  12          HD22      LEU  12  15.936 -20.999   5.022
   91   3HD2  LEU  12          HD23      LEU  12  16.949 -21.482   6.399
   92    H    GLY  13           H        GLY  13  17.970 -15.132   6.974
   93   1HA   GLY  13          HA2       GLY  13  18.132 -15.758   9.867
   94   2HA   GLY  13          HA3       GLY  13  19.474 -14.867   9.128
   95    H    GLY  14           H        GLY  14  19.045 -12.862  10.196
   96   1HA   GLY  14          HA2       GLY  14  17.061 -11.210   8.885
   97   2HA   GLY  14          HA3       GLY  14  16.699 -11.491  10.593
   98    H    ALA  15           H        ALA  15  17.235  -8.971   9.589
   99    HA   ALA  15           HA       ALA  15  19.494  -8.123  11.253
  100   1HB   ALA  15          HB1       ALA  15  20.516  -8.407   8.988
  101   2HB   ALA  15          HB2       ALA  15  19.273  -7.334   8.301
  102   3HB   ALA  15          HB3       ALA  15  20.449  -6.703   9.471
  103    H    GLU  16           H        GLU  16  16.713  -8.098  11.654
  104    HA   GLU  16           HA       GLU  16  15.202  -6.079  10.515
  105   1HB   GLU  16          HB2       GLU  16  14.982  -7.313  13.284
  106   2HB   GLU  16          HB3       GLU  16  13.734  -6.320  12.519
  107   1HG   GLU  16          HG2       GLU  16  13.587  -7.938  10.639
  108   2HG   GLU  16          HG3       GLU  16  14.799  -8.957  11.417
  109    H    TYR  17           H        TYR  17  17.376  -5.737  13.356
  110    HA   TYR  17           HA       TYR  17  16.492  -3.174  14.183
  111   1HB   TYR  17          HB2       TYR  17  18.007  -4.512  15.530
  112   2HB   TYR  17          HB3       TYR  17  19.238  -4.485  14.273
  113    HD1  TYR  17           HD1      TYR  17  17.418  -2.352  16.750
  114    HD2  TYR  17           HD2      TYR  17  20.798  -2.661  14.081
  115    HE1  TYR  17           HE1      TYR  17  18.371  -0.278  17.716
  116    HE2  TYR  17           HE2      TYR  17  21.750  -0.589  15.030
  117    HH   TYR  17           HH       TYR  17  21.459   1.154  16.560
  118    H    VAL  18           H        VAL  18  18.888  -4.106  11.675
  119    HA   VAL  18           HA       VAL  18  19.663  -1.351  11.108
  120    HB   VAL  18           HB       VAL  18  20.163  -3.984   9.634
  121   1HG1  VAL  18          HG11      VAL  18  20.458  -2.031   8.142
  122   2HG1  VAL  18          HG12      VAL  18  21.582  -1.307   9.311
  123   3HG1  VAL  18          HG13      VAL  18  21.973  -2.844   8.491
  124   1HG2  VAL  18          HG21      VAL  18  21.185  -4.044  11.870
  125   2HG2  VAL  18          HG22      VAL  18  22.434  -3.861  10.644
  126   3HG2  VAL  18          HG23      VAL  18  21.926  -2.451  11.599
  127    H    ALA  19           H        ALA  19  17.656  -3.924   9.612
  128    HA   ALA  19           HA       ALA  19  17.041  -2.503   7.253
  129   1HB   ALA  19          HB1       ALA  19  16.796  -4.955   7.593
  130   2HB   ALA  19          HB2       ALA  19  15.386  -4.655   8.636
  131   3HB   ALA  19          HB3       ALA  19  15.341  -4.205   6.915
  132    H    GLU  20           H        GLU  20  15.251  -2.655  10.392
  133    HA   GLU  20           HA       GLU  20  13.054  -1.066   9.452
  134   1HB   GLU  20          HB2       GLU  20  13.011  -2.657  11.388
  135   2HB   GLU  20          HB3       GLU  20  14.003  -1.512  12.310
  136   1HG   GLU  20          HG2       GLU  20  12.213   0.204  12.047
  137   2HG   GLU  20          HG3       GLU  20  11.258  -0.937  11.102
  138    H    HIS  21           H        HIS  21  16.166  -0.256  11.120
  139    HA   HIS  21           HA       HIS  21  15.545   2.498  11.559
  140   1HB   HIS  21          HB2       HIS  21  17.422   1.399  12.668
  141   2HB   HIS  21          HB3       HIS  21  18.214   1.094  11.121
  142    HD1  HIS  21           HD1      HIS  21  19.752   3.052  10.215
  143    HD2  HIS  21           HD2      HIS  21  17.180   4.113  13.377
  144    HE1  HIS  21           HE1      HIS  21  20.381   5.425  10.885
  145    H    LEU  22           H        LEU  22  17.189   0.824   8.838
  146    HA   LEU  22           HA       LEU  22  17.622   3.055   7.141
  147   1HB   LEU  22          HB2       LEU  22  17.067   0.104   6.678
  148   2HB   LEU  22          HB3       LEU  22  17.245   1.187   5.322
  149    HG   LEU  22           HG       LEU  22  19.373   0.915   7.491
  150   1HD1  LEU  22          HD11      LEU  22  19.204  -0.557   4.826
  151   2HD1  LEU  22          HD12      LEU  22  20.514  -0.654   6.036
  152   3HD1  LEU  22          HD13      LEU  22  18.914  -1.276   6.424
  153   1HD2  LEU  22          HD21      LEU  22  20.883   1.805   5.730
  154   2HD2  LEU  22          HD22      LEU  22  19.503   1.975   4.626
  155   3HD2  LEU  22          HD23      LEU  22  19.594   2.953   6.105
  156    H    ALA  23           H        ALA  23  14.900   0.739   7.183
  157    HA   ALA  23           HA       ALA  23  13.273   1.866   5.266
  158   1HB   ALA  23          HB1       ALA  23  11.399   0.739   6.488
  159   2HB   ALA  23          HB2       ALA  23  12.819  -0.301   6.320
  160   3HB   ALA  23          HB3       ALA  23  12.462   0.495   7.865
  161    H    GLU  24           H        GLU  24  13.291   2.706   8.786
  162    HA   GLU  24           HA       GLU  24  11.196   4.574   8.707
  163   1HB   GLU  24          HB2       GLU  24  12.402   3.568  10.717
  164   2HB   GLU  24          HB3       GLU  24  13.679   4.737  10.490
  165   1HG   GLU  24          HG2       GLU  24  12.071   6.572  10.769
  166   2HG   GLU  24          HG3       GLU  24  10.740   5.424  10.923
  167    H    LYS  25           H        LYS  25  14.733   5.209   8.612
  168    HA   LYS  25           HA       LYS  25  14.561   7.977   8.117
  169   1HB   LYS  25          HB2       LYS  25  16.635   5.879   7.329
  170   2HB   LYS  25          HB3       LYS  25  16.894   7.596   7.151
  171   1HG   LYS  25          HG2       LYS  25  16.354   6.086   9.763
  172   2HG   LYS  25          HG3       LYS  25  17.885   6.699   9.231
  173   1HD   LYS  25          HD2       LYS  25  15.489   8.210  10.249
  174   2HD   LYS  25          HD3       LYS  25  17.116   8.153  10.920
  175   1HE   LYS  25          HE2       LYS  25  17.918   9.383   8.831
  176   2HE   LYS  25          HE3       LYS  25  16.214   9.584   8.382
  177   1HZ   LYS  25          HZ1       LYS  25  17.042  11.516   9.555
  178   2HZ   LYS  25          HZ2       LYS  25  15.887  10.808  10.459
  179   3HZ   LYS  25          HZ3       LYS  25  17.464  10.633  10.855
  180    H    LEU  26           H        LEU  26  14.560   5.317   5.775
  181    HA   LEU  26           HA       LEU  26  14.587   6.967   3.430
  182   1HB   LEU  26          HB2       LEU  26  13.599   4.168   4.008
  183   2HB   LEU  26          HB3       LEU  26  13.479   4.872   2.395
  184    HG   LEU  26           HG       LEU  26  16.128   4.658   3.888
  185   1HD1  LEU  26          HD11      LEU  26  15.144   2.405   3.618
  186   2HD1  LEU  26          HD12      LEU  26  14.966   2.693   1.873
  187   3HD1  LEU  26          HD13      LEU  26  16.582   2.635   2.619
  188   1HD2  LEU  26          HD21      LEU  26  16.157   6.266   2.045
  189   2HD2  LEU  26          HD22      LEU  26  17.065   4.823   1.588
  190   3HD2  LEU  26          HD23      LEU  26  15.427   5.067   0.955
  191    H    GLU  27           H        GLU  27  11.804   5.908   5.550
  192    HA   GLU  27           HA       GLU  27   9.894   7.040   3.725
  193   1HB   GLU  27          HB2       GLU  27   9.719   6.290   6.675
  194   2HB   GLU  27          HB3       GLU  27   8.393   6.897   5.689
  195   1HG   GLU  27          HG2       GLU  27   8.999   4.977   4.038
  196   2HG   GLU  27          HG3       GLU  27   9.885   4.305   5.382
  197    H    GLU  28           H        GLU  28  11.731   8.303   6.574
  198    HA   GLU  28           HA       GLU  28  10.545  10.879   6.591
  199   1HB   GLU  28          HB2       GLU  28  13.318   9.869   7.354
  200   2HB   GLU  28          HB3       GLU  28  12.765  11.493   7.646
  201   1HG   GLU  28          HG2       GLU  28  11.439   9.008   8.792
  202   2HG   GLU  28          HG3       GLU  28  12.641   9.986   9.618
  203    H    ALA  29           H        ALA  29  13.015   9.431   4.471
  204    HA   ALA  29           HA       ALA  29  13.847  11.907   3.265
  205   1HB   ALA  29          HB1       ALA  29  14.960  10.509   1.624
  206   2HB   ALA  29          HB2       ALA  29  15.223   9.831   3.242
  207   3HB   ALA  29          HB3       ALA  29  14.044   9.086   2.135
  208    H    GLY  30           H        GLY  30  10.921  10.090   2.957
  209   1HA   GLY  30          HA2       GLY  30   9.181  11.460   1.995
  210   2HA   GLY  30          HA3       GLY  30  10.181  11.733   0.570
  211    H    PHE  31           H        PHE  31  10.389   8.428   1.617
  212    HA   PHE  31           HA       PHE  31   8.524   7.689  -0.605
  213   1HB   PHE  31          HB2       PHE  31  10.770   5.930   0.327
  214   2HB   PHE  31          HB3       PHE  31   9.965   5.990  -1.221
  215    HD1  PHE  31           HD1      PHE  31  12.947   6.866   0.463
  216    HD2  PHE  31           HD2      PHE  31  10.223   8.321  -2.551
  217    HE1  PHE  31           HE1      PHE  31  14.713   8.374  -0.408
  218    HE2  PHE  31           HE2      PHE  31  11.994   9.829  -3.417
  219    HZ   PHE  31           HZ       PHE  31  14.232   9.873  -2.336
  220    H    THR  32           H        THR  32   8.353   4.947  -0.137
  221    HA   THR  32           HA       THR  32   7.465   4.595   2.648
  222    HB   THR  32           HB       THR  32   5.666   3.052   1.712
  223    HG1  THR  32           HG1      THR  32   5.890   4.838  -0.492
  224   1HG2  THR  32          HG21      THR  32   5.288   6.066   1.511
  225   2HG2  THR  32          HG22      THR  32   3.995   4.850   1.675
  226   3HG2  THR  32          HG23      THR  32   5.178   5.067   2.979
  227    H    THR  33           H        THR  33   7.898   2.467   3.393
  228    HA   THR  33           HA       THR  33   9.550   0.816   1.528
  229    HB   THR  33           HB       THR  33  11.269   0.733   3.214
  230    HG1  THR  33           HG1      THR  33  10.932   2.587   4.863
  231   1HG2  THR  33          HG21      THR  33  12.223   2.857   2.900
  232   2HG2  THR  33          HG22      THR  33  11.201   2.631   1.484
  233   3HG2  THR  33          HG23      THR  33  10.636   3.674   2.798
  234    H    GLU  34           H        GLU  34   9.839  -1.372   2.036
  235    HA   GLU  34           HA       GLU  34   7.932  -2.546   3.964
  236   1HB   GLU  34          HB2       GLU  34   8.084  -2.698   1.199
  237   2HB   GLU  34          HB3       GLU  34   8.974  -4.111   1.680
  238   1HG   GLU  34          HG2       GLU  34   6.779  -4.693   1.423
  239   2HG   GLU  34          HG3       GLU  34   7.086  -4.761   3.151
  240    H    THR  35           H        THR  35   9.261  -2.845   5.806
  241    HA   THR  35           HA       THR  35  11.984  -3.837   5.597
  242    HB   THR  35           HB       THR  35  10.228  -3.937   8.076
  243    HG1  THR  35           HG1      THR  35  10.108  -1.828   7.571
  244   1HG2  THR  35          HG21      THR  35  12.382  -3.746   9.214
  245   2HG2  THR  35          HG22      THR  35  12.492  -5.073   8.037
  246   3HG2  THR  35          HG23      THR  35  13.212  -3.498   7.658
  247    H    LEU  36           H        LEU  36  12.481  -5.936   5.113
  248    HA   LEU  36           HA       LEU  36  10.573  -8.115   5.864
  249   1HB   LEU  36          HB2       LEU  36  11.747  -7.496   3.118
  250   2HB   LEU  36          HB3       LEU  36  10.887  -8.975   3.510
  251    HG   LEU  36           HG       LEU  36   9.612  -6.222   3.708
  252   1HD1  LEU  36          HD11      LEU  36   9.545  -8.215   1.423
  253   2HD1  LEU  36          HD12      LEU  36   8.574  -6.721   1.554
  254   3HD1  LEU  36          HD13      LEU  36  10.339  -6.625   1.442
  255   1HD2  LEU  36          HD21      LEU  36   7.491  -7.476   3.626
  256   2HD2  LEU  36          HD22      LEU  36   8.378  -9.016   3.576
  257   3HD2  LEU  36          HD23      LEU  36   8.447  -7.983   5.022
  258    H    HIS  37           H        HIS  37  11.486 -10.151   6.070
  259    HA   HIS  37           HA       HIS  37  14.436 -10.355   6.033
  260   1HB   HIS  37          HB2       HIS  37  14.102 -12.458   7.222
  261   2HB   HIS  37          HB3       HIS  37  13.356 -11.103   8.048
  262    HD1  HIS  37           HD1      HIS  37  12.206 -13.999   5.730
  263    HD2  HIS  37           HD2      HIS  37  10.897 -11.484   8.837
  264    HE1  HIS  37           HE1      HIS  37   9.899 -14.861   6.431
  265    H    GLY  38           H        GLY  38  13.140  -9.958   3.569
  266   1HA   GLY  38          HA2       GLY  38  12.831 -10.734   1.454
  267   2HA   GLY  38          HA3       GLY  38  14.269 -11.704   1.798
  268    HA   PRO  39           HA       PRO  39  10.938 -14.819   3.024
  269   1HB   PRO  39          HB2       PRO  39   8.229 -14.295   2.894
  270   2HB   PRO  39          HB3       PRO  39   9.251 -13.919   4.310
  271   1HG   PRO  39          HG2       PRO  39   8.428 -12.060   2.062
  272   2HG   PRO  39          HG3       PRO  39   8.357 -11.761   3.830
  273   1HD   PRO  39          HD2       PRO  39  10.422 -10.852   2.314
  274   2HD   PRO  39          HD3       PRO  39  10.694 -11.485   3.970
  275    H    LEU  40           H        LEU  40  10.232 -12.830   0.173
  276    HA   LEU  40           HA       LEU  40   9.659 -15.207  -1.479
  277   1HB   LEU  40          HB2       LEU  40   7.561 -14.306  -1.186
  278   2HB   LEU  40          HB3       LEU  40   8.176 -12.723  -0.746
  279    HG   LEU  40           HG       LEU  40   8.720 -12.259  -3.022
  280   1HD1  LEU  40          HD11      LEU  40   8.574 -14.654  -3.985
  281   2HD1  LEU  40          HD12      LEU  40   6.835 -14.611  -3.695
  282   3HD1  LEU  40          HD13      LEU  40   7.569 -13.501  -4.873
  283   1HD2  LEU  40          HD21      LEU  40   5.770 -12.800  -2.456
  284   2HD2  LEU  40          HD22      LEU  40   6.695 -11.399  -1.895
  285   3HD2  LEU  40          HD23      LEU  40   6.404 -11.620  -3.627
  286    H    LEU  41           H        LEU  41  12.091 -13.382  -0.658
  287    HA   LEU  41           HA       LEU  41  13.859 -12.322  -1.463
  288   1HB   LEU  41          HB2       LEU  41  13.826 -14.348  -3.052
  289   2HB   LEU  41          HB3       LEU  41  13.119 -13.266  -4.242
  290    HG   LEU  41           HG       LEU  41  15.224 -11.747  -3.840
  291   1HD1  LEU  41          HD11      LEU  41  17.224 -13.004  -3.151
  292   2HD1  LEU  41          HD12      LEU  41  16.063 -12.893  -1.824
  293   3HD1  LEU  41          HD13      LEU  41  16.219 -14.410  -2.740
  294   1HD2  LEU  41          HD21      LEU  41  16.534 -13.062  -5.471
  295   2HD2  LEU  41          HD22      LEU  41  15.416 -14.426  -5.244
  296   3HD2  LEU  41          HD23      LEU  41  14.831 -12.899  -5.924
  297    H    GLU  42           H        GLU  42  10.833 -11.591  -3.082
  298    HA   GLU  42           HA       GLU  42  11.611  -8.784  -3.516
  299   1HB   GLU  42          HB2       GLU  42  11.095  -8.988  -5.963
  300   2HB   GLU  42          HB3       GLU  42  12.583  -9.745  -5.433
  301   1HG   GLU  42          HG2       GLU  42  11.475 -11.984  -5.500
  302   2HG   GLU  42          HG3       GLU  42  10.015 -11.237  -6.131
  303    H    ASP  43           H        ASP  43   9.914  -8.562  -1.874
  304    HA   ASP  43           HA       ASP  43   7.186  -9.306  -2.430
  305   1HB   ASP  43          HB2       ASP  43   7.882  -8.647  -0.190
  306   2HB   ASP  43          HB3       ASP  43   8.276  -7.017  -0.774
  307    H    LEU  44           H        LEU  44   9.132  -6.353  -3.177
  308    HA   LEU  44           HA       LEU  44   6.917  -5.344  -4.862
  309   1HB   LEU  44          HB2       LEU  44   9.743  -4.292  -4.548
  310   2HB   LEU  44          HB3       LEU  44   8.529  -3.546  -5.510
  311    HG   LEU  44           HG       LEU  44   8.432  -3.820  -2.487
  312   1HD1  LEU  44          HD11      LEU  44   8.528  -1.350  -4.274
  313   2HD1  LEU  44          HD12      LEU  44   8.637  -1.408  -2.502
  314   3HD1  LEU  44          HD13      LEU  44   9.947  -2.069  -3.503
  315   1HD2  LEU  44          HD21      LEU  44   6.344  -2.647  -4.377
  316   2HD2  LEU  44          HD22      LEU  44   6.135  -4.025  -3.267
  317   3HD2  LEU  44          HD23      LEU  44   6.374  -2.407  -2.618
  318    HA   PRO  45           HA       PRO  45   8.139  -7.639  -8.369
  319   1HB   PRO  45          HB2       PRO  45   7.481  -5.939 -10.488
  320   2HB   PRO  45          HB3       PRO  45   6.337  -6.833  -9.488
  321   1HG   PRO  45          HG2       PRO  45   7.275  -3.957  -9.239
  322   2HG   PRO  45          HG3       PRO  45   5.607  -4.569  -9.130
  323   1HD   PRO  45          HD2       PRO  45   7.119  -3.991  -6.919
  324   2HD   PRO  45          HD3       PRO  45   5.911  -5.315  -6.936
  325    H    ALA  46           H        ALA  46   9.125  -7.203 -10.662
  326    HA   ALA  46           HA       ALA  46  11.899  -6.420 -10.347
  327   1HB   ALA  46          HB1       ALA  46  10.329  -7.294 -12.825
  328   2HB   ALA  46          HB2       ALA  46  12.093  -7.184 -12.712
  329   3HB   ALA  46          HB3       ALA  46  11.229  -8.378 -11.732
  330    H    SER  47           H        SER  47  10.066  -4.272  -9.897
  331    HA   SER  47           HA       SER  47  10.962  -2.215 -11.694
  332   1HB   SER  47          HB2       SER  47   7.993  -2.647 -11.314
  333   2HB   SER  47          HB3       SER  47   8.762  -1.372 -12.265
  334    HG   SER  47           HG       SER  47   7.952  -3.090 -13.556
  335    H    GLY  48           H        GLY  48  11.315  -0.424 -10.327
  336   1HA   GLY  48          HA2       GLY  48  10.105   0.951  -8.489
  337   2HA   GLY  48          HA3       GLY  48  10.144  -0.556  -7.574
  338    H    ILE  49           H        ILE  49  11.531   0.071  -5.984
  339    HA   ILE  49           HA       ILE  49  14.394   0.320  -6.766
  340    HB   ILE  49           HB       ILE  49  13.132   1.440  -4.256
  341   1HG1  ILE  49          HG12      ILE  49  12.245   2.817  -6.071
  342   2HG1  ILE  49          HG13      ILE  49  13.345   3.702  -5.039
  343   1HG2  ILE  49          HG21      ILE  49  15.913   1.807  -5.453
  344   2HG2  ILE  49          HG22      ILE  49  15.292   2.671  -4.026
  345   3HG2  ILE  49          HG23      ILE  49  15.500   0.921  -3.983
  346   1HD1  ILE  49          HD11      ILE  49  15.127   3.556  -6.724
  347   2HD1  ILE  49          HD12      ILE  49  14.077   2.597  -7.782
  348   3HD1  ILE  49          HD13      ILE  49  13.661   4.276  -7.406
  349    H    TRP  50           H        TRP  50  15.717  -1.131  -5.597
  350    HA   TRP  50           HA       TRP  50  14.426  -2.940  -3.597
  351   1HB   TRP  50          HB2       TRP  50  16.314  -3.506  -5.917
  352   2HB   TRP  50          HB3       TRP  50  16.310  -4.513  -4.505
  353    HD1  TRP  50           HD1      TRP  50  12.866  -3.461  -5.846
  354    HE1  TRP  50           HE1      TRP  50  11.733  -5.403  -7.034
  355    HE3  TRP  50           HE3      TRP  50  16.784  -6.749  -5.810
  356    HZ2  TRP  50           HZ2      TRP  50  12.452  -8.080  -7.873
  357    HZ3  TRP  50           HZ3      TRP  50  16.528  -8.996  -6.827
  358    HH2  TRP  50           HH2      TRP  50  14.371  -9.670  -7.858
  359    H    LEU  51           H        LEU  51  15.833  -3.368  -1.788
  360    HA   LEU  51           HA       LEU  51  18.599  -2.324  -1.895
  361   1HB   LEU  51          HB2       LEU  51  16.550  -1.710   0.271
  362   2HB   LEU  51          HB3       LEU  51  18.287  -1.550   0.499
  363    HG   LEU  51           HG       LEU  51  16.589   0.077  -1.447
  364   1HD1  LEU  51          HD11      LEU  51  18.012   0.899   1.123
  365   2HD1  LEU  51          HD12      LEU  51  17.020   1.930   0.072
  366   3HD1  LEU  51          HD13      LEU  51  16.276   0.596   0.968
  367   1HD2  LEU  51          HD21      LEU  51  18.631   1.497  -1.707
  368   2HD2  LEU  51          HD22      LEU  51  19.578   0.275  -0.830
  369   3HD2  LEU  51          HD23      LEU  51  18.838  -0.111  -2.388
  370    H    VAL  52           H        VAL  52  19.978  -3.746  -0.784
  371    HA   VAL  52           HA       VAL  52  18.676  -6.086   0.511
  372    HB   VAL  52           HB       VAL  52  18.935  -6.877  -1.613
  373   1HG1  VAL  52          HG11      VAL  52  20.258  -5.119  -2.702
  374   2HG1  VAL  52          HG12      VAL  52  21.720  -5.706  -1.867
  375   3HG1  VAL  52          HG13      VAL  52  20.900  -6.720  -3.063
  376   1HG2  VAL  52          HG21      VAL  52  19.935  -8.381   0.092
  377   2HG2  VAL  52          HG22      VAL  52  20.658  -8.597  -1.513
  378   3HG2  VAL  52          HG23      VAL  52  21.538  -7.703  -0.275
  379    H    ILE  53           H        ILE  53  19.439  -6.505   2.421
  380    HA   ILE  53           HA       ILE  53  21.889  -5.122   3.353
  381    HB   ILE  53           HB       ILE  53  19.473  -6.024   4.985
  382   1HG1  ILE  53          HG12      ILE  53  19.101  -3.487   5.254
  383   2HG1  ILE  53          HG13      ILE  53  20.036  -3.291   3.780
  384   1HG2  ILE  53          HG21      ILE  53  21.614  -5.814   6.233
  385   2HG2  ILE  53          HG22      ILE  53  21.793  -4.148   5.644
  386   3HG2  ILE  53          HG23      ILE  53  20.453  -4.587   6.727
  387   1HD1  ILE  53          HD11      ILE  53  17.548  -3.261   3.501
  388   2HD1  ILE  53          HD12      ILE  53  18.299  -4.496   2.512
  389   3HD1  ILE  53          HD13      ILE  53  17.481  -4.946   4.029
  390    H    SER  54           H        SER  54  23.549  -6.560   3.303
  391    HA   SER  54           HA       SER  54  23.279  -9.149   4.677
  392   1HB   SER  54          HB2       SER  54  24.494  -9.186   1.917
  393   2HB   SER  54          HB3       SER  54  23.834 -10.508   2.875
  394    HG   SER  54           HG       SER  54  22.406  -8.430   1.560
  395    H    SER  55           H        SER  55  25.906 -10.103   3.839
  396    HA   SER  55           HA       SER  55  27.774  -7.887   3.984
  397   1HB   SER  55          HB2       SER  55  27.726 -10.031   6.152
  398   2HB   SER  55          HB3       SER  55  29.028  -8.852   5.906
  399    HG   SER  55           HG       SER  55  26.597  -7.655   6.004
  400    H    THR  56           H        THR  56  29.825  -8.542   3.137
  401    HA   THR  56           HA       THR  56  30.262 -11.378   2.463
  402    HB   THR  56           HB       THR  56  30.873 -10.677   0.079
  403    HG1  THR  56           HG1      THR  56  29.876  -8.803  -0.645
  404   1HG2  THR  56          HG21      THR  56  27.919 -10.298   0.671
  405   2HG2  THR  56          HG22      THR  56  28.683 -10.919  -0.804
  406   3HG2  THR  56          HG23      THR  56  28.728 -11.884   0.685
  407    H    HIS  57           H        HIS  57  31.544  -8.040   2.475
  408    HA   HIS  57           HA       HIS  57  33.623  -7.196   2.747
  409   1HB   HIS  57          HB2       HIS  57  33.031  -8.480   4.929
  410   2HB   HIS  57          HB3       HIS  57  34.251  -9.633   4.429
  411    HD1  HIS  57           HD1      HIS  57  34.869  -5.820   3.997
  412    HD2  HIS  57           HD2      HIS  57  35.657  -9.001   6.647
  413    HE1  HIS  57           HE1      HIS  57  36.589  -4.970   5.647
  414    H    GLY  58           H        GLY  58  33.306  -9.153   0.446
  415   1HA   GLY  58          HA2       GLY  58  35.185  -9.223  -1.189
  416   2HA   GLY  58          HA3       GLY  58  36.158  -9.954   0.093
  417    H    ALA  59           H        ALA  59  33.873 -11.624   1.079
  418    HA   ALA  59           HA       ALA  59  32.874 -13.177  -1.133
  419   1HB   ALA  59          HB1       ALA  59  35.062 -14.270  -1.054
  420   2HB   ALA  59          HB2       ALA  59  34.956 -14.457   0.707
  421   3HB   ALA  59          HB3       ALA  59  33.857 -15.358  -0.354
  422    H    GLY  60           H        GLY  60  33.738 -13.912   2.299
  423   1HA   GLY  60          HA2       GLY  60  31.736 -13.045   3.824
  424   2HA   GLY  60          HA3       GLY  60  30.934 -14.373   2.983
  425    H    ASP  61           H        ASP  61  30.735 -15.334   5.118
  426    HA   ASP  61           HA       ASP  61  33.070 -16.466   6.467
  427   1HB   ASP  61          HB2       ASP  61  30.924 -16.169   7.639
  428   2HB   ASP  61          HB3       ASP  61  30.128 -17.251   6.492
  429    H    ILE  62           H        ILE  62  31.023 -17.224   3.741
  430    HA   ILE  62           HA       ILE  62  32.858 -19.290   2.813
  431    HB   ILE  62           HB       ILE  62  30.932 -20.659   1.968
  432   1HG1  ILE  62          HG12      ILE  62  29.203 -19.107   3.950
  433   2HG1  ILE  62          HG13      ILE  62  29.171 -18.878   2.205
  434   1HG2  ILE  62          HG21      ILE  62  32.262 -21.276   3.996
  435   2HG2  ILE  62          HG22      ILE  62  31.001 -20.534   5.004
  436   3HG2  ILE  62          HG23      ILE  62  30.627 -21.938   3.986
  437   1HD1  ILE  62          HD11      ILE  62  28.398 -21.418   3.680
  438   2HD1  ILE  62          HD12      ILE  62  27.334 -20.294   2.822
  439   3HD1  ILE  62          HD13      ILE  62  28.505 -21.265   1.908
  440    HA   PRO  63           HA       PRO  63  32.393 -16.921  -0.946
  441   1HB   PRO  63          HB2       PRO  63  31.816 -19.521  -2.373
  442   2HB   PRO  63          HB3       PRO  63  32.946 -18.213  -2.838
  443   1HG   PRO  63          HG2       PRO  63  33.892 -20.466  -1.681
  444   2HG   PRO  63          HG3       PRO  63  34.511 -18.868  -1.150
  445   1HD   PRO  63          HD2       PRO  63  32.422 -20.608   0.174
  446   2HD   PRO  63          HD3       PRO  63  33.789 -19.718   0.911
  447    H    ASP  64           H        ASP  64  29.860 -19.223  -0.132
  448    HA   ASP  64           HA       ASP  64  27.859 -17.882  -1.870
  449   1HB   ASP  64          HB2       ASP  64  28.311 -20.310  -2.175
  450   2HB   ASP  64          HB3       ASP  64  27.835 -20.599  -0.500
  451    H    ASN  65           H        ASN  65  28.692 -16.493   0.326
  452    HA   ASN  65           HA       ASN  65  27.692 -16.994   2.811
  453   1HB   ASN  65          HB2       ASN  65  29.314 -15.164   1.929
  454   2HB   ASN  65          HB3       ASN  65  27.878 -14.162   1.793
  455   1HD2  ASN  65          HD22      ASN  65  27.624 -12.841   3.677
  456   2HD2  ASN  65          HD21      ASN  65  28.015 -13.402   5.278
  457    H    LEU  66           H        LEU  66  25.708 -15.928   0.211
  458    HA   LEU  66           HA       LEU  66  23.405 -15.709   2.019
  459   1HB   LEU  66          HB2       LEU  66  22.423 -13.950   0.631
  460   2HB   LEU  66          HB3       LEU  66  23.638 -13.458   1.792
  461    HG   LEU  66           HG       LEU  66  24.108 -13.626  -1.223
  462   1HD1  LEU  66          HD11      LEU  66  23.240 -11.404   0.662
  463   2HD1  LEU  66          HD12      LEU  66  23.878 -11.057  -0.931
  464   3HD1  LEU  66          HD13      LEU  66  22.390 -11.995  -0.771
  465   1HD2  LEU  66          HD21      LEU  66  25.739 -12.450   1.082
  466   2HD2  LEU  66          HD22      LEU  66  26.256 -13.675  -0.100
  467   3HD2  LEU  66          HD23      LEU  66  26.004 -12.018  -0.617
  468    H    SER  67           H        SER  67  23.102 -17.734   1.522
  469    HA   SER  67           HA       SER  67  23.633 -18.935  -1.010
  470   1HB   SER  67          HB2       SER  67  22.230 -20.218   1.343
  471   2HB   SER  67          HB3       SER  67  23.333 -20.951   0.172
  472    HG   SER  67           HG       SER  67  24.937 -19.414   1.193
  473    HA   PRO  68           HA       PRO  68  18.905 -19.650  -1.169
  474   1HB   PRO  68          HB2       PRO  68  17.202 -18.035   0.267
  475   2HB   PRO  68          HB3       PRO  68  17.892 -19.566   0.876
  476   1HG   PRO  68          HG2       PRO  68  18.863 -16.779   1.445
  477   2HG   PRO  68          HG3       PRO  68  18.616 -18.118   2.607
  478   1HD   PRO  68          HD2       PRO  68  21.029 -17.566   1.622
  479   2HD   PRO  68          HD3       PRO  68  20.531 -19.237   1.948
  480    H    PHE  69           H        PHE  69  20.084 -16.425  -0.470
  481    HA   PHE  69           HA       PHE  69  18.531 -14.931  -2.352
  482   1HB   PHE  69          HB2       PHE  69  20.466 -14.285  -0.543
  483   2HB   PHE  69          HB3       PHE  69  21.412 -14.131  -1.965
  484    HD1  PHE  69           HD1      PHE  69  19.004 -12.419   0.062
  485    HD2  PHE  69           HD2      PHE  69  20.479 -12.761  -3.977
  486    HE1  PHE  69           HE1      PHE  69  18.102 -10.183  -0.464
  487    HE2  PHE  69           HE2      PHE  69  19.503 -10.544  -4.518
  488    HZ   PHE  69           HZ       PHE  69  18.293  -9.256  -2.766
  489    H    TYR  70           H        TYR  70  21.851 -16.075  -2.623
  490    HA   TYR  70           HA       TYR  70  22.229 -15.455  -5.302
  491   1HB   TYR  70          HB2       TYR  70  24.010 -16.036  -3.677
  492   2HB   TYR  70          HB3       TYR  70  23.550 -17.725  -3.831
  493    HD1  TYR  70           HD1      TYR  70  24.983 -18.988  -5.209
  494    HD2  TYR  70           HD2      TYR  70  24.341 -14.824  -6.139
  495    HE1  TYR  70           HE1      TYR  70  26.553 -19.172  -7.114
  496    HE2  TYR  70           HE2      TYR  70  25.904 -14.996  -8.041
  497    HH   TYR  70           HH       TYR  70  27.293 -16.410  -9.288
  498    H    GLU  71           H        GLU  71  21.167 -18.728  -4.043
  499    HA   GLU  71           HA       GLU  71  20.941 -19.854  -6.627
  500   1HB   GLU  71          HB2       GLU  71  19.382 -20.506  -4.085
  501   2HB   GLU  71          HB3       GLU  71  19.422 -21.487  -5.560
  502   1HG   GLU  71          HG2       GLU  71  22.023 -21.377  -5.242
  503   2HG   GLU  71          HG3       GLU  71  21.664 -20.945  -3.592
  504    H    ALA  72           H        ALA  72  18.478 -18.061  -4.671
  505    HA   ALA  72           HA       ALA  72  16.375 -18.460  -6.593
  506   1HB   ALA  72          HB1       ALA  72  16.012 -17.879  -4.183
  507   2HB   ALA  72          HB2       ALA  72  16.744 -16.280  -4.499
  508   3HB   ALA  72          HB3       ALA  72  15.204 -16.741  -5.275
  509    H    LEU  73           H        LEU  73  18.994 -16.069  -6.480
  510    HA   LEU  73           HA       LEU  73  17.838 -14.359  -8.503
  511   1HB   LEU  73          HB2       LEU  73  20.682 -14.965  -7.583
  512   2HB   LEU  73          HB3       LEU  73  20.372 -13.953  -8.956
  513    HG   LEU  73           HG       LEU  73  19.423 -13.413  -6.112
  514   1HD1  LEU  73          HD11      LEU  73  21.864 -13.249  -6.472
  515   2HD1  LEU  73          HD12      LEU  73  21.604 -12.099  -7.794
  516   3HD1  LEU  73          HD13      LEU  73  21.151 -11.664  -6.130
  517   1HD2  LEU  73          HD21      LEU  73  19.199 -11.660  -8.602
  518   2HD2  LEU  73          HD22      LEU  73  17.848 -12.371  -7.688
  519   3HD2  LEU  73          HD23      LEU  73  18.855 -11.147  -6.934
  520    H    GLN  74           H        GLN  74  20.355 -16.955  -8.741
  521    HA   GLN  74           HA       GLN  74  20.296 -16.834 -11.583
  522   1HB   GLN  74          HB2       GLN  74  21.326 -19.202  -9.992
  523   2HB   GLN  74          HB3       GLN  74  21.797 -18.684 -11.612
  524   1HG   GLN  74          HG2       GLN  74  22.615 -16.517 -10.533
  525   2HG   GLN  74          HG3       GLN  74  22.306 -17.292  -8.980
  526   1HE2  GLN  74          HE21      GLN  74  24.524 -16.870 -11.485
  527   2HE2  GLN  74          HE22      GLN  74  25.739 -18.051 -10.976
  528    H    GLU  75           H        GLU  75  18.271 -18.521  -9.438
  529    HA   GLU  75           HA       GLU  75  17.382 -20.606 -11.119
  530   1HB   GLU  75          HB2       GLU  75  16.917 -20.507  -8.720
  531   2HB   GLU  75          HB3       GLU  75  15.884 -19.096  -8.967
  532   1HG   GLU  75          HG2       GLU  75  14.278 -20.455 -10.231
  533   2HG   GLU  75          HG3       GLU  75  15.365 -21.846 -10.167
  534    H    GLN  76           H        GLN  76  16.436 -17.213 -10.948
  535    HA   GLN  76           HA       GLN  76  14.569 -17.619 -13.258
  536   1HB   GLN  76          HB2       GLN  76  13.307 -15.646 -12.152
  537   2HB   GLN  76          HB3       GLN  76  13.099 -17.273 -11.511
  538   1HG   GLN  76          HG2       GLN  76  14.308 -16.861  -9.588
  539   2HG   GLN  76          HG3       GLN  76  15.250 -15.553 -10.306
  540   1HE2  GLN  76          HE22      GLN  76  14.783 -14.581  -8.194
  541   2HE2  GLN  76          HE21      GLN  76  13.402 -13.471  -8.157
  542    H    LYS  77           H        LYS  77  17.160 -15.642 -12.035
  543    HA   LYS  77           HA       LYS  77  17.836 -13.501 -12.498
  544   1HB   LYS  77          HB2       LYS  77  18.131 -14.707 -15.246
  545   2HB   LYS  77          HB3       LYS  77  19.050 -13.368 -14.542
  546   1HG   LYS  77          HG2       LYS  77  19.673 -15.081 -12.686
  547   2HG   LYS  77          HG3       LYS  77  19.088 -16.310 -13.824
  548   1HD   LYS  77          HD2       LYS  77  20.776 -14.945 -15.464
  549   2HD   LYS  77          HD3       LYS  77  21.517 -14.563 -13.894
  550   1HE   LYS  77          HE2       LYS  77  21.426 -17.082 -13.430
  551   2HE   LYS  77          HE3       LYS  77  21.031 -17.301 -15.136
  552   1HZ   LYS  77          HZ1       LYS  77  23.387 -17.530 -14.792
  553   2HZ   LYS  77          HZ2       LYS  77  23.166 -16.151 -15.633
  554   3HZ   LYS  77          HZ3       LYS  77  23.499 -16.098 -14.011
  555    HA   PRO  78           HA       PRO  78  13.739 -12.271 -14.273
  556   1HB   PRO  78          HB2       PRO  78  13.057 -10.313 -12.392
  557   2HB   PRO  78          HB3       PRO  78  12.626 -12.033 -12.345
  558   1HG   PRO  78          HG2       PRO  78  14.880 -10.605 -10.949
  559   2HG   PRO  78          HG3       PRO  78  13.831 -11.898 -10.304
  560   1HD   PRO  78          HD2       PRO  78  16.375 -12.361 -11.211
  561   2HD   PRO  78          HD3       PRO  78  15.065 -13.562 -11.405
  562    H    ASP  79           H        ASP  79  12.858 -10.253 -15.031
  563    HA   ASP  79           HA       ASP  79  14.956  -8.780 -16.427
  564   1HB   ASP  79          HB2       ASP  79  13.047  -9.663 -17.654
  565   2HB   ASP  79          HB3       ASP  79  11.931  -8.701 -16.677
  566    H    LEU  80           H        LEU  80  15.658  -7.917 -14.295
  567    HA   LEU  80           HA       LEU  80  14.159  -5.875 -12.927
  568   1HB   LEU  80          HB2       LEU  80  17.063  -6.694 -12.979
  569   2HB   LEU  80          HB3       LEU  80  16.529  -5.394 -11.989
  570    HG   LEU  80           HG       LEU  80  16.180  -6.642 -10.291
  571   1HD1  LEU  80          HD11      LEU  80  13.881  -6.820 -10.885
  572   2HD1  LEU  80          HD12      LEU  80  14.187  -8.269 -11.885
  573   3HD1  LEU  80          HD13      LEU  80  14.410  -8.310 -10.122
  574   1HD2  LEU  80          HD21      LEU  80  16.761  -8.992 -10.214
  575   2HD2  LEU  80          HD22      LEU  80  16.716  -9.089 -11.986
  576   3HD2  LEU  80          HD23      LEU  80  17.937  -8.083 -11.167
  577    H    SER  81           H        SER  81  14.645  -5.341 -15.916
  578    HA   SER  81           HA       SER  81  16.626  -3.275 -16.155
  579   1HB   SER  81          HB2       SER  81  15.597  -3.028 -18.440
  580   2HB   SER  81          HB3       SER  81  16.152  -4.663 -18.056
  581    HG   SER  81           HG       SER  81  14.213  -5.393 -18.149
  582    H    ALA  82           H        ALA  82  13.723  -3.287 -14.607
  583    HA   ALA  82           HA       ALA  82  13.137  -0.402 -15.124
  584   1HB   ALA  82          HB1       ALA  82  11.194  -2.629 -14.391
  585   2HB   ALA  82          HB2       ALA  82  10.785  -0.915 -14.615
  586   3HB   ALA  82          HB3       ALA  82  11.354  -1.875 -15.994
  587    H    VAL  83           H        VAL  83  14.777  -2.236 -13.004
  588    HA   VAL  83           HA       VAL  83  13.993  -0.437 -10.791
  589    HB   VAL  83           HB       VAL  83  12.853  -2.410 -10.243
  590   1HG1  VAL  83          HG11      VAL  83  13.948  -4.060 -11.679
  591   2HG1  VAL  83          HG12      VAL  83  15.402  -4.000 -10.662
  592   3HG1  VAL  83          HG13      VAL  83  13.878  -4.642 -10.012
  593   1HG2  VAL  83          HG21      VAL  83  14.231  -1.432  -8.322
  594   2HG2  VAL  83          HG22      VAL  83  13.659  -3.084  -8.163
  595   3HG2  VAL  83          HG23      VAL  83  15.355  -2.772  -8.569
  596    H    ARG  84           H        ARG  84  15.634  -0.109  -9.167
  597    HA   ARG  84           HA       ARG  84  18.384  -0.769 -10.037
  598   1HB   ARG  84          HB2       ARG  84  19.186   1.301  -9.232
  599   2HB   ARG  84          HB3       ARG  84  17.937   1.649 -10.433
  600   1HG   ARG  84          HG2       ARG  84  16.358   2.166  -8.542
  601   2HG   ARG  84          HG3       ARG  84  17.677   1.837  -7.401
  602   1HD   ARG  84          HD2       ARG  84  18.930   3.601  -9.065
  603   2HD   ARG  84          HD3       ARG  84  17.279   4.176  -9.237
  604    HE   ARG  84           HE       ARG  84  18.941   3.931  -6.752
  605   1HH1  ARG  84          HH11      ARG  84  16.192   5.471  -8.426
  606   2HH1  ARG  84          HH12      ARG  84  15.817   6.575  -7.165
  607   1HH2  ARG  84          HH21      ARG  84  18.448   5.462  -5.040
  608   2HH2  ARG  84          HH22      ARG  84  17.127   6.547  -5.186
  609    H    PHE  85           H        PHE  85  19.763  -1.239  -8.268
  610    HA   PHE  85           HA       PHE  85  18.290  -1.885  -5.756
  611   1HB   PHE  85          HB2       PHE  85  19.313  -3.872  -5.443
  612   2HB   PHE  85          HB3       PHE  85  18.885  -3.903  -7.135
  613    HD1  PHE  85           HD1      PHE  85  20.776  -3.334  -8.852
  614    HD2  PHE  85           HD2      PHE  85  21.542  -4.307  -4.724
  615    HE1  PHE  85           HE1      PHE  85  23.041  -4.058  -9.449
  616    HE2  PHE  85           HE2      PHE  85  23.845  -5.002  -5.324
  617    HZ   PHE  85           HZ       PHE  85  24.601  -4.906  -7.688
  618    H    GLY  86           H        GLY  86  19.789  -2.010  -3.860
  619   1HA   GLY  86          HA2       GLY  86  22.375  -0.588  -4.151
  620   2HA   GLY  86          HA3       GLY  86  21.216  -0.006  -2.940
  621    H    ALA  87           H        ALA  87  23.838  -1.972  -3.318
  622    HA   ALA  87           HA       ALA  87  23.101  -4.139  -1.483
  623   1HB   ALA  87          HB1       ALA  87  25.753  -3.166  -2.656
  624   2HB   ALA  87          HB2       ALA  87  25.557  -4.608  -1.657
  625   3HB   ALA  87          HB3       ALA  87  24.781  -4.535  -3.238
  626    H    ILE  88           H        ILE  88  23.436  -4.085   0.731
  627    HA   ILE  88           HA       ILE  88  24.637  -1.653   1.964
  628    HB   ILE  88           HB       ILE  88  22.024  -3.084   2.628
  629   1HG1  ILE  88          HG12      ILE  88  22.526  -0.428   1.273
  630   2HG1  ILE  88          HG13      ILE  88  21.612  -1.803   0.676
  631   1HG2  ILE  88          HG21      ILE  88  23.061  -0.553   3.916
  632   2HG2  ILE  88          HG22      ILE  88  21.666  -1.539   4.386
  633   3HG2  ILE  88          HG23      ILE  88  23.273  -2.170   4.636
  634   1HD1  ILE  88          HD11      ILE  88  19.865  -1.409   2.388
  635   2HD1  ILE  88          HD12      ILE  88  20.757   0.034   2.946
  636   3HD1  ILE  88          HD13      ILE  88  20.114  -0.021   1.313
  637    H    GLY  89           H        GLY  89  26.084  -2.181   3.564
  638   1HA   GLY  89          HA2       GLY  89  27.081  -3.360   5.303
  639   2HA   GLY  89          HA3       GLY  89  25.789  -4.564   5.241
  640    H    ILE  90           H        ILE  90  26.173  -5.012   2.362
  641    HA   ILE  90           HA       ILE  90  28.073  -7.038   2.054
  642    HB   ILE  90           HB       ILE  90  26.689  -5.132   0.154
  643   1HG1  ILE  90          HG12      ILE  90  26.063  -7.880   1.222
  644   2HG1  ILE  90          HG13      ILE  90  25.101  -6.429   1.356
  645   1HG2  ILE  90          HG21      ILE  90  28.664  -6.108  -1.038
  646   2HG2  ILE  90          HG22      ILE  90  27.983  -7.730  -0.717
  647   3HG2  ILE  90          HG23      ILE  90  27.130  -6.561  -1.731
  648   1HD1  ILE  90          HD11      ILE  90  24.556  -6.549  -1.068
  649   2HD1  ILE  90          HD12      ILE  90  25.448  -8.091  -1.160
  650   3HD1  ILE  90          HD13      ILE  90  24.015  -7.951  -0.143
  651    H    GLY  91           H        GLY  91  30.109  -7.018   0.851
  652   1HA   GLY  91          HA2       GLY  91  31.602  -4.468   0.730
  653   2HA   GLY  91          HA3       GLY  91  32.131  -5.647   1.937
  654    H    SER  92           H        SER  92  30.750  -6.896  -1.030
  655    HA   SER  92           HA       SER  92  33.267  -8.051  -1.897
  656   1HB   SER  92          HB2       SER  92  31.553  -8.693  -3.819
  657   2HB   SER  92          HB3       SER  92  31.557  -9.510  -2.244
  658    HG   SER  92           HG       SER  92  29.777  -7.575  -3.264
  659    H    ARG  93           H        ARG  93  31.678  -5.030  -2.407
  660    HA   ARG  93           HA       ARG  93  32.622  -4.411  -5.015
  661   1HB   ARG  93          HB2       ARG  93  31.063  -3.069  -3.217
  662   2HB   ARG  93          HB3       ARG  93  32.600  -2.301  -2.860
  663   1HG   ARG  93          HG2       ARG  93  31.853  -0.872  -4.490
  664   2HG   ARG  93          HG3       ARG  93  32.696  -2.010  -5.530
  665   1HD   ARG  93          HD2       ARG  93  29.716  -1.717  -5.024
  666   2HD   ARG  93          HD3       ARG  93  30.562  -1.566  -6.552
  667    HE   ARG  93           HE       ARG  93  29.589  -3.981  -5.216
  668   1HH1  ARG  93          HH11      ARG  93  31.598  -2.779  -7.914
  669   2HH1  ARG  93          HH12      ARG  93  31.803  -4.346  -8.610
  670   1HH2  ARG  93          HH21      ARG  93  30.086  -6.015  -5.994
  671   2HH2  ARG  93          HH22      ARG  93  30.787  -6.235  -7.586
  672    H    GLU  94           H        GLU  94  34.564  -3.444  -5.685
  673    HA   GLU  94           HA       GLU  94  36.842  -4.661  -4.818
  674   1HB   GLU  94          HB2       GLU  94  36.548  -2.048  -6.286
  675   2HB   GLU  94          HB3       GLU  94  38.054  -2.953  -6.207
  676   1HG   GLU  94          HG2       GLU  94  35.465  -3.992  -7.444
  677   2HG   GLU  94          HG3       GLU  94  36.800  -3.279  -8.334
  678    H    TYR  95           H        TYR  95  35.546  -1.697  -3.474
  679    HA   TYR  95           HA       TYR  95  38.003  -0.742  -2.366
  680   1HB   TYR  95          HB2       TYR  95  35.994   0.646  -2.919
  681   2HB   TYR  95          HB3       TYR  95  35.113  -0.130  -1.610
  682    HD1  TYR  95           HD1      TYR  95  35.177   0.826   0.573
  683    HD2  TYR  95           HD2      TYR  95  38.174   1.936  -2.330
  684    HE1  TYR  95           HE1      TYR  95  36.020   2.570   2.117
  685    HE2  TYR  95           HE2      TYR  95  39.026   3.679  -0.794
  686    HH   TYR  95           HH       TYR  95  38.791   4.709   1.284
  687    H    ASP  96           H        ASP  96  35.899  -3.317  -1.281
  688    HA   ASP  96           HA       ASP  96  37.098  -3.147   1.446
  689   1HB   ASP  96          HB2       ASP  96  34.795  -2.187   1.314
  690   2HB   ASP  96          HB3       ASP  96  34.200  -3.760   0.797
  691    H    THR  97           H        THR  97  37.666  -4.852  -0.978
  692    HA   THR  97           HA       THR  97  36.947  -7.560  -0.317
  693    HB   THR  97           HB       THR  97  38.712  -8.025  -2.101
  694    HG1  THR  97           HG1      THR  97  39.942  -6.132  -1.767
  695   1HG2  THR  97          HG21      THR  97  36.646  -5.917  -2.861
  696   2HG2  THR  97          HG22      THR  97  37.383  -7.121  -3.937
  697   3HG2  THR  97          HG23      THR  97  36.282  -7.645  -2.649
  698    H    PHE  98           H        PHE  98  37.554  -8.017   1.847
  699    HA   PHE  98           HA       PHE  98  40.506  -8.160   2.334
  700   1HB   PHE  98          HB2       PHE  98  38.330  -7.182   4.201
  701   2HB   PHE  98          HB3       PHE  98  39.959  -7.581   4.722
  702    HD1  PHE  98           HD1      PHE  98  41.944  -6.396   3.451
  703    HD2  PHE  98           HD2      PHE  98  37.893  -4.921   3.563
  704    HE1  PHE  98           HE1      PHE  98  42.755  -4.116   2.900
  705    HE2  PHE  98           HE2      PHE  98  38.710  -2.641   3.031
  706    HZ   PHE  98           HZ       PHE  98  41.139  -2.234   2.687
  707    H    CYS  99           H        CYS  99  37.442  -9.823   2.530
  708    HA   CYS  99           HA       CYS  99  38.881 -12.182   3.656
  709   1HB   CYS  99          HB2       CYS  99  35.934 -11.412   3.893
  710   2HB   CYS  99          HB3       CYS  99  36.632 -12.947   4.440
  711    HG   CYS  99           HG       CYS  99  38.382 -11.924   6.085
  712    H    GLY 100           H        GLY 100  38.579 -11.102   0.855
  713   1HA   GLY 100          HA2       GLY 100  38.689 -13.313  -0.686
  714   2HA   GLY 100          HA3       GLY 100  36.945 -13.006  -0.615
  715    H    ALA 101           H        ALA 101  37.673 -12.731  -3.053
  716    HA   ALA 101           HA       ALA 101  37.775  -9.843  -3.598
  717   1HB   ALA 101          HB1       ALA 101  39.755 -11.820  -4.825
  718   2HB   ALA 101          HB2       ALA 101  39.592 -10.100  -5.244
  719   3HB   ALA 101          HB3       ALA 101  40.150 -10.563  -3.629
  720    H    ILE 102           H        ILE 102  35.544 -11.545  -3.684
  721    HA   ILE 102           HA       ILE 102  35.020 -11.763  -6.602
  722    HB   ILE 102           HB       ILE 102  33.648 -13.750  -6.179
  723   1HG1  ILE 102          HG12      ILE 102  34.906 -13.882  -3.406
  724   2HG1  ILE 102          HG13      ILE 102  33.248 -13.366  -3.719
  725   1HG2  ILE 102          HG21      ILE 102  36.016 -13.901  -6.979
  726   2HG2  ILE 102          HG22      ILE 102  36.531 -14.206  -5.307
  727   3HG2  ILE 102          HG23      ILE 102  35.463 -15.351  -6.140
  728   1HD1  ILE 102          HD11      ILE 102  32.766 -15.600  -4.735
  729   2HD1  ILE 102          HD12      ILE 102  34.396 -16.131  -4.248
  730   3HD1  ILE 102          HD13      ILE 102  33.213 -15.659  -3.019
  731    H    ASP 103           H        ASP 103  32.776 -11.494  -7.157
  732    HA   ASP 103           HA       ASP 103  31.058 -10.176  -5.158
  733   1HB   ASP 103          HB2       ASP 103  30.969  -8.137  -6.235
  734   2HB   ASP 103          HB3       ASP 103  32.684  -8.502  -6.255
  735    H    LYS 104           H        LYS 104  30.917 -12.680  -6.697
  736    HA   LYS 104           HA       LYS 104  29.398 -12.581  -9.007
  737   1HB   LYS 104          HB2       LYS 104  29.294 -14.688  -6.813
  738   2HB   LYS 104          HB3       LYS 104  28.678 -14.883  -8.456
  739   1HG   LYS 104          HG2       LYS 104  30.950 -14.519  -9.329
  740   2HG   LYS 104          HG3       LYS 104  31.584 -14.381  -7.681
  741   1HD   LYS 104          HD2       LYS 104  30.805 -16.690  -7.191
  742   2HD   LYS 104          HD3       LYS 104  30.196 -16.832  -8.856
  743   1HE   LYS 104          HE2       LYS 104  32.500 -16.440  -9.720
  744   2HE   LYS 104          HE3       LYS 104  33.103 -16.323  -8.062
  745   1HZ   LYS 104          HZ1       LYS 104  33.453 -18.525  -8.979
  746   2HZ   LYS 104          HZ2       LYS 104  32.420 -18.632  -7.725
  747   3HZ   LYS 104          HZ3       LYS 104  31.864 -18.735  -9.259
  748    H    LEU 105           H        LEU 105  28.181 -12.287  -5.680
  749    HA   LEU 105           HA       LEU 105  25.431 -12.691  -6.238
  750   1HB   LEU 105          HB2       LEU 105  26.537 -12.681  -4.000
  751   2HB   LEU 105          HB3       LEU 105  26.778 -10.948  -4.113
  752    HG   LEU 105           HG       LEU 105  24.973 -11.610  -2.661
  753   1HD1  LEU 105          HD11      LEU 105  24.834  -9.388  -3.826
  754   2HD1  LEU 105          HD12      LEU 105  23.672 -10.125  -4.958
  755   3HD1  LEU 105          HD13      LEU 105  23.295 -10.035  -3.237
  756   1HD2  LEU 105          HD21      LEU 105  24.212 -13.633  -3.832
  757   2HD2  LEU 105          HD22      LEU 105  22.868 -12.551  -3.437
  758   3HD2  LEU 105          HD23      LEU 105  23.488 -12.615  -5.099
  759    H    GLU 106           H        GLU 106  27.261  -9.602  -5.887
  760    HA   GLU 106           HA       GLU 106  25.135  -7.901  -6.762
  761   1HB   GLU 106          HB2       GLU 106  28.164  -7.501  -6.861
  762   2HB   GLU 106          HB3       GLU 106  26.961  -6.230  -7.072
  763   1HG   GLU 106          HG2       GLU 106  26.160  -6.510  -4.806
  764   2HG   GLU 106          HG3       GLU 106  27.220  -7.890  -4.525
  765    H    ALA 107           H        ALA 107  27.758  -9.614  -8.427
  766    HA   ALA 107           HA       ALA 107  27.514  -8.350 -10.948
  767   1HB   ALA 107          HB1       ALA 107  28.746 -10.242 -11.847
  768   2HB   ALA 107          HB2       ALA 107  29.436  -9.797 -10.273
  769   3HB   ALA 107          HB3       ALA 107  28.376 -11.223 -10.424
  770    H    GLU 108           H        GLU 108  25.899 -11.400  -9.719
  771    HA   GLU 108           HA       GLU 108  24.473 -11.867 -12.141
  772   1HB   GLU 108          HB2       GLU 108  24.066 -12.715  -9.274
  773   2HB   GLU 108          HB3       GLU 108  22.978 -13.198 -10.562
  774   1HG   GLU 108          HG2       GLU 108  25.953 -13.834 -10.464
  775   2HG   GLU 108          HG3       GLU 108  24.626 -14.928 -10.083
  776    H    LEU 109           H        LEU 109  23.651  -9.818  -9.295
  777    HA   LEU 109           HA       LEU 109  20.968  -9.237 -10.128
  778   1HB   LEU 109          HB2       LEU 109  23.042  -7.870  -8.394
  779   2HB   LEU 109          HB3       LEU 109  21.614  -6.961  -8.861
  780    HG   LEU 109           HG       LEU 109  21.440  -9.685  -7.538
  781   1HD1  LEU 109          HD11      LEU 109  21.341  -6.950  -6.201
  782   2HD1  LEU 109          HD12      LEU 109  21.067  -8.516  -5.409
  783   3HD1  LEU 109          HD13      LEU 109  22.666  -8.123  -6.055
  784   1HD2  LEU 109          HD21      LEU 109  19.152  -8.836  -6.904
  785   2HD2  LEU 109          HD22      LEU 109  19.447  -7.386  -7.878
  786   3HD2  LEU 109          HD23      LEU 109  19.356  -8.982  -8.653
  787    H    LYS 110           H        LYS 110  24.081  -7.586 -10.838
  788    HA   LYS 110           HA       LYS 110  22.941  -5.506 -12.409
  789   1HB   LYS 110          HB2       LYS 110  25.756  -6.669 -12.267
  790   2HB   LYS 110          HB3       LYS 110  25.344  -5.157 -13.094
  791   1HG   LYS 110          HG2       LYS 110  24.636  -4.110 -11.058
  792   2HG   LYS 110          HG3       LYS 110  24.614  -5.598 -10.174
  793   1HD   LYS 110          HD2       LYS 110  26.490  -4.797  -9.299
  794   2HD   LYS 110          HD3       LYS 110  27.215  -5.671 -10.645
  795   1HE   LYS 110          HE2       LYS 110  27.511  -3.631 -11.915
  796   2HE   LYS 110          HE3       LYS 110  26.417  -2.736 -10.853
  797   1HZ   LYS 110          HZ1       LYS 110  29.070  -3.770 -10.055
  798   2HZ   LYS 110          HZ2       LYS 110  28.697  -2.207 -10.336
  799   3HZ   LYS 110          HZ3       LYS 110  28.023  -2.983  -9.054
  800    H    ASN 111           H        ASN 111  24.179  -8.709 -13.195
  801    HA   ASN 111           HA       ASN 111  23.911  -8.531 -16.050
  802   1HB   ASN 111          HB2       ASN 111  25.256 -10.254 -15.567
  803   2HB   ASN 111          HB3       ASN 111  24.607 -10.519 -13.983
  804   1HD2  ASN 111          HD21      ASN 111  22.698 -11.784 -13.629
  805   2HD2  ASN 111          HD22      ASN 111  22.409 -13.100 -14.726
  806    H    SER 112           H        SER 112  21.685  -9.494 -13.414
  807    HA   SER 112           HA       SER 112  19.685 -10.576 -15.153
  808   1HB   SER 112          HB2       SER 112  19.404  -9.485 -12.352
  809   2HB   SER 112          HB3       SER 112  18.190 -10.438 -13.222
  810    HG   SER 112           HG       SER 112  20.772 -11.222 -12.363
  811    H    GLY 113           H        GLY 113  20.315  -7.310 -13.809
  812   1HA   GLY 113          HA2       GLY 113  19.677  -5.862 -15.946
  813   2HA   GLY 113          HA3       GLY 113  18.051  -6.150 -15.328
  814    H    ALA 114           H        ALA 114  19.244  -5.989 -12.398
  815    HA   ALA 114           HA       ALA 114  18.315  -3.288 -12.211
  816   1HB   ALA 114          HB1       ALA 114  18.715  -3.479  -9.803
  817   2HB   ALA 114          HB2       ALA 114  17.812  -4.871 -10.375
  818   3HB   ALA 114          HB3       ALA 114  19.550  -5.041 -10.042
  819    H    LYS 115           H        LYS 115  19.490  -1.385 -11.780
  820    HA   LYS 115           HA       LYS 115  22.411  -1.597 -12.316
  821   1HB   LYS 115          HB2       LYS 115  22.386   0.843 -12.523
  822   2HB   LYS 115          HB3       LYS 115  21.312   0.045 -13.672
  823   1HG   LYS 115          HG2       LYS 115  19.347   0.647 -12.267
  824   2HG   LYS 115          HG3       LYS 115  20.438   1.391 -11.092
  825   1HD   LYS 115          HD2       LYS 115  19.440   3.124 -12.417
  826   2HD   LYS 115          HD3       LYS 115  21.165   3.038 -12.800
  827   1HE   LYS 115          HE2       LYS 115  20.639   1.739 -14.859
  828   2HE   LYS 115          HE3       LYS 115  18.920   1.780 -14.452
  829   1HZ   LYS 115          HZ1       LYS 115  18.993   4.196 -14.686
  830   2HZ   LYS 115          HZ2       LYS 115  20.586   4.157 -15.056
  831   3HZ   LYS 115          HZ3       LYS 115  19.496   3.484 -16.060
  832    H    GLN 116           H        GLN 116  23.921  -0.987 -10.729
  833    HA   GLN 116           HA       GLN 116  22.917  -1.086  -7.962
  834   1HB   GLN 116          HB2       GLN 116  24.896  -2.402  -8.679
  835   2HB   GLN 116          HB3       GLN 116  25.752  -0.896  -9.012
  836   1HG   GLN 116          HG2       GLN 116  25.708  -0.254  -6.682
  837   2HG   GLN 116          HG3       GLN 116  24.520  -1.505  -6.305
  838   1HE2  GLN 116          HE22      GLN 116  26.202  -1.897  -4.561
  839   2HE2  GLN 116          HE21      GLN 116  27.335  -3.163  -4.899
  840    H    THR 117           H        THR 117  22.198   0.834  -7.109
  841    HA   THR 117           HA       THR 117  22.950   3.365  -8.320
  842    HB   THR 117           HB       THR 117  21.600   3.124  -5.607
  843    HG1  THR 117           HG1      THR 117  20.503   1.688  -6.879
  844   1HG2  THR 117          HG21      THR 117  20.481   5.164  -6.381
  845   2HG2  THR 117          HG22      THR 117  22.219   5.364  -6.475
  846   3HG2  THR 117          HG23      THR 117  21.287   5.033  -7.957
  847    H    GLY 118           H        GLY 118  24.371   4.937  -7.478
  848   1HA   GLY 118          HA2       GLY 118  26.057   5.865  -6.251
  849   2HA   GLY 118          HA3       GLY 118  25.306   5.087  -4.860
  850    H    GLU 119           H        GLU 119  26.576   3.770  -3.779
  851    HA   GLU 119           HA       GLU 119  28.164   1.733  -5.039
  852   1HB   GLU 119          HB2       GLU 119  30.269   2.210  -3.956
  853   2HB   GLU 119          HB3       GLU 119  29.822   3.594  -4.948
  854   1HG   GLU 119          HG2       GLU 119  28.964   4.740  -2.854
  855   2HG   GLU 119          HG3       GLU 119  29.594   3.381  -1.921
  856    H    THR 120           H        THR 120  28.742   0.086  -3.359
  857    HA   THR 120           HA       THR 120  26.654  -0.644  -1.841
  858    HB   THR 120           HB       THR 120  29.579  -1.313  -1.364
  859    HG1  THR 120           HG1      THR 120  28.769  -3.077  -2.844
  860   1HG2  THR 120          HG21      THR 120  28.633  -3.529  -0.694
  861   2HG2  THR 120          HG22      THR 120  28.200  -2.222   0.427
  862   3HG2  THR 120          HG23      THR 120  27.004  -2.818  -0.729
  863    H    LEU 121           H        LEU 121  25.794  -0.183   0.096
  864    HA   LEU 121           HA       LEU 121  26.693   2.191   1.517
  865   1HB   LEU 121          HB2       LEU 121  24.267   1.079   0.829
  866   2HB   LEU 121          HB3       LEU 121  24.405   0.509   2.485
  867    HG   LEU 121           HG       LEU 121  24.583   3.401   1.597
  868   1HD1  LEU 121          HD11      LEU 121  22.339   3.724   2.381
  869   2HD1  LEU 121          HD12      LEU 121  22.357   2.472   1.135
  870   3HD1  LEU 121          HD13      LEU 121  22.204   2.009   2.849
  871   1HD2  LEU 121          HD21      LEU 121  24.345   2.152   4.358
  872   2HD2  LEU 121          HD22      LEU 121  25.649   3.201   3.751
  873   3HD2  LEU 121          HD23      LEU 121  24.043   3.861   4.041
  874    H    LYS 122           H        LYS 122  27.281   2.176   3.783
  875    HA   LYS 122           HA       LYS 122  27.823  -0.476   5.029
  876   1HB   LYS 122          HB2       LYS 122  29.369   2.117   5.391
  877   2HB   LYS 122          HB3       LYS 122  29.597   0.651   6.339
  878   1HG   LYS 122          HG2       LYS 122  30.030  -0.460   3.977
  879   2HG   LYS 122          HG3       LYS 122  30.344   1.198   3.458
  880   1HD   LYS 122          HD2       LYS 122  31.741  -0.384   5.642
  881   2HD   LYS 122          HD3       LYS 122  32.440   0.100   4.104
  882   1HE   LYS 122          HE2       LYS 122  32.706   2.341   4.761
  883   2HE   LYS 122          HE3       LYS 122  31.454   2.243   6.001
  884   1HZ   LYS 122          HZ1       LYS 122  34.079   0.898   6.214
  885   2HZ   LYS 122          HZ2       LYS 122  33.678   2.287   6.963
  886   3HZ   LYS 122          HZ3       LYS 122  32.896   0.904   7.360
  887    H    ILE 123           H        ILE 123  27.036  -0.634   7.146
  888    HA   ILE 123           HA       ILE 123  25.354   1.626   8.076
  889    HB   ILE 123           HB       ILE 123  23.575  -0.122   8.526
  890   1HG1  ILE 123          HG12      ILE 123  23.519  -2.073   6.973
  891   2HG1  ILE 123          HG13      ILE 123  25.205  -1.848   6.582
  892   1HG2  ILE 123          HG21      ILE 123  24.299   0.257   5.607
  893   2HG2  ILE 123          HG22      ILE 123  22.681   0.056   6.320
  894   3HG2  ILE 123          HG23      ILE 123  23.604   1.526   6.624
  895   1HD1  ILE 123          HD11      ILE 123  24.179  -2.425   9.394
  896   2HD1  ILE 123          HD12      ILE 123  24.682  -3.668   8.229
  897   3HD1  ILE 123          HD13      ILE 123  25.861  -2.499   8.825
  898    H    ASN 124           H        ASN 124  24.538   1.541  10.068
  899    HA   ASN 124           HA       ASN 124  24.417   1.555  12.209
  900   1HB   ASN 124          HB2       ASN 124  23.727  -0.356  13.030
  901   2HB   ASN 124          HB3       ASN 124  24.163  -1.093  11.500
  902   1HD2  ASN 124          HD22      ASN 124  26.642  -1.804  11.405
  903   2HD2  ASN 124          HD21      ASN 124  27.141  -2.672  12.880
  904    H    ILE 125           H        ILE 125  25.335   1.608  14.303
  905    HA   ILE 125           HA       ILE 125  28.259   1.397  14.551
  906    HB   ILE 125           HB       ILE 125  28.278   3.702  15.650
  907   1HG1  ILE 125          HG12      ILE 125  26.712   5.402  14.861
  908   2HG1  ILE 125          HG13      ILE 125  25.731   4.199  14.037
  909   1HG2  ILE 125          HG21      ILE 125  29.260   3.185  13.422
  910   2HG2  ILE 125          HG22      ILE 125  27.747   3.724  12.664
  911   3HG2  ILE 125          HG23      ILE 125  28.723   4.860  13.614
  912   1HD1  ILE 125          HD11      ILE 125  25.041   3.241  16.193
  913   2HD1  ILE 125          HD12      ILE 125  26.160   4.330  17.055
  914   3HD1  ILE 125          HD13      ILE 125  24.760   4.985  16.185
  915    H    LEU 126           H        LEU 126  25.740  -0.020  15.612
  916    HA   LEU 126           HA       LEU 126  25.306   0.833  18.320
  917   1HB   LEU 126          HB2       LEU 126  23.661  -0.460  16.990
  918   2HB   LEU 126          HB3       LEU 126  24.778  -1.826  16.928
  919    HG   LEU 126           HG       LEU 126  24.609  -2.107  19.385
  920   1HD1  LEU 126          HD11      LEU 126  22.817  -0.906  20.635
  921   2HD1  LEU 126          HD12      LEU 126  24.095   0.188  20.111
  922   3HD1  LEU 126          HD13      LEU 126  22.552   0.147  19.228
  923   1HD2  LEU 126          HD21      LEU 126  23.101  -3.335  17.871
  924   2HD2  LEU 126          HD22      LEU 126  22.321  -2.977  19.419
  925   3HD2  LEU 126          HD23      LEU 126  21.911  -2.022  17.980
  926    H    ASP 127           H        ASP 127  27.513  -1.447  16.754
  927    HA   ASP 127           HA       ASP 127  29.320  -1.430  19.004
  928   1HB   ASP 127          HB2       ASP 127  27.766  -3.330  19.583
  929   2HB   ASP 127          HB3       ASP 127  28.169  -4.087  18.043
  930    H    HIS 128           H        HIS 128  31.254  -2.912  18.196
  931    HA   HIS 128           HA       HIS 128  32.242  -2.081  15.668
  932   1HB   HIS 128          HB2       HIS 128  33.023  -4.516  17.333
  933   2HB   HIS 128          HB3       HIS 128  34.015  -3.703  16.132
  934    HD1  HIS 128           HD1      HIS 128  32.524  -2.991  19.674
  935    HD2  HIS 128           HD2      HIS 128  35.531  -1.720  16.993
  936    HE1  HIS 128           HE1      HIS 128  34.014  -1.381  20.967
  937    H    ASP 129           H        ASP 129  32.297  -3.221  13.673
  938    HA   ASP 129           HA       ASP 129  31.232  -5.878  13.368
  939   1HB   ASP 129          HB2       ASP 129  29.659  -3.601  12.063
  940   2HB   ASP 129          HB3       ASP 129  29.507  -5.276  11.636
  941    H    ILE 130           H        ILE 130  30.834  -5.746  10.620
  942    HA   ILE 130           HA       ILE 130  33.543  -5.324   9.554
  943    HB   ILE 130           HB       ILE 130  31.005  -6.577   8.486
  944   1HG1  ILE 130          HG12      ILE 130  33.808  -7.626   8.850
  945   2HG1  ILE 130          HG13      ILE 130  32.504  -7.841  10.014
  946   1HG2  ILE 130          HG21      ILE 130  33.520  -6.041   6.867
  947   2HG2  ILE 130          HG22      ILE 130  32.109  -6.993   6.343
  948   3HG2  ILE 130          HG23      ILE 130  31.946  -5.272   6.587
  949   1HD1  ILE 130          HD11      ILE 130  32.633  -9.017   7.214
  950   2HD1  ILE 130          HD12      ILE 130  32.689  -9.866   8.761
  951   3HD1  ILE 130          HD13      ILE 130  31.186  -9.067   8.255
  952    HA   PRO 131           HA       PRO 131  31.387  -1.984   7.043
  953   1HB   PRO 131          HB2       PRO 131  28.801  -1.159   7.505
  954   2HB   PRO 131          HB3       PRO 131  29.247  -2.483   6.384
  955   1HG   PRO 131          HG2       PRO 131  28.334  -2.697   9.279
  956   2HG   PRO 131          HG3       PRO 131  27.748  -3.615   7.867
  957   1HD   PRO 131          HD2       PRO 131  29.581  -4.668   9.507
  958   2HD   PRO 131          HD3       PRO 131  29.731  -4.881   7.741
  959    H    GLU 132           H        GLU 132  29.705  -1.775  10.154
  960    HA   GLU 132           HA       GLU 132  29.536  -0.178  11.733
  961   1HB   GLU 132          HB2       GLU 132  31.607   0.071  13.025
  962   2HB   GLU 132          HB3       GLU 132  31.177  -1.577  12.590
  963   1HG   GLU 132          HG2       GLU 132  32.900  -1.685  10.897
  964   2HG   GLU 132          HG3       GLU 132  33.255   0.030  11.053
  965    H    ASP 133           H        ASP 133  28.797   1.402   9.945
  966    HA   ASP 133           HA       ASP 133  30.206   3.936  10.366
  967   1HB   ASP 133          HB2       ASP 133  31.271   2.910   8.326
  968   2HB   ASP 133          HB3       ASP 133  29.685   2.882   7.559
  969    HA   PRO 134           HA       PRO 134  25.873   4.809  10.605
  970   1HB   PRO 134          HB2       PRO 134  25.766   7.559  10.517
  971   2HB   PRO 134          HB3       PRO 134  26.355   6.618  11.920
  972   1HG   PRO 134          HG2       PRO 134  27.993   7.917   9.727
  973   2HG   PRO 134          HG3       PRO 134  28.260   7.979  11.498
  974   1HD   PRO 134          HD2       PRO 134  29.613   6.248   9.901
  975   2HD   PRO 134          HD3       PRO 134  29.099   5.772  11.539
  976    H    ALA 135           H        ALA 135  24.228   4.726   9.195
  977    HA   ALA 135           HA       ALA 135  24.774   4.606   6.434
  978   1HB   ALA 135          HB1       ALA 135  23.010   3.323   7.739
  979   2HB   ALA 135          HB2       ALA 135  22.036   4.804   7.777
  980   3HB   ALA 135          HB3       ALA 135  22.421   4.040   6.222
  981    H    GLU 136           H        GLU 136  23.576   7.297   8.353
  982    HA   GLU 136           HA       GLU 136  21.895   8.535   6.555
  983   1HB   GLU 136          HB2       GLU 136  22.086  10.519   7.910
  984   2HB   GLU 136          HB3       GLU 136  22.031   9.077   8.921
  985   1HG   GLU 136          HG2       GLU 136  24.528   9.212   9.192
  986   2HG   GLU 136          HG3       GLU 136  24.526  10.703   8.249
  987    H    GLU 137           H        GLU 137  25.460   8.820   6.559
  988    HA   GLU 137           HA       GLU 137  25.466  11.120   4.782
  989   1HB   GLU 137          HB2       GLU 137  27.630   9.067   5.442
  990   2HB   GLU 137          HB3       GLU 137  27.871  10.522   4.461
  991   1HG   GLU 137          HG2       GLU 137  27.069  11.905   6.417
  992   2HG   GLU 137          HG3       GLU 137  27.044  10.437   7.395
  993    H    TRP 138           H        TRP 138  25.640   7.571   4.286
  994    HA   TRP 138           HA       TRP 138  25.926   7.724   1.428
  995   1HB   TRP 138          HB2       TRP 138  25.497   5.613   3.423
  996   2HB   TRP 138          HB3       TRP 138  24.491   5.433   2.019
  997    HD1  TRP 138           HD1      TRP 138  25.645   4.991  -0.326
  998    HE1  TRP 138           HE1      TRP 138  27.813   3.800  -0.918
  999    HE3  TRP 138           HE3      TRP 138  28.019   5.415   4.186
 1000    HZ2  TRP 138           HZ2      TRP 138  30.398   3.302   0.354
 1001    HZ3  TRP 138           HZ3      TRP 138  30.333   4.571   4.467
 1002    HH2  TRP 138           HH2      TRP 138  31.535   3.526   2.557
 1003    H    LEU 139           H        LEU 139  23.106   7.382   3.647
 1004    HA   LEU 139           HA       LEU 139  21.121   7.190   1.658
 1005   1HB   LEU 139          HB2       LEU 139  21.197   7.407   4.495
 1006   2HB   LEU 139          HB3       LEU 139  20.267   8.794   3.981
 1007    HG   LEU 139           HG       LEU 139  18.800   7.239   2.608
 1008   1HD1  LEU 139          HD11      LEU 139  18.828   4.818   3.272
 1009   2HD1  LEU 139          HD12      LEU 139  20.289   5.283   2.399
 1010   3HD1  LEU 139          HD13      LEU 139  20.337   5.097   4.163
 1011   1HD2  LEU 139          HD21      LEU 139  18.124   8.091   4.820
 1012   2HD2  LEU 139          HD22      LEU 139  17.545   6.437   4.584
 1013   3HD2  LEU 139          HD23      LEU 139  18.963   6.738   5.614
 1014    H    GLY 140           H        GLY 140  22.407  10.123   3.267
 1015   1HA   GLY 140          HA2       GLY 140  20.903  12.052   1.863
 1016   2HA   GLY 140          HA3       GLY 140  22.514  12.299   2.568
 1017    H    SER 141           H        SER 141  24.183  10.701   1.056
 1018    HA   SER 141           HA       SER 141  24.502  12.237  -1.296
 1019   1HB   SER 141          HB2       SER 141  26.253  10.978   0.043
 1020   2HB   SER 141          HB3       SER 141  25.678   9.481  -0.713
 1021    HG   SER 141           HG       SER 141  27.483  10.443  -1.786
 1022    H    TRP 142           H        TRP 142  23.149   8.949  -0.822
 1023    HA   TRP 142           HA       TRP 142  22.677   8.293  -3.539
 1024   1HB   TRP 142          HB2       TRP 142  22.864   6.708  -1.728
 1025   2HB   TRP 142          HB3       TRP 142  21.496   7.421  -0.906
 1026    HD1  TRP 142           HD1      TRP 142  22.271   5.149  -3.903
 1027    HE1  TRP 142           HE1      TRP 142  20.216   3.664  -4.325
 1028    HE3  TRP 142           HE3      TRP 142  19.082   7.280  -0.557
 1029    HZ2  TRP 142           HZ2      TRP 142  17.446   3.548  -3.430
 1030    HZ3  TRP 142           HZ3      TRP 142  16.691   6.591  -0.470
 1031    HH2  TRP 142           HH2      TRP 142  15.873   4.720  -1.888
 1032    H    VAL 143           H        VAL 143  20.631   9.974  -1.095
 1033    HA   VAL 143           HA       VAL 143  18.387  10.399  -2.823
 1034    HB   VAL 143           HB       VAL 143  19.404  11.684  -0.282
 1035   1HG1  VAL 143          HG11      VAL 143  18.380  13.562  -1.404
 1036   2HG1  VAL 143          HG12      VAL 143  16.961  12.577  -1.856
 1037   3HG1  VAL 143          HG13      VAL 143  17.283  12.980  -0.152
 1038   1HG2  VAL 143          HG21      VAL 143  16.833  10.174  -0.945
 1039   2HG2  VAL 143          HG22      VAL 143  18.270   9.446  -0.208
 1040   3HG2  VAL 143          HG23      VAL 143  17.382  10.695   0.664
 1041    H    ASN 144           H        ASN 144  21.320  12.452  -2.177
 1042    HA   ASN 144           HA       ASN 144  20.577  14.508  -3.964
 1043   1HB   ASN 144          HB2       ASN 144  23.382  13.565  -3.257
 1044   2HB   ASN 144          HB3       ASN 144  22.995  15.077  -4.058
 1045   1HD2  ASN 144          HD22      ASN 144  24.302  14.522  -1.381
 1046   2HD2  ASN 144          HD21      ASN 144  23.329  15.366  -0.212
 1047    H    LEU 145           H        LEU 145  21.997  11.341  -4.599
 1048    HA   LEU 145           HA       LEU 145  22.722  11.876  -7.336
 1049   1HB   LEU 145          HB2       LEU 145  22.730   9.542  -5.499
 1050   2HB   LEU 145          HB3       LEU 145  22.314   9.125  -7.152
 1051    HG   LEU 145           HG       LEU 145  24.362  10.221  -7.988
 1052   1HD1  LEU 145          HD11      LEU 145  25.120  10.543  -5.050
 1053   2HD1  LEU 145          HD12      LEU 145  26.173  10.853  -6.446
 1054   3HD1  LEU 145          HD13      LEU 145  24.756  11.873  -6.167
 1055   1HD2  LEU 145          HD21      LEU 145  24.829   8.134  -5.813
 1056   2HD2  LEU 145          HD22      LEU 145  24.324   7.809  -7.487
 1057   3HD2  LEU 145          HD23      LEU 145  25.924   8.494  -7.169
 1058    H    LEU 146           H        LEU 146  19.841  10.236  -5.806
 1059    HA   LEU 146           HA       LEU 146  18.633   9.752  -8.339
 1060   1HB   LEU 146          HB2       LEU 146  16.894   8.855  -7.194
 1061   2HB   LEU 146          HB3       LEU 146  18.289   8.498  -6.209
 1062    HG   LEU 146           HG       LEU 146  17.411  10.649  -4.863
 1063   1HD1  LEU 146          HD11      LEU 146  14.954  10.725  -4.735
 1064   2HD1  LEU 146          HD12      LEU 146  15.483  11.186  -6.347
 1065   3HD1  LEU 146          HD13      LEU 146  14.832   9.563  -6.071
 1066   1HD2  LEU 146          HD21      LEU 146  17.665   8.341  -3.968
 1067   2HD2  LEU 146          HD22      LEU 146  16.262   9.188  -3.330
 1068   3HD2  LEU 146          HD23      LEU 146  16.023   7.962  -4.579
 1069    H    LYS 147           H        LYS 147  18.433  12.413  -6.069
 1070    HA   LYS 147           HA       LYS 147  16.264  13.887  -7.090
 1071   1HB   LYS 147          HB2       LYS 147  18.822  14.552  -5.617
 1072   2HB   LYS 147          HB3       LYS 147  17.870  15.869  -6.309
 1073   1HG   LYS 147          HG2       LYS 147  15.873  15.156  -5.090
 1074   2HG   LYS 147          HG3       LYS 147  16.744  13.779  -4.394
 1075   1HD   LYS 147          HD2       LYS 147  18.301  15.298  -3.250
 1076   2HD   LYS 147          HD3       LYS 147  17.529  16.709  -3.977
 1077   1HE   LYS 147          HE2       LYS 147  16.123  14.729  -2.123
 1078   2HE   LYS 147          HE3       LYS 147  16.874  16.233  -1.585
 1079   1HZ   LYS 147          HZ1       LYS 147  14.604  16.064  -3.481
 1080   2HZ   LYS 147          HZ2       LYS 147  14.519  16.528  -1.923
 1081   3HZ   LYS 147          HZ3       LYS 147  15.323  17.451  -2.995
  Start of MODEL    8
    1   1H    MET   1          H1        MET   1   1.432  -0.929  -0.590
    2   2H    MET   1          H2        MET   1   1.163  -0.362  -2.097
    3   3H    MET   1          H3        MET   1   0.922  -1.952  -1.762
    4    HA   MET   1           HA       MET   1   3.271  -2.260  -1.319
    5   1HB   MET   1          HB2       MET   1   2.443  -1.199  -4.044
    6   2HB   MET   1          HB3       MET   1   4.123  -1.591  -3.706
    7   1HG   MET   1          HG2       MET   1   3.455  -3.880  -2.998
    8   2HG   MET   1          HG3       MET   1   1.796  -3.527  -3.503
    9   1HE   MET   1          HE1       MET   1   1.993  -5.806  -4.960
   10   2HE   MET   1          HE2       MET   1   3.257  -6.072  -6.182
   11   3HE   MET   1          HE3       MET   1   3.691  -5.989  -4.460
   12    H    ALA   2           H        ALA   2   5.073  -1.395  -0.547
   13    HA   ALA   2           HA       ALA   2   5.593   1.360  -0.138
   14   1HB   ALA   2          HB1       ALA   2   7.398  -1.083  -0.397
   15   2HB   ALA   2          HB2       ALA   2   7.916   0.463   0.251
   16   3HB   ALA   2          HB3       ALA   2   6.677  -0.462   1.113
   17    H    ASP   3           H        ASP   3   7.728   2.356  -0.990
   18    HA   ASP   3           HA       ASP   3   7.774   2.370  -3.937
   19   1HB   ASP   3          HB2       ASP   3   7.848   4.511  -2.527
   20   2HB   ASP   3          HB3       ASP   3   9.399   3.979  -1.932
   21    H    ILE   4           H        ILE   4   9.503   1.141  -1.139
   22    HA   ILE   4           HA       ILE   4  11.686   0.081  -2.867
   23    HB   ILE   4           HB       ILE   4  12.000   1.225  -0.068
   24   1HG1  ILE   4          HG12      ILE   4  12.566   2.690  -2.669
   25   2HG1  ILE   4          HG13      ILE   4  11.388   3.129  -1.433
   26   1HG2  ILE   4          HG21      ILE   4  14.066   0.614  -2.218
   27   2HG2  ILE   4          HG22      ILE   4  14.375   1.109  -0.536
   28   3HG2  ILE   4          HG23      ILE   4  13.679  -0.461  -0.870
   29   1HD1  ILE   4          HD11      ILE   4  14.400   3.269  -1.168
   30   2HD1  ILE   4          HD12      ILE   4  13.240   4.596  -1.231
   31   3HD1  ILE   4          HD13      ILE   4  13.254   3.514   0.177
   32    H    THR   5           H        THR   5  11.932  -2.131  -2.585
   33    HA   THR   5           HA       THR   5  10.810  -3.442  -0.177
   34    HB   THR   5           HB       THR   5  10.398  -4.565  -2.340
   35    HG1  THR   5           HG1      THR   5  11.293  -6.563  -1.747
   36   1HG2  THR   5          HG21      THR   5  13.400  -4.876  -2.661
   37   2HG2  THR   5          HG22      THR   5  12.123  -5.546  -3.690
   38   3HG2  THR   5          HG23      THR   5  12.362  -3.799  -3.626
   39    H    LEU   6           H        LEU   6  12.176  -3.988   1.542
   40    HA   LEU   6           HA       LEU   6  15.130  -3.568   1.194
   41   1HB   LEU   6          HB2       LEU   6  13.345  -3.260   3.631
   42   2HB   LEU   6          HB3       LEU   6  15.056  -3.561   3.755
   43    HG   LEU   6           HG       LEU   6  15.512  -1.478   2.399
   44   1HD1  LEU   6          HD11      LEU   6  13.669   0.250   2.448
   45   2HD1  LEU   6          HD12      LEU   6  13.367  -1.084   1.336
   46   3HD1  LEU   6          HD13      LEU   6  12.545  -1.063   2.904
   47   1HD2  LEU   6          HD21      LEU   6  15.127   0.019   4.348
   48   2HD2  LEU   6          HD22      LEU   6  14.071  -1.220   5.067
   49   3HD2  LEU   6          HD23      LEU   6  15.796  -1.546   4.824
   50    H    ILE   7           H        ILE   7  15.739  -5.579   0.593
   51    HA   ILE   7           HA       ILE   7  14.690  -7.963   1.912
   52    HB   ILE   7           HB       ILE   7  17.236  -7.884   0.259
   53   1HG1  ILE   7          HG12      ILE   7  14.390  -8.106  -0.837
   54   2HG1  ILE   7          HG13      ILE   7  15.501  -6.768  -1.132
   55   1HG2  ILE   7          HG21      ILE   7  16.629 -10.248  -0.071
   56   2HG2  ILE   7          HG22      ILE   7  16.543  -9.887   1.651
   57   3HG2  ILE   7          HG23      ILE   7  15.044  -9.967   0.696
   58   1HD1  ILE   7          HD11      ILE   7  17.083  -8.320  -2.265
   59   2HD1  ILE   7          HD12      ILE   7  15.870  -9.618  -2.110
   60   3HD1  ILE   7          HD13      ILE   7  15.502  -8.176  -3.060
   61    H    SER   8           H        SER   8  15.024  -7.885   4.021
   62    HA   SER   8           HA       SER   8  17.275  -6.487   5.241
   63   1HB   SER   8          HB2       SER   8  14.820  -7.812   6.457
   64   2HB   SER   8          HB3       SER   8  15.864  -6.612   7.215
   65    HG   SER   8           HG       SER   8  14.408  -6.140   4.804
   66    H    GLY   9           H        GLY   9  17.699  -9.209   3.939
   67   1HA   GLY   9          HA2       GLY   9  19.163 -10.532   5.989
   68   2HA   GLY   9          HA3       GLY   9  17.623 -11.374   5.660
   69    H    SER  10           H        SER  10  19.689 -12.819   5.189
   70    HA   SER  10           HA       SER  10  20.060 -12.819   2.238
   71   1HB   SER  10          HB2       SER  10  22.443 -13.552   2.809
   72   2HB   SER  10          HB3       SER  10  22.044 -11.861   3.106
   73    HG   SER  10           HG       SER  10  23.231 -13.071   4.736
   74    H    THR  11           H        THR  11  19.800 -14.680   5.231
   75    HA   THR  11           HA       THR  11  19.611 -17.184   3.645
   76    HB   THR  11           HB       THR  11  20.345 -18.197   5.884
   77    HG1  THR  11           HG1      THR  11  20.027 -16.532   7.302
   78   1HG2  THR  11          HG21      THR  11  22.290 -16.255   4.555
   79   2HG2  THR  11          HG22      THR  11  22.704 -17.684   5.524
   80   3HG2  THR  11          HG23      THR  11  21.891 -17.883   3.967
   81    H    LEU  12           H        LEU  12  17.400 -15.547   3.674
   82    HA   LEU  12           HA       LEU  12  15.293 -15.158   4.298
   83   1HB   LEU  12          HB2       LEU  12  15.269 -17.641   3.740
   84   2HB   LEU  12          HB3       LEU  12  15.239 -17.952   5.472
   85    HG   LEU  12           HG       LEU  12  13.074 -16.558   5.571
   86   1HD1  LEU  12          HD11      LEU  12  11.809 -16.352   3.460
   87   2HD1  LEU  12          HD12      LEU  12  13.264 -15.351   3.422
   88   3HD1  LEU  12          HD13      LEU  12  13.225 -16.893   2.545
   89   1HD2  LEU  12          HD21      LEU  12  13.092 -19.021   5.638
   90   2HD2  LEU  12          HD22      LEU  12  11.690 -18.415   4.745
   91   3HD2  LEU  12          HD23      LEU  12  13.084 -19.081   3.862
   92    H    GLY  13           H        GLY  13  17.262 -14.229   5.956
   93   1HA   GLY  13          HA2       GLY  13  15.940 -13.234   8.210
   94   2HA   GLY  13          HA3       GLY  13  16.907 -14.624   8.747
   95    H    GLY  14           H        GLY  14  17.523 -12.005   9.617
   96   1HA   GLY  14          HA2       GLY  14  20.231 -11.684   9.277
   97   2HA   GLY  14          HA3       GLY  14  19.520 -10.743   7.967
   98    H    ALA  15           H        ALA  15  20.452  -8.906   9.016
   99    HA   ALA  15           HA       ALA  15  19.761  -8.096  11.686
  100   1HB   ALA  15          HB1       ALA  15  21.952  -7.629  10.637
  101   2HB   ALA  15          HB2       ALA  15  21.156  -6.585   9.431
  102   3HB   ALA  15          HB3       ALA  15  21.143  -6.142  11.151
  103    H    GLU  16           H        GLU  16  17.315  -8.400  10.882
  104    HA   GLU  16           HA       GLU  16  16.017  -6.446   9.369
  105   1HB   GLU  16          HB2       GLU  16  15.018  -7.988  11.790
  106   2HB   GLU  16          HB3       GLU  16  13.994  -6.983  10.750
  107   1HG   GLU  16          HG2       GLU  16  14.534  -8.386   8.800
  108   2HG   GLU  16          HG3       GLU  16  15.605  -9.386   9.784
  109    H    TYR  17           H        TYR  17  17.098  -6.143  12.770
  110    HA   TYR  17           HA       TYR  17  15.645  -3.771  13.395
  111   1HB   TYR  17          HB2       TYR  17  16.819  -5.098  15.080
  112   2HB   TYR  17          HB3       TYR  17  18.369  -4.762  14.321
  113    HD1  TYR  17           HD1      TYR  17  19.416  -2.498  14.493
  114    HD2  TYR  17           HD2      TYR  17  15.697  -3.423  16.480
  115    HE1  TYR  17           HE1      TYR  17  19.675  -0.482  15.902
  116    HE2  TYR  17           HE2      TYR  17  15.943  -1.403  17.886
  117    HH   TYR  17           HH       TYR  17  17.254   0.458  18.388
  118    H    VAL  18           H        VAL  18  18.739  -4.263  11.628
  119    HA   VAL  18           HA       VAL  18  19.368  -1.420  11.595
  120    HB   VAL  18           HB       VAL  18  20.520  -3.745   9.986
  121   1HG1  VAL  18          HG11      VAL  18  21.624  -0.940  10.461
  122   2HG1  VAL  18          HG12      VAL  18  22.476  -2.278   9.660
  123   3HG1  VAL  18          HG13      VAL  18  21.029  -1.588   8.916
  124   1HG2  VAL  18          HG21      VAL  18  21.529  -2.436  12.558
  125   2HG2  VAL  18          HG22      VAL  18  20.889  -4.084  12.416
  126   3HG2  VAL  18          HG23      VAL  18  22.400  -3.658  11.614
  127    H    ALA  19           H        ALA  19  17.824  -3.828   9.439
  128    HA   ALA  19           HA       ALA  19  17.419  -2.044   7.236
  129   1HB   ALA  19          HB1       ALA  19  15.723  -4.419   8.059
  130   2HB   ALA  19          HB2       ALA  19  15.793  -3.641   6.466
  131   3HB   ALA  19          HB3       ALA  19  17.215  -4.504   7.081
  132    H    GLU  20           H        GLU  20  15.381  -2.728  10.157
  133    HA   GLU  20           HA       GLU  20  13.270  -0.987   9.411
  134   1HB   GLU  20          HB2       GLU  20  13.227  -2.732  11.207
  135   2HB   GLU  20          HB3       GLU  20  14.216  -1.670  12.223
  136   1HG   GLU  20          HG2       GLU  20  12.437   0.069  12.101
  137   2HG   GLU  20          HG3       GLU  20  11.478  -0.984  11.062
  138    H    HIS  21           H        HIS  21  16.348  -0.313  11.190
  139    HA   HIS  21           HA       HIS  21  15.743   2.429  11.729
  140   1HB   HIS  21          HB2       HIS  21  17.590   0.966  12.720
  141   2HB   HIS  21          HB3       HIS  21  18.516   1.308  11.257
  142    HD1  HIS  21           HD1      HIS  21  17.995   4.424  10.955
  143    HD2  HIS  21           HD2      HIS  21  18.546   2.410  14.602
  144    HE1  HIS  21           HE1      HIS  21  18.838   6.171  12.614
  145    H    LEU  22           H        LEU  22  17.256   0.803   8.920
  146    HA   LEU  22           HA       LEU  22  17.924   3.155   7.425
  147   1HB   LEU  22          HB2       LEU  22  17.384   0.240   6.804
  148   2HB   LEU  22          HB3       LEU  22  17.551   1.362   5.487
  149    HG   LEU  22           HG       LEU  22  19.645   1.182   7.706
  150   1HD1  LEU  22          HD11      LEU  22  19.598  -0.472   5.151
  151   2HD1  LEU  22          HD12      LEU  22  20.895  -0.426   6.379
  152   3HD1  LEU  22          HD13      LEU  22  19.330  -1.081   6.799
  153   1HD2  LEU  22          HD21      LEU  22  19.793   2.102   4.797
  154   2HD2  LEU  22          HD22      LEU  22  19.834   3.144   6.231
  155   3HD2  LEU  22          HD23      LEU  22  21.166   2.026   5.922
  156    H    ALA  23           H        ALA  23  15.102   0.974   7.244
  157    HA   ALA  23           HA       ALA  23  13.457   2.362   5.492
  158   1HB   ALA  23          HB1       ALA  23  11.551   1.372   6.797
  159   2HB   ALA  23          HB2       ALA  23  12.797   0.203   6.330
  160   3HB   ALA  23          HB3       ALA  23  12.706   0.808   7.997
  161    H    GLU  24           H        GLU  24  13.842   3.023   9.040
  162    HA   GLU  24           HA       GLU  24  11.937   5.043   9.251
  163   1HB   GLU  24          HB2       GLU  24  13.527   3.979  11.045
  164   2HB   GLU  24          HB3       GLU  24  14.659   5.234  10.603
  165   1HG   GLU  24          HG2       GLU  24  13.508   6.056  12.486
  166   2HG   GLU  24          HG3       GLU  24  12.907   6.968  11.109
  167    H    LYS  25           H        LYS  25  15.439   5.484   8.487
  168    HA   LYS  25           HA       LYS  25  15.291   8.251   7.929
  169   1HB   LYS  25          HB2       LYS  25  17.128   6.098   6.771
  170   2HB   LYS  25          HB3       LYS  25  17.411   7.813   6.660
  171   1HG   LYS  25          HG2       LYS  25  17.317   6.103   9.190
  172   2HG   LYS  25          HG3       LYS  25  18.729   6.795   8.469
  173   1HD   LYS  25          HD2       LYS  25  16.510   8.125  10.007
  174   2HD   LYS  25          HD3       LYS  25  18.208   8.050  10.429
  175   1HE   LYS  25          HE2       LYS  25  16.980   9.701   8.170
  176   2HE   LYS  25          HE3       LYS  25  17.490  10.283   9.748
  177   1HZ   LYS  25          HZ1       LYS  25  19.308   9.174   7.686
  178   2HZ   LYS  25          HZ2       LYS  25  19.192  10.736   8.137
  179   3HZ   LYS  25          HZ3       LYS  25  19.798   9.635   9.178
  180    H    LEU  26           H        LEU  26  14.909   5.498   5.718
  181    HA   LEU  26           HA       LEU  26  14.710   7.017   3.307
  182   1HB   LEU  26          HB2       LEU  26  13.629   4.302   4.122
  183   2HB   LEU  26          HB3       LEU  26  13.469   4.925   2.482
  184    HG   LEU  26           HG       LEU  26  16.194   4.707   3.809
  185   1HD1  LEU  26          HD11      LEU  26  14.815   2.559   2.146
  186   2HD1  LEU  26          HD12      LEU  26  16.485   2.527   2.771
  187   3HD1  LEU  26          HD13      LEU  26  15.128   2.476   3.894
  188   1HD2  LEU  26          HD21      LEU  26  16.003   6.075   1.724
  189   2HD2  LEU  26          HD22      LEU  26  16.999   4.630   1.498
  190   3HD2  LEU  26          HD23      LEU  26  15.337   4.670   0.882
  191    H    GLU  27           H        GLU  27  12.116   5.956   5.633
  192    HA   GLU  27           HA       GLU  27  10.064   7.129   3.995
  193   1HB   GLU  27          HB2       GLU  27  10.117   6.108   6.861
  194   2HB   GLU  27          HB3       GLU  27   8.683   6.723   6.033
  195   1HG   GLU  27          HG2       GLU  27   9.187   5.051   4.158
  196   2HG   GLU  27          HG3       GLU  27  10.339   4.304   5.236
  197    H    GLU  28           H        GLU  28  12.081   8.334   6.731
  198    HA   GLU  28           HA       GLU  28  10.785  10.858   6.999
  199   1HB   GLU  28          HB2       GLU  28  13.606   9.831   7.478
  200   2HB   GLU  28          HB3       GLU  28  13.209  11.514   7.707
  201   1HG   GLU  28          HG2       GLU  28  11.772   9.257   9.153
  202   2HG   GLU  28          HG3       GLU  28  13.192  10.096   9.775
  203    H    ALA  29           H        ALA  29  13.121   9.609   4.584
  204    HA   ALA  29           HA       ALA  29  13.676  12.173   3.401
  205   1HB   ALA  29          HB1       ALA  29  14.626  10.890   1.558
  206   2HB   ALA  29          HB2       ALA  29  15.161  10.208   3.107
  207   3HB   ALA  29          HB3       ALA  29  13.895   9.401   2.151
  208    H    GLY  30           H        GLY  30  10.929  10.028   3.230
  209   1HA   GLY  30          HA2       GLY  30   8.943  11.323   2.624
  210   2HA   GLY  30          HA3       GLY  30   9.731  11.752   1.102
  211    H    PHE  31           H        PHE  31  10.609   8.529   1.647
  212    HA   PHE  31           HA       PHE  31   8.612   7.725  -0.389
  213   1HB   PHE  31          HB2       PHE  31  10.789   5.915   0.609
  214   2HB   PHE  31          HB3       PHE  31  10.044   6.006  -0.964
  215    HD1  PHE  31           HD1      PHE  31  13.049   6.503   0.627
  216    HD2  PHE  31           HD2      PHE  31  10.408   8.535  -2.114
  217    HE1  PHE  31           HE1      PHE  31  14.964   7.776  -0.270
  218    HE2  PHE  31           HE2      PHE  31  12.329   9.842  -2.986
  219    HZ   PHE  31           HZ       PHE  31  14.611   9.467  -2.073
  220    H    THR  32           H        THR  32   8.361   5.037   0.036
  221    HA   THR  32           HA       THR  32   7.559   4.570   2.826
  222    HB   THR  32           HB       THR  32   5.723   3.080   1.869
  223    HG1  THR  32           HG1      THR  32   5.878   4.987  -0.240
  224   1HG2  THR  32          HG21      THR  32   5.285   5.017   3.267
  225   2HG2  THR  32          HG22      THR  32   5.348   6.103   1.860
  226   3HG2  THR  32          HG23      THR  32   4.052   4.886   1.997
  227    H    THR  33           H        THR  33   8.044   2.435   3.441
  228    HA   THR  33           HA       THR  33   9.625   0.894   1.415
  229    HB   THR  33           HB       THR  33  11.403   0.726   2.948
  230    HG1  THR  33           HG1      THR  33  10.262   0.967   4.929
  231   1HG2  THR  33          HG21      THR  33  12.318   2.909   2.842
  232   2HG2  THR  33          HG22      THR  33  11.278   2.761   1.421
  233   3HG2  THR  33          HG23      THR  33  10.718   3.687   2.824
  234    H    GLU  34           H        GLU  34   9.874  -1.315   1.722
  235    HA   GLU  34           HA       GLU  34   7.982  -2.614   3.580
  236   1HB   GLU  34          HB2       GLU  34   8.289  -2.667   0.785
  237   2HB   GLU  34          HB3       GLU  34   9.072  -4.129   1.303
  238   1HG   GLU  34          HG2       GLU  34   6.934  -4.707   0.957
  239   2HG   GLU  34          HG3       GLU  34   7.017  -4.635   2.708
  240    H    THR  35           H        THR  35   9.448  -2.701   5.427
  241    HA   THR  35           HA       THR  35  12.061  -3.922   5.175
  242    HB   THR  35           HB       THR  35  10.419  -3.861   7.714
  243    HG1  THR  35           HG1      THR  35  10.857  -1.772   7.981
  244   1HG2  THR  35          HG21      THR  35  12.636  -3.652   8.735
  245   2HG2  THR  35          HG22      THR  35  12.683  -4.997   7.572
  246   3HG2  THR  35          HG23      THR  35  13.389  -3.435   7.135
  247    H    LEU  36           H        LEU  36  12.376  -6.021   4.730
  248    HA   LEU  36           HA       LEU  36  10.342  -8.102   5.488
  249   1HB   LEU  36          HB2       LEU  36  11.594  -7.490   2.770
  250   2HB   LEU  36          HB3       LEU  36  10.669  -8.934   3.120
  251    HG   LEU  36           HG       LEU  36   9.509  -6.139   3.301
  252   1HD1  LEU  36          HD11      LEU  36   9.495  -8.146   1.010
  253   2HD1  LEU  36          HD12      LEU  36   8.571  -6.613   1.074
  254   3HD1  LEU  36          HD13      LEU  36  10.340  -6.593   1.053
  255   1HD2  LEU  36          HD21      LEU  36   8.231  -7.853   4.558
  256   2HD2  LEU  36          HD22      LEU  36   7.340  -7.319   3.128
  257   3HD2  LEU  36          HD23      LEU  36   8.180  -8.884   3.110
  258    H    HIS  37           H        HIS  37  11.350 -10.101   6.025
  259    HA   HIS  37           HA       HIS  37  14.261 -10.307   5.660
  260   1HB   HIS  37          HB2       HIS  37  14.051 -12.427   6.868
  261   2HB   HIS  37          HB3       HIS  37  13.295 -11.106   7.739
  262    HD1  HIS  37           HD1      HIS  37  12.120 -13.962   5.386
  263    HD2  HIS  37           HD2      HIS  37  10.928 -11.662   8.697
  264    HE1  HIS  37           HE1      HIS  37   9.893 -14.953   6.188
  265    H    GLY  38           H        GLY  38  12.984  -9.953   3.228
  266   1HA   GLY  38          HA2       GLY  38  12.521 -10.771   1.150
  267   2HA   GLY  38          HA3       GLY  38  13.892 -11.838   1.458
  268    HA   PRO  39           HA       PRO  39  10.419 -14.674   2.942
  269   1HB   PRO  39          HB2       PRO  39   7.756 -13.982   2.932
  270   2HB   PRO  39          HB3       PRO  39   8.872 -13.616   4.281
  271   1HG   PRO  39          HG2       PRO  39   8.044 -11.797   2.004
  272   2HG   PRO  39          HG3       PRO  39   8.090 -11.428   3.758
  273   1HD   PRO  39          HD2       PRO  39  10.114 -10.727   2.076
  274   2HD   PRO  39          HD3       PRO  39  10.439 -11.268   3.759
  275    H    LEU  40           H        LEU  40   9.722 -12.714   0.077
  276    HA   LEU  40           HA       LEU  40   8.987 -15.133  -1.459
  277   1HB   LEU  40          HB2       LEU  40   7.983 -12.239  -1.469
  278   2HB   LEU  40          HB3       LEU  40   7.693 -13.345  -2.778
  279    HG   LEU  40           HG       LEU  40   6.711 -13.760   0.072
  280   1HD1  LEU  40          HD11      LEU  40   5.612 -11.868  -1.058
  281   2HD1  LEU  40          HD12      LEU  40   5.207 -12.910  -2.439
  282   3HD1  LEU  40          HD13      LEU  40   4.492 -13.219  -0.840
  283   1HD2  LEU  40          HD21      LEU  40   6.130 -15.340  -2.476
  284   2HD2  LEU  40          HD22      LEU  40   6.984 -15.932  -1.032
  285   3HD2  LEU  40          HD23      LEU  40   5.270 -15.535  -0.932
  286    H    LEU  41           H        LEU  41  11.589 -13.471  -0.814
  287    HA   LEU  41           HA       LEU  41  13.395 -12.543  -1.759
  288   1HB   LEU  41          HB2       LEU  41  13.235 -14.676  -3.110
  289   2HB   LEU  41          HB3       LEU  41  12.492 -13.710  -4.386
  290    HG   LEU  41           HG       LEU  41  14.578 -12.227  -4.319
  291   1HD1  LEU  41          HD11      LEU  41  15.519 -12.898  -2.151
  292   2HD1  LEU  41          HD12      LEU  41  15.670 -14.568  -2.732
  293   3HD1  LEU  41          HD13      LEU  41  16.645 -13.270  -3.458
  294   1HD2  LEU  41          HD21      LEU  41  15.888 -13.807  -5.701
  295   2HD2  LEU  41          HD22      LEU  41  14.882 -15.152  -5.114
  296   3HD2  LEU  41          HD23      LEU  41  14.163 -13.859  -6.098
  297    H    GLU  42           H        GLU  42  10.341 -11.695  -3.253
  298    HA   GLU  42           HA       GLU  42  11.245  -8.975  -3.900
  299   1HB   GLU  42          HB2       GLU  42  10.657  -9.294  -6.321
  300   2HB   GLU  42          HB3       GLU  42  12.128 -10.080  -5.781
  301   1HG   GLU  42          HG2       GLU  42  10.957 -12.275  -5.709
  302   2HG   GLU  42          HG3       GLU  42   9.506 -11.513  -6.354
  303    H    ASP  43           H        ASP  43   9.618  -8.655  -2.199
  304    HA   ASP  43           HA       ASP  43   6.843  -9.282  -2.716
  305   1HB   ASP  43          HB2       ASP  43   7.649  -8.658  -0.474
  306   2HB   ASP  43          HB3       ASP  43   8.017  -7.026  -1.073
  307    H    LEU  44           H        LEU  44   8.936  -6.372  -3.406
  308    HA   LEU  44           HA       LEU  44   6.770  -5.277  -5.110
  309   1HB   LEU  44          HB2       LEU  44   9.630  -4.319  -4.777
  310   2HB   LEU  44          HB3       LEU  44   8.418  -3.515  -5.701
  311    HG   LEU  44           HG       LEU  44   8.419  -3.821  -2.684
  312   1HD1  LEU  44          HD11      LEU  44   8.615  -1.410  -2.706
  313   2HD1  LEU  44          HD12      LEU  44   9.869  -2.058  -3.790
  314   3HD1  LEU  44          HD13      LEU  44   8.400  -1.344  -4.465
  315   1HD2  LEU  44          HD21      LEU  44   6.357  -2.432  -2.701
  316   2HD2  LEU  44          HD22      LEU  44   6.239  -2.659  -4.462
  317   3HD2  LEU  44          HD23      LEU  44   6.093  -4.047  -3.356
  318    HA   PRO  45           HA       PRO  45   8.012  -7.455  -8.715
  319   1HB   PRO  45          HB2       PRO  45   7.690  -5.533 -10.743
  320   2HB   PRO  45          HB3       PRO  45   6.418  -6.501  -9.985
  321   1HG   PRO  45          HG2       PRO  45   7.324  -3.673  -9.370
  322   2HG   PRO  45          HG3       PRO  45   5.648  -4.293  -9.455
  323   1HD   PRO  45          HD2       PRO  45   6.976  -3.898  -7.089
  324   2HD   PRO  45          HD3       PRO  45   5.794  -5.225  -7.305
  325    H    ALA  46           H        ALA  46   9.267  -7.158 -10.814
  326    HA   ALA  46           HA       ALA  46  12.056  -6.554 -10.262
  327   1HB   ALA  46          HB1       ALA  46  11.373  -8.509 -11.625
  328   2HB   ALA  46          HB2       ALA  46  10.632  -7.420 -12.827
  329   3HB   ALA  46          HB3       ALA  46  12.385  -7.410 -12.576
  330    H    SER  47           H        SER  47  10.479  -4.225  -9.983
  331    HA   SER  47           HA       SER  47  11.472  -2.345 -11.915
  332   1HB   SER  47          HB2       SER  47   8.482  -2.629 -11.547
  333   2HB   SER  47          HB3       SER  47   9.313  -1.466 -12.585
  334    HG   SER  47           HG       SER  47   8.441  -3.243 -13.748
  335    H    GLY  48           H        GLY  48  11.855  -0.455 -10.687
  336   1HA   GLY  48          HA2       GLY  48  10.720   1.149  -9.056
  337   2HA   GLY  48          HA3       GLY  48  10.469  -0.251  -8.029
  338    H    ILE  49           H        ILE  49  11.711   0.237  -6.348
  339    HA   ILE  49           HA       ILE  49  14.654   0.523  -6.750
  340    HB   ILE  49           HB       ILE  49  13.094   1.476  -4.354
  341   1HG1  ILE  49          HG12      ILE  49  12.147   2.812  -6.153
  342   2HG1  ILE  49          HG13      ILE  49  13.094   3.771  -5.042
  343   1HG2  ILE  49          HG21      ILE  49  15.506   1.160  -4.016
  344   2HG2  ILE  49          HG22      ILE  49  15.864   2.226  -5.379
  345   3HG2  ILE  49          HG23      ILE  49  15.087   2.873  -3.920
  346   1HD1  ILE  49          HD11      ILE  49  14.162   2.840  -7.737
  347   2HD1  ILE  49          HD12      ILE  49  13.378   4.403  -7.442
  348   3HD1  ILE  49          HD13      ILE  49  14.891   4.018  -6.617
  349    H    TRP  50           H        TRP  50  15.846  -1.044  -5.676
  350    HA   TRP  50           HA       TRP  50  14.489  -2.816  -3.693
  351   1HB   TRP  50          HB2       TRP  50  16.194  -3.432  -6.119
  352   2HB   TRP  50          HB3       TRP  50  16.370  -4.419  -4.719
  353    HD1  TRP  50           HD1      TRP  50  12.949  -3.204  -6.151
  354    HE1  TRP  50           HE1      TRP  50  11.680  -5.156  -7.178
  355    HE3  TRP  50           HE3      TRP  50  16.285  -6.931  -5.152
  356    HZ2  TRP  50           HZ2      TRP  50  12.196  -7.925  -7.797
  357    HZ3  TRP  50           HZ3      TRP  50  15.921  -9.215  -6.059
  358    HH2  TRP  50           HH2      TRP  50  13.903  -9.709  -7.425
  359    H    LEU  51           H        LEU  51  15.708  -3.072  -1.844
  360    HA   LEU  51           HA       LEU  51  18.543  -2.154  -1.880
  361   1HB   LEU  51          HB2       LEU  51  16.469  -1.670   0.290
  362   2HB   LEU  51          HB3       LEU  51  18.201  -1.422   0.489
  363    HG   LEU  51           HG       LEU  51  16.384   0.142  -1.403
  364   1HD1  LEU  51          HD11      LEU  51  16.770   1.993   0.153
  365   2HD1  LEU  51          HD12      LEU  51  16.082   0.612   1.024
  366   3HD1  LEU  51          HD13      LEU  51  17.811   0.970   1.165
  367   1HD2  LEU  51          HD21      LEU  51  19.359   0.472  -0.828
  368   2HD2  LEU  51          HD22      LEU  51  18.603   0.069  -2.385
  369   3HD2  LEU  51          HD23      LEU  51  18.344   1.661  -1.679
  370    H    VAL  52           H        VAL  52  19.903  -3.454  -0.648
  371    HA   VAL  52           HA       VAL  52  18.665  -5.839   0.645
  372    HB   VAL  52           HB       VAL  52  19.204  -6.526  -1.577
  373   1HG1  VAL  52          HG11      VAL  52  20.894  -4.877  -2.258
  374   2HG1  VAL  52          HG12      VAL  52  22.065  -5.605  -1.120
  375   3HG1  VAL  52          HG13      VAL  52  21.485  -6.525  -2.510
  376   1HG2  VAL  52          HG21      VAL  52  21.323  -7.627   0.310
  377   2HG2  VAL  52          HG22      VAL  52  19.620  -8.126   0.272
  378   3HG2  VAL  52          HG23      VAL  52  20.656  -8.414  -1.133
  379    H    ILE  53           H        ILE  53  19.547  -6.400   2.539
  380    HA   ILE  53           HA       ILE  53  21.832  -4.785   3.544
  381    HB   ILE  53           HB       ILE  53  19.339  -5.584   5.106
  382   1HG1  ILE  53          HG12      ILE  53  19.022  -2.973   5.143
  383   2HG1  ILE  53          HG13      ILE  53  19.925  -2.995   3.637
  384   1HG2  ILE  53          HG21      ILE  53  21.613  -3.649   5.736
  385   2HG2  ILE  53          HG22      ILE  53  20.230  -4.025   6.788
  386   3HG2  ILE  53          HG23      ILE  53  21.417  -5.275   6.427
  387   1HD1  ILE  53          HD11      ILE  53  18.124  -4.397   2.616
  388   2HD1  ILE  53          HD12      ILE  53  17.305  -4.463   4.189
  389   3HD1  ILE  53          HD13      ILE  53  17.476  -2.923   3.328
  390    H    SER  54           H        SER  54  23.493  -6.219   3.831
  391    HA   SER  54           HA       SER  54  23.130  -8.715   5.286
  392   1HB   SER  54          HB2       SER  54  24.124  -8.875   2.408
  393   2HB   SER  54          HB3       SER  54  23.847 -10.209   3.532
  394    HG   SER  54           HG       SER  54  21.577  -8.954   3.400
  395    H    SER  55           H        SER  55  25.671  -9.859   4.564
  396    HA   SER  55           HA       SER  55  27.699  -7.779   4.418
  397   1HB   SER  55          HB2       SER  55  27.587  -9.666   6.805
  398   2HB   SER  55          HB3       SER  55  28.919  -8.561   6.401
  399    HG   SER  55           HG       SER  55  26.566  -7.248   6.414
  400    H    THR  56           H        THR  56  29.566  -8.742   3.334
  401    HA   THR  56           HA       THR  56  29.245 -11.633   2.650
  402    HB   THR  56           HB       THR  56  30.002 -10.937   0.364
  403    HG1  THR  56           HG1      THR  56  30.085  -8.896  -0.155
  404   1HG2  THR  56          HG21      THR  56  27.398  -9.632   1.276
  405   2HG2  THR  56          HG22      THR  56  27.829 -10.149  -0.370
  406   3HG2  THR  56          HG23      THR  56  27.608 -11.358   0.905
  407    H    HIS  57           H        HIS  57  31.761  -9.293   1.727
  408    HA   HIS  57           HA       HIS  57  33.852 -11.159   2.050
  409   1HB   HIS  57          HB2       HIS  57  33.967  -8.117   2.143
  410   2HB   HIS  57          HB3       HIS  57  35.358  -9.177   1.986
  411    HD1  HIS  57           HD1      HIS  57  35.153  -7.217  -0.274
  412    HD2  HIS  57           HD2      HIS  57  33.081 -10.891  -0.259
  413    HE1  HIS  57           HE1      HIS  57  34.732  -7.837  -2.717
  414    H    GLY  58           H        GLY  58  34.730 -12.036   3.831
  415   1HA   GLY  58          HA2       GLY  58  35.764 -12.090   5.893
  416   2HA   GLY  58          HA3       GLY  58  35.153 -10.467   6.258
  417    H    ALA  59           H        ALA  59  32.462 -11.951   5.285
  418    HA   ALA  59           HA       ALA  59  31.745 -13.303   7.831
  419   1HB   ALA  59          HB1       ALA  59  29.762 -11.824   8.069
  420   2HB   ALA  59          HB2       ALA  59  31.263 -10.900   8.180
  421   3HB   ALA  59          HB3       ALA  59  30.307 -10.863   6.677
  422    H    GLY  60           H        GLY  60  32.181 -14.288   5.093
  423   1HA   GLY  60          HA2       GLY  60  29.566 -14.447   3.824
  424   2HA   GLY  60          HA3       GLY  60  31.102 -15.056   3.201
  425    H    ASP  61           H        ASP  61  29.504 -16.720   2.554
  426    HA   ASP  61           HA       ASP  61  29.595 -19.024   4.394
  427   1HB   ASP  61          HB2       ASP  61  27.266 -17.792   4.380
  428   2HB   ASP  61          HB3       ASP  61  27.089 -18.500   2.778
  429    H    ILE  62           H        ILE  62  28.761 -20.994   2.786
  430    HA   ILE  62           HA       ILE  62  30.943 -21.333   1.052
  431    HB   ILE  62           HB       ILE  62  28.373 -22.844   1.526
  432   1HG1  ILE  62          HG12      ILE  62  29.933 -24.624   2.257
  433   2HG1  ILE  62          HG13      ILE  62  31.314 -23.606   1.862
  434   1HG2  ILE  62          HG21      ILE  62  28.763 -23.248  -0.858
  435   2HG2  ILE  62          HG22      ILE  62  30.477 -23.613  -0.543
  436   3HG2  ILE  62          HG23      ILE  62  29.193 -24.679   0.066
  437   1HD1  ILE  62          HD11      ILE  62  29.239 -22.958   3.998
  438   2HD1  ILE  62          HD12      ILE  62  30.797 -23.751   4.293
  439   3HD1  ILE  62          HD13      ILE  62  30.772 -22.089   3.698
  440    HA   PRO  63           HA       PRO  63  28.299 -20.351  -2.775
  441   1HB   PRO  63          HB2       PRO  63  25.956 -18.885  -2.526
  442   2HB   PRO  63          HB3       PRO  63  26.049 -20.667  -2.632
  443   1HG   PRO  63          HG2       PRO  63  25.801 -18.951  -0.155
  444   2HG   PRO  63          HG3       PRO  63  24.929 -20.464  -0.557
  445   1HD   PRO  63          HD2       PRO  63  27.062 -20.413   1.103
  446   2HD   PRO  63          HD3       PRO  63  26.804 -21.780  -0.018
  447    H    ASP  64           H        ASP  64  27.618 -17.844  -0.270
  448    HA   ASP  64           HA       ASP  64  29.746 -16.102  -1.102
  449   1HB   ASP  64          HB2       ASP  64  28.412 -15.406  -2.952
  450   2HB   ASP  64          HB3       ASP  64  26.919 -15.470  -2.011
  451    H    ASN  65           H        ASN  65  26.417 -15.810   0.136
  452    HA   ASN  65           HA       ASN  65  26.990 -15.967   2.897
  453   1HB   ASN  65          HB2       ASN  65  27.831 -13.645   2.761
  454   2HB   ASN  65          HB3       ASN  65  26.350 -13.161   1.954
  455   1HD2  ASN  65          HD22      ASN  65  27.726 -13.974   5.122
  456   2HD2  ASN  65          HD21      ASN  65  26.253 -13.659   5.961
  457    H    LEU  66           H        LEU  66  24.959 -14.299   0.470
  458    HA   LEU  66           HA       LEU  66  22.401 -15.144   1.475
  459   1HB   LEU  66          HB2       LEU  66  23.443 -14.269  -1.270
  460   2HB   LEU  66          HB3       LEU  66  21.826 -14.920  -1.070
  461    HG   LEU  66           HG       LEU  66  21.339 -13.160   0.625
  462   1HD1  LEU  66          HD11      LEU  66  23.632 -12.425   1.237
  463   2HD1  LEU  66          HD12      LEU  66  23.900 -11.880  -0.429
  464   3HD1  LEU  66          HD13      LEU  66  22.688 -11.082   0.594
  465   1HD2  LEU  66          HD21      LEU  66  20.647 -13.001  -1.799
  466   2HD2  LEU  66          HD22      LEU  66  20.780 -11.460  -0.939
  467   3HD2  LEU  66          HD23      LEU  66  22.060 -11.960  -2.049
  468    H    SER  67           H        SER  67  21.398 -17.219   1.268
  469    HA   SER  67           HA       SER  67  22.959 -19.149  -0.425
  470   1HB   SER  67          HB2       SER  67  21.727 -19.705   2.281
  471   2HB   SER  67          HB3       SER  67  22.533 -20.870   1.218
  472    HG   SER  67           HG       SER  67  23.687 -18.503   2.323
  473    HA   PRO  68           HA       PRO  68  18.589 -20.654  -1.164
  474   1HB   PRO  68          HB2       PRO  68  16.368 -19.468  -0.069
  475   2HB   PRO  68          HB3       PRO  68  17.289 -20.763   0.749
  476   1HG   PRO  68          HG2       PRO  68  17.422 -17.792   1.255
  477   2HG   PRO  68          HG3       PRO  68  17.396 -19.129   2.441
  478   1HD   PRO  68          HD2       PRO  68  19.695 -17.845   1.584
  479   2HD   PRO  68          HD3       PRO  68  19.681 -19.524   2.170
  480    H    PHE  69           H        PHE  69  18.645 -17.177  -0.459
  481    HA   PHE  69           HA       PHE  69  17.293 -16.212  -2.739
  482   1HB   PHE  69          HB2       PHE  69  19.519 -15.042  -1.020
  483   2HB   PHE  69          HB3       PHE  69  18.588 -14.111  -2.164
  484    HD1  PHE  69           HD1      PHE  69  18.681 -12.937   0.303
  485    HD2  PHE  69           HD2      PHE  69  16.107 -16.232  -0.809
  486    HE1  PHE  69           HE1      PHE  69  17.099 -12.350   2.120
  487    HE2  PHE  69           HE2      PHE  69  14.565 -15.632   1.002
  488    HZ   PHE  69           HZ       PHE  69  15.054 -13.706   2.480
  489    H    TYR  70           H        TYR  70  20.784 -16.840  -2.213
  490    HA   TYR  70           HA       TYR  70  21.759 -15.955  -4.688
  491   1HB   TYR  70          HB2       TYR  70  23.069 -16.496  -2.689
  492   2HB   TYR  70          HB3       TYR  70  22.791 -18.207  -2.971
  493    HD1  TYR  70           HD1      TYR  70  23.729 -19.225  -5.202
  494    HD2  TYR  70           HD2      TYR  70  24.956 -15.434  -3.547
  495    HE1  TYR  70           HE1      TYR  70  25.816 -19.329  -6.514
  496    HE2  TYR  70           HE2      TYR  70  27.025 -15.507  -4.906
  497    HH   TYR  70           HH       TYR  70  27.803 -18.250  -7.085
  498    H    GLU  71           H        GLU  71  20.759 -19.362  -3.779
  499    HA   GLU  71           HA       GLU  71  21.113 -20.350  -6.411
  500   1HB   GLU  71          HB2       GLU  71  19.233 -21.338  -4.220
  501   2HB   GLU  71          HB3       GLU  71  19.689 -22.222  -5.686
  502   1HG   GLU  71          HG2       GLU  71  22.134 -21.824  -4.875
  503   2HG   GLU  71          HG3       GLU  71  21.430 -21.466  -3.319
  504    H    ALA  72           H        ALA  72  18.155 -19.027  -4.811
  505    HA   ALA  72           HA       ALA  72  16.393 -19.490  -6.981
  506   1HB   ALA  72          HB1       ALA  72  15.614 -18.846  -4.731
  507   2HB   ALA  72          HB2       ALA  72  16.349 -17.235  -4.921
  508   3HB   ALA  72          HB3       ALA  72  14.993 -17.718  -5.957
  509    H    LEU  73           H        LEU  73  18.604 -16.707  -6.414
  510    HA   LEU  73           HA       LEU  73  17.622 -15.029  -8.452
  511   1HB   LEU  73          HB2       LEU  73  20.326 -15.446  -7.137
  512   2HB   LEU  73          HB3       LEU  73  20.203 -14.354  -8.482
  513    HG   LEU  73           HG       LEU  73  18.567 -14.180  -5.903
  514   1HD1  LEU  73          HD11      LEU  73  20.923 -13.784  -5.523
  515   2HD1  LEU  73          HD12      LEU  73  20.970 -12.561  -6.813
  516   3HD1  LEU  73          HD13      LEU  73  20.013 -12.277  -5.337
  517   1HD2  LEU  73          HD21      LEU  73  18.780 -12.225  -8.236
  518   2HD2  LEU  73          HD22      LEU  73  17.316 -13.079  -7.706
  519   3HD2  LEU  73          HD23      LEU  73  18.025 -11.857  -6.664
  520    H    GLN  74           H        GLN  74  20.338 -17.367  -8.643
  521    HA   GLN  74           HA       GLN  74  20.580 -16.964 -11.468
  522   1HB   GLN  74          HB2       GLN  74  21.659 -19.516 -10.266
  523   2HB   GLN  74          HB3       GLN  74  22.267 -18.490 -11.542
  524   1HG   GLN  74          HG2       GLN  74  22.707 -16.733  -9.731
  525   2HG   GLN  74          HG3       GLN  74  22.283 -17.988  -8.554
  526   1HE2  GLN  74          HE22      GLN  74  24.438 -17.291 -11.304
  527   2HE2  GLN  74          HE21      GLN  74  25.723 -18.378 -10.798
  528    H    GLU  75           H        GLU  75  18.331 -18.883  -9.700
  529    HA   GLU  75           HA       GLU  75  17.855 -20.809 -11.764
  530   1HB   GLU  75          HB2       GLU  75  17.322 -21.107  -9.334
  531   2HB   GLU  75          HB3       GLU  75  15.991 -19.962  -9.538
  532   1HG   GLU  75          HG2       GLU  75  14.902 -21.461 -11.147
  533   2HG   GLU  75          HG3       GLU  75  16.284 -22.560 -11.096
  534    H    GLN  76           H        GLN  76  16.542 -17.581 -11.064
  535    HA   GLN  76           HA       GLN  76  14.769 -17.848 -13.457
  536   1HB   GLN  76          HB2       GLN  76  13.356 -16.097 -12.346
  537   2HB   GLN  76          HB3       GLN  76  13.308 -17.717 -11.666
  538   1HG   GLN  76          HG2       GLN  76  14.356 -17.126  -9.711
  539   2HG   GLN  76          HG3       GLN  76  15.251 -15.788 -10.430
  540   1HE2  GLN  76          HE22      GLN  76  14.539 -14.727  -8.358
  541   2HE2  GLN  76          HE21      GLN  76  13.038 -13.812  -8.440
  542    H    LYS  77           H        LYS  77  17.269 -15.820 -12.067
  543    HA   LYS  77           HA       LYS  77  17.985 -13.697 -12.578
  544   1HB   LYS  77          HB2       LYS  77  18.217 -15.200 -15.179
  545   2HB   LYS  77          HB3       LYS  77  19.068 -13.690 -14.820
  546   1HG   LYS  77          HG2       LYS  77  20.183 -14.722 -12.929
  547   2HG   LYS  77          HG3       LYS  77  19.325 -16.245 -13.180
  548   1HD   LYS  77          HD2       LYS  77  21.193 -15.025 -15.240
  549   2HD   LYS  77          HD3       LYS  77  21.697 -16.204 -14.016
  550   1HE   LYS  77          HE2       LYS  77  20.012 -17.790 -14.886
  551   2HE   LYS  77          HE3       LYS  77  19.549 -16.639 -16.143
  552   1HZ   LYS  77          HZ1       LYS  77  21.117 -18.277 -16.973
  553   2HZ   LYS  77          HZ2       LYS  77  21.807 -16.804 -17.028
  554   3HZ   LYS  77          HZ3       LYS  77  22.234 -17.870 -15.861
  555    HA   PRO  78           HA       PRO  78  13.915 -12.421 -14.427
  556   1HB   PRO  78          HB2       PRO  78  13.168 -10.526 -12.508
  557   2HB   PRO  78          HB3       PRO  78  12.747 -12.252 -12.514
  558   1HG   PRO  78          HG2       PRO  78  14.946 -10.845 -11.018
  559   2HG   PRO  78          HG3       PRO  78  13.889 -12.160 -10.440
  560   1HD   PRO  78          HD2       PRO  78  16.464 -12.584 -11.288
  561   2HD   PRO  78          HD3       PRO  78  15.169 -13.786 -11.538
  562    H    ASP  79           H        ASP  79  13.031 -10.294 -15.059
  563    HA   ASP  79           HA       ASP  79  15.137  -8.785 -16.401
  564   1HB   ASP  79          HB2       ASP  79  13.129  -9.542 -17.603
  565   2HB   ASP  79          HB3       ASP  79  12.104  -8.578 -16.534
  566    H    LEU  80           H        LEU  80  15.910  -8.154 -14.205
  567    HA   LEU  80           HA       LEU  80  14.554  -6.061 -12.756
  568   1HB   LEU  80          HB2       LEU  80  17.425  -7.010 -12.788
  569   2HB   LEU  80          HB3       LEU  80  16.888  -5.745 -11.760
  570    HG   LEU  80           HG       LEU  80  16.554  -7.079 -10.134
  571   1HD1  LEU  80          HD11      LEU  80  14.369  -8.452 -11.724
  572   2HD1  LEU  80          HD12      LEU  80  14.618  -8.533  -9.965
  573   3HD1  LEU  80          HD13      LEU  80  14.199  -6.994 -10.707
  574   1HD2  LEU  80          HD21      LEU  80  16.785  -9.459 -11.987
  575   2HD2  LEU  80          HD22      LEU  80  18.117  -8.634 -11.139
  576   3HD2  LEU  80          HD23      LEU  80  16.872  -9.483 -10.214
  577    H    SER  81           H        SER  81  15.505  -5.668 -15.827
  578    HA   SER  81           HA       SER  81  17.285  -3.563 -16.006
  579   1HB   SER  81          HB2       SER  81  14.969  -4.358 -17.816
  580   2HB   SER  81          HB3       SER  81  16.543  -3.703 -18.253
  581    HG   SER  81           HG       SER  81  15.774  -6.228 -18.006
  582    H    ALA  82           H        ALA  82  14.237  -3.577 -14.622
  583    HA   ALA  82           HA       ALA  82  13.704  -0.703 -15.259
  584   1HB   ALA  82          HB1       ALA  82  11.932  -2.193 -16.097
  585   2HB   ALA  82          HB2       ALA  82  11.730  -2.882 -14.472
  586   3HB   ALA  82          HB3       ALA  82  11.339  -1.176 -14.772
  587    H    VAL  83           H        VAL  83  15.244  -2.496 -12.977
  588    HA   VAL  83           HA       VAL  83  14.363  -0.584 -10.881
  589    HB   VAL  83           HB       VAL  83  13.258  -2.492 -10.230
  590   1HG1  VAL  83          HG11      VAL  83  14.258  -4.187 -11.673
  591   2HG1  VAL  83          HG12      VAL  83  15.738  -4.169 -10.688
  592   3HG1  VAL  83          HG13      VAL  83  14.204  -4.753 -10.006
  593   1HG2  VAL  83          HG21      VAL  83  14.228  -3.307  -8.211
  594   2HG2  VAL  83          HG22      VAL  83  15.844  -2.783  -8.656
  595   3HG2  VAL  83          HG23      VAL  83  14.575  -1.589  -8.302
  596    H    ARG  84           H        ARG  84  15.827  -0.076  -9.217
  597    HA   ARG  84           HA       ARG  84  18.694  -0.406  -9.971
  598   1HB   ARG  84          HB2       ARG  84  19.195   1.685  -9.106
  599   2HB   ARG  84          HB3       ARG  84  17.728   1.962 -10.036
  600   1HG   ARG  84          HG2       ARG  84  16.453   1.731  -7.787
  601   2HG   ARG  84          HG3       ARG  84  18.037   1.813  -7.003
  602   1HD   ARG  84          HD2       ARG  84  16.634   3.920  -8.653
  603   2HD   ARG  84          HD3       ARG  84  17.111   4.018  -6.951
  604    HE   ARG  84           HE       ARG  84  19.521   3.808  -7.885
  605   1HH1  ARG  84          HH11      ARG  84  16.946   5.770  -9.374
  606   2HH1  ARG  84          HH12      ARG  84  17.990   6.511 -10.529
  607   1HH2  ARG  84          HH21      ARG  84  20.831   4.637  -9.490
  608   2HH2  ARG  84          HH22      ARG  84  20.303   5.915 -10.555
  609    H    PHE  85           H        PHE  85  20.129  -0.862  -8.237
  610    HA   PHE  85           HA       PHE  85  18.873  -2.188  -5.848
  611   1HB   PHE  85          HB2       PHE  85  20.898  -3.029  -7.805
  612   2HB   PHE  85          HB3       PHE  85  21.558  -3.001  -6.189
  613    HD1  PHE  85           HD1      PHE  85  21.193  -4.813  -4.732
  614    HD2  PHE  85           HD2      PHE  85  18.523  -4.199  -8.065
  615    HE1  PHE  85           HE1      PHE  85  20.104  -7.001  -4.279
  616    HE2  PHE  85           HE2      PHE  85  17.486  -6.411  -7.641
  617    HZ   PHE  85           HZ       PHE  85  18.305  -7.826  -5.762
  618    H    GLY  86           H        GLY  86  19.899  -1.752  -3.836
  619   1HA   GLY  86          HA2       GLY  86  22.284   0.014  -3.798
  620   2HA   GLY  86          HA3       GLY  86  20.872   0.462  -2.833
  621    H    ALA  87           H        ALA  87  23.694  -1.463  -2.930
  622    HA   ALA  87           HA       ALA  87  22.750  -3.533  -1.054
  623   1HB   ALA  87          HB1       ALA  87  25.439  -2.975  -2.387
  624   2HB   ALA  87          HB2       ALA  87  25.137  -4.307  -1.267
  625   3HB   ALA  87          HB3       ALA  87  24.275  -4.248  -2.816
  626    H    ILE  88           H        ILE  88  23.272  -3.565   1.107
  627    HA   ILE  88           HA       ILE  88  24.728  -1.239   2.248
  628    HB   ILE  88           HB       ILE  88  22.036  -2.374   3.121
  629   1HG1  ILE  88          HG12      ILE  88  22.595   0.153   1.528
  630   2HG1  ILE  88          HG13      ILE  88  21.684  -1.257   1.022
  631   1HG2  ILE  88          HG21      ILE  88  22.086  -0.207   4.554
  632   2HG2  ILE  88          HG22      ILE  88  23.085  -1.567   5.039
  633   3HG2  ILE  88          HG23      ILE  88  23.815  -0.178   4.227
  634   1HD1  ILE  88          HD11      ILE  88  19.956  -0.778   2.733
  635   2HD1  ILE  88          HD12      ILE  88  20.796   0.755   3.091
  636   3HD1  ILE  88          HD13      ILE  88  20.140   0.465   1.484
  637    H    GLY  89           H        GLY  89  26.116  -1.825   3.842
  638   1HA   GLY  89          HA2       GLY  89  27.005  -2.977   5.651
  639   2HA   GLY  89          HA3       GLY  89  25.656  -4.123   5.591
  640    H    ILE  90           H        ILE  90  26.052  -4.735   2.774
  641    HA   ILE  90           HA       ILE  90  27.808  -6.873   2.615
  642    HB   ILE  90           HB       ILE  90  26.621  -4.987   0.575
  643   1HG1  ILE  90          HG12      ILE  90  25.883  -7.681   1.715
  644   2HG1  ILE  90          HG13      ILE  90  24.963  -6.195   1.788
  645   1HG2  ILE  90          HG21      ILE  90  27.134  -6.512  -1.211
  646   2HG2  ILE  90          HG22      ILE  90  28.627  -6.015  -0.447
  647   3HG2  ILE  90          HG23      ILE  90  27.943  -7.626  -0.101
  648   1HD1  ILE  90          HD11      ILE  90  24.526  -6.368  -0.670
  649   2HD1  ILE  90          HD12      ILE  90  25.342  -7.952  -0.660
  650   3HD1  ILE  90          HD13      ILE  90  23.870  -7.703   0.285
  651    H    GLY  91           H        GLY  91  29.940  -7.161   1.891
  652   1HA   GLY  91          HA2       GLY  91  31.720  -4.848   2.453
  653   2HA   GLY  91          HA3       GLY  91  32.181  -6.554   2.338
  654    H    SER  92           H        SER  92  30.787  -7.153  -0.031
  655    HA   SER  92           HA       SER  92  32.509  -6.620  -2.131
  656   1HB   SER  92          HB2       SER  92  29.550  -7.200  -2.283
  657   2HB   SER  92          HB3       SER  92  30.779  -7.607  -3.493
  658    HG   SER  92           HG       SER  92  31.714  -9.014  -1.947
  659    H    ARG  93           H        ARG  93  32.569  -5.173  -3.809
  660    HA   ARG  93           HA       ARG  93  30.682  -3.026  -4.189
  661   1HB   ARG  93          HB2       ARG  93  32.121  -2.327  -2.165
  662   2HB   ARG  93          HB3       ARG  93  33.520  -2.378  -3.236
  663   1HG   ARG  93          HG2       ARG  93  32.552  -0.529  -4.585
  664   2HG   ARG  93          HG3       ARG  93  31.075  -0.591  -3.615
  665   1HD   ARG  93          HD2       ARG  93  32.485   1.268  -2.936
  666   2HD   ARG  93          HD3       ARG  93  32.357   0.098  -1.612
  667    HE   ARG  93           HE       ARG  93  34.662  -0.661  -2.920
  668   1HH1  ARG  93          HH11      ARG  93  33.610   2.483  -1.549
  669   2HH1  ARG  93          HH12      ARG  93  35.235   2.969  -1.200
  670   1HH2  ARG  93          HH21      ARG  93  36.694  -0.003  -2.526
  671   2HH2  ARG  93          HH22      ARG  93  37.058   1.517  -1.753
  672    H    GLU  94           H        GLU  94  31.677  -1.672  -6.120
  673    HA   GLU  94           HA       GLU  94  32.685  -3.317  -8.172
  674   1HB   GLU  94          HB2       GLU  94  32.888  -0.329  -7.810
  675   2HB   GLU  94          HB3       GLU  94  33.213  -1.162  -9.328
  676   1HG   GLU  94          HG2       GLU  94  30.523  -1.110  -7.883
  677   2HG   GLU  94          HG3       GLU  94  30.965  -0.125  -9.270
  678    H    TYR  95           H        TYR  95  34.417  -1.672  -5.605
  679    HA   TYR  95           HA       TYR  95  36.793  -3.211  -6.351
  680   1HB   TYR  95          HB2       TYR  95  37.245  -1.040  -7.399
  681   2HB   TYR  95          HB3       TYR  95  36.909  -0.207  -5.885
  682    HD1  TYR  95           HD1      TYR  95  39.141  -2.863  -7.367
  683    HD2  TYR  95           HD2      TYR  95  38.696   0.205  -4.363
  684    HE1  TYR  95           HE1      TYR  95  41.491  -3.204  -6.676
  685    HE2  TYR  95           HE2      TYR  95  41.047  -0.122  -3.671
  686    HH   TYR  95           HH       TYR  95  43.022  -1.312  -4.027
  687    H    ASP  96           H        ASP  96  36.669  -4.497  -4.605
  688    HA   ASP  96           HA       ASP  96  37.530  -3.317  -2.081
  689   1HB   ASP  96          HB2       ASP  96  35.027  -3.453  -1.845
  690   2HB   ASP  96          HB3       ASP  96  35.117  -5.191  -2.133
  691    H    THR  97           H        THR  97  38.560  -4.979  -4.375
  692    HA   THR  97           HA       THR  97  39.780  -7.180  -2.973
  693    HB   THR  97           HB       THR  97  37.507  -8.073  -3.317
  694    HG1  THR  97           HG1      THR  97  38.101  -9.932  -4.108
  695   1HG2  THR  97          HG21      THR  97  36.827  -6.827  -5.364
  696   2HG2  THR  97          HG22      THR  97  37.983  -7.785  -6.315
  697   3HG2  THR  97          HG23      THR  97  36.599  -8.564  -5.520
  698    H    PHE  98           H        PHE  98  41.017  -8.504  -4.614
  699    HA   PHE  98           HA       PHE  98  41.559  -7.445  -7.212
  700   1HB   PHE  98          HB2       PHE  98  42.910  -5.842  -5.824
  701   2HB   PHE  98          HB3       PHE  98  43.811  -7.198  -5.164
  702    HD1  PHE  98           HD1      PHE  98  45.891  -7.677  -6.184
  703    HD2  PHE  98           HD2      PHE  98  42.813  -5.735  -8.506
  704    HE1  PHE  98           HE1      PHE  98  47.455  -7.478  -8.097
  705    HE2  PHE  98           HE2      PHE  98  44.385  -5.540 -10.417
  706    HZ   PHE  98           HZ       PHE  98  46.707  -6.412 -10.219
  707    H    CYS  99           H        CYS  99  42.777  -9.426  -4.477
  708    HA   CYS  99           HA       CYS  99  42.930 -11.820  -6.229
  709   1HB   CYS  99          HB2       CYS  99  45.051 -10.891  -4.231
  710   2HB   CYS  99          HB3       CYS  99  45.031 -12.458  -5.045
  711    HG   CYS  99           HG       CYS  99  46.866 -10.962  -6.117
  712    H    GLY 100           H        GLY 100  40.704 -11.210  -4.697
  713   1HA   GLY 100          HA2       GLY 100  40.811 -13.146  -2.439
  714   2HA   GLY 100          HA3       GLY 100  40.223 -11.499  -2.171
  715    H    ALA 101           H        ALA 101  38.208 -12.610  -1.562
  716    HA   ALA 101           HA       ALA 101  36.502 -13.967  -3.414
  717   1HB   ALA 101          HB1       ALA 101  34.703 -13.288  -1.856
  718   2HB   ALA 101          HB2       ALA 101  36.100 -13.923  -0.968
  719   3HB   ALA 101          HB3       ALA 101  35.812 -12.166  -1.045
  720    H    ILE 102           H        ILE 102  34.527 -13.001  -4.430
  721    HA   ILE 102           HA       ILE 102  34.839 -10.176  -5.236
  722    HB   ILE 102           HB       ILE 102  34.561 -10.667  -7.566
  723   1HG1  ILE 102          HG12      ILE 102  34.555 -13.630  -6.845
  724   2HG1  ILE 102          HG13      ILE 102  33.191 -12.679  -7.447
  725   1HG2  ILE 102          HG21      ILE 102  36.744 -11.491  -8.106
  726   2HG2  ILE 102          HG22      ILE 102  36.879 -10.645  -6.567
  727   3HG2  ILE 102          HG23      ILE 102  36.849 -12.419  -6.597
  728   1HD1  ILE 102          HD11      ILE 102  34.432 -12.269  -9.574
  729   2HD1  ILE 102          HD12      ILE 102  35.702 -13.381  -9.001
  730   3HD1  ILE 102          HD13      ILE 102  34.057 -13.977  -9.262
  731    H    ASP 103           H        ASP 103  32.878  -9.496  -6.526
  732    HA   ASP 103           HA       ASP 103  30.632  -9.804  -4.785
  733   1HB   ASP 103          HB2       ASP 103  29.767  -7.923  -5.921
  734   2HB   ASP 103          HB3       ASP 103  31.494  -7.655  -5.768
  735    H    LYS 104           H        LYS 104  30.992 -12.323  -6.059
  736    HA   LYS 104           HA       LYS 104  29.791 -12.845  -8.493
  737   1HB   LYS 104          HB2       LYS 104  29.420 -14.554  -6.008
  738   2HB   LYS 104          HB3       LYS 104  29.267 -15.097  -7.678
  739   1HG   LYS 104          HG2       LYS 104  31.688 -14.565  -7.992
  740   2HG   LYS 104          HG3       LYS 104  31.805 -14.201  -6.262
  741   1HD   LYS 104          HD2       LYS 104  31.050 -16.879  -7.506
  742   2HD   LYS 104          HD3       LYS 104  32.583 -16.480  -6.711
  743   1HE   LYS 104          HE2       LYS 104  31.353 -16.073  -4.570
  744   2HE   LYS 104          HE3       LYS 104  29.835 -16.495  -5.373
  745   1HZ   LYS 104          HZ1       LYS 104  32.087 -18.337  -4.886
  746   2HZ   LYS 104          HZ2       LYS 104  30.596 -18.336  -4.185
  747   3HZ   LYS 104          HZ3       LYS 104  30.753 -18.715  -5.766
  748    H    LEU 105           H        LEU 105  28.085 -12.542  -5.382
  749    HA   LEU 105           HA       LEU 105  25.495 -13.298  -6.253
  750   1HB   LEU 105          HB2       LEU 105  26.180 -13.185  -3.929
  751   2HB   LEU 105          HB3       LEU 105  26.488 -11.469  -4.013
  752    HG   LEU 105           HG       LEU 105  24.400 -12.259  -2.815
  753   1HD1  LEU 105          HD11      LEU 105  23.057 -10.356  -3.449
  754   2HD1  LEU 105          HD12      LEU 105  24.765  -9.896  -3.474
  755   3HD1  LEU 105          HD13      LEU 105  23.898 -10.201  -4.990
  756   1HD2  LEU 105          HD21      LEU 105  22.396 -12.742  -4.073
  757   2HD2  LEU 105          HD22      LEU 105  23.239 -12.570  -5.611
  758   3HD2  LEU 105          HD23      LEU 105  23.637 -13.910  -4.524
  759    H    GLU 106           H        GLU 106  27.012 -10.053  -5.936
  760    HA   GLU 106           HA       GLU 106  24.736  -8.632  -6.942
  761   1HB   GLU 106          HB2       GLU 106  27.627  -7.723  -7.071
  762   2HB   GLU 106          HB3       GLU 106  26.158  -6.742  -7.097
  763   1HG   GLU 106          HG2       GLU 106  25.695  -7.503  -4.743
  764   2HG   GLU 106          HG3       GLU 106  27.305  -8.244  -4.725
  765    H    ALA 107           H        ALA 107  27.709  -9.937  -8.468
  766    HA   ALA 107           HA       ALA 107  27.502  -8.786 -10.973
  767   1HB   ALA 107          HB1       ALA 107  28.514 -11.585 -10.325
  768   2HB   ALA 107          HB2       ALA 107  28.902 -10.622 -11.760
  769   3HB   ALA 107          HB3       ALA 107  29.453 -10.082 -10.161
  770    H    GLU 108           H        GLU 108  25.840 -11.762  -9.748
  771    HA   GLU 108           HA       GLU 108  24.589 -12.431 -12.275
  772   1HB   GLU 108          HB2       GLU 108  23.975 -13.003  -9.368
  773   2HB   GLU 108          HB3       GLU 108  22.931 -13.541 -10.663
  774   1HG   GLU 108          HG2       GLU 108  25.834 -14.388 -10.281
  775   2HG   GLU 108          HG3       GLU 108  24.382 -15.304  -9.927
  776    H    LEU 109           H        LEU 109  23.665 -10.244  -9.589
  777    HA   LEU 109           HA       LEU 109  21.007  -9.750 -10.633
  778   1HB   LEU 109          HB2       LEU 109  22.816  -8.576  -8.503
  779   2HB   LEU 109          HB3       LEU 109  21.381  -7.677  -8.984
  780    HG   LEU 109           HG       LEU 109  21.226 -10.617  -8.209
  781   1HD1  LEU 109          HD11      LEU 109  21.161  -8.185  -6.401
  782   2HD1  LEU 109          HD12      LEU 109  20.592  -9.805  -5.916
  783   3HD1  LEU 109          HD13      LEU 109  22.286  -9.546  -6.354
  784   1HD2  LEU 109          HD21      LEU 109  19.219  -8.325  -8.383
  785   2HD2  LEU 109          HD22      LEU 109  19.226  -9.845  -9.299
  786   3HD2  LEU 109          HD23      LEU 109  18.866  -9.856  -7.571
  787    H    LYS 110           H        LYS 110  24.141  -8.018 -10.870
  788    HA   LYS 110           HA       LYS 110  23.263  -5.794 -12.368
  789   1HB   LYS 110          HB2       LYS 110  25.941  -7.253 -12.200
  790   2HB   LYS 110          HB3       LYS 110  25.716  -5.648 -12.910
  791   1HG   LYS 110          HG2       LYS 110  25.235  -4.642 -10.873
  792   2HG   LYS 110          HG3       LYS 110  24.821  -6.100 -10.046
  793   1HD   LYS 110          HD2       LYS 110  27.096  -6.815  -9.900
  794   2HD   LYS 110          HD3       LYS 110  27.685  -5.541 -10.933
  795   1HE   LYS 110          HE2       LYS 110  26.978  -3.846  -9.231
  796   2HE   LYS 110          HE3       LYS 110  26.286  -5.134  -8.247
  797   1HZ   LYS 110          HZ1       LYS 110  28.304  -4.942  -7.255
  798   2HZ   LYS 110          HZ2       LYS 110  28.775  -6.012  -8.391
  799   3HZ   LYS 110          HZ3       LYS 110  29.079  -4.415  -8.624
  800    H    ASN 111           H        ASN 111  24.300  -9.071 -13.261
  801    HA   ASN 111           HA       ASN 111  24.114  -8.734 -16.122
  802   1HB   ASN 111          HB2       ASN 111  25.396 -10.525 -15.679
  803   2HB   ASN 111          HB3       ASN 111  24.656 -10.864 -14.151
  804   1HD2  ASN 111          HD21      ASN 111  22.854 -12.158 -13.891
  805   2HD2  ASN 111          HD22      ASN 111  22.617 -13.440 -15.036
  806    H    SER 112           H        SER 112  21.803  -9.774 -13.594
  807    HA   SER 112           HA       SER 112  19.819 -10.741 -15.381
  808   1HB   SER 112          HB2       SER 112  19.544  -9.692 -12.564
  809   2HB   SER 112          HB3       SER 112  18.307 -10.596 -13.449
  810    HG   SER 112           HG       SER 112  20.889 -11.502 -12.683
  811    H    GLY 113           H        GLY 113  20.476  -7.463 -14.079
  812   1HA   GLY 113          HA2       GLY 113  19.733  -6.106 -16.277
  813   2HA   GLY 113          HA3       GLY 113  18.160  -6.337 -15.522
  814    H    ALA 114           H        ALA 114  19.422  -6.063 -12.712
  815    HA   ALA 114           HA       ALA 114  18.821  -3.265 -12.543
  816   1HB   ALA 114          HB1       ALA 114  19.836  -5.275 -10.489
  817   2HB   ALA 114          HB2       ALA 114  19.517  -3.571 -10.107
  818   3HB   ALA 114          HB3       ALA 114  18.196  -4.578 -10.640
  819    H    LYS 115           H        LYS 115  20.329  -1.764 -11.255
  820    HA   LYS 115           HA       LYS 115  23.200  -2.253 -11.777
  821   1HB   LYS 115          HB2       LYS 115  23.517   0.142 -12.296
  822   2HB   LYS 115          HB3       LYS 115  22.593  -0.723 -13.524
  823   1HG   LYS 115          HG2       LYS 115  20.485   0.271 -12.689
  824   2HG   LYS 115          HG3       LYS 115  21.356   1.058 -11.372
  825   1HD   LYS 115          HD2       LYS 115  20.906   2.678 -13.084
  826   2HD   LYS 115          HD3       LYS 115  22.652   2.393 -13.011
  827   1HE   LYS 115          HE2       LYS 115  22.485   0.885 -14.985
  828   2HE   LYS 115          HE3       LYS 115  20.735   1.130 -15.031
  829   1HZ   LYS 115          HZ1       LYS 115  22.765   3.251 -15.446
  830   2HZ   LYS 115          HZ2       LYS 115  21.873   2.549 -16.614
  831   3HZ   LYS 115          HZ3       LYS 115  21.145   3.477 -15.494
  832    H    GLN 116           H        GLN 116  24.448  -1.757 -10.015
  833    HA   GLN 116           HA       GLN 116  23.117  -1.042  -7.506
  834   1HB   GLN 116          HB2       GLN 116  25.020  -2.589  -7.488
  835   2HB   GLN 116          HB3       GLN 116  26.044  -1.338  -8.219
  836   1HG   GLN 116          HG2       GLN 116  25.715   0.108  -6.228
  837   2HG   GLN 116          HG3       GLN 116  24.631  -1.098  -5.530
  838   1HE2  GLN 116          HE21      GLN 116  26.227  -0.750  -3.717
  839   2HE2  GLN 116          HE22      GLN 116  27.622  -1.800  -3.664
  840    H    THR 117           H        THR 117  22.717   1.066  -6.947
  841    HA   THR 117           HA       THR 117  23.933   3.247  -8.554
  842    HB   THR 117           HB       THR 117  21.843   3.300  -6.334
  843    HG1  THR 117           HG1      THR 117  21.407   2.187  -8.393
  844   1HG2  THR 117          HG21      THR 117  22.723   5.404  -8.373
  845   2HG2  THR 117          HG22      THR 117  21.293   5.540  -7.330
  846   3HG2  THR 117          HG23      THR 117  22.905   5.506  -6.612
  847    H    GLY 118           H        GLY 118  25.157   4.946  -7.547
  848   1HA   GLY 118          HA2       GLY 118  26.560   5.949  -6.050
  849   2HA   GLY 118          HA3       GLY 118  25.691   5.101  -4.772
  850    H    GLU 119           H        GLU 119  26.791   3.703  -3.654
  851    HA   GLU 119           HA       GLU 119  28.467   1.676  -4.775
  852   1HB   GLU 119          HB2       GLU 119  30.464   2.027  -3.509
  853   2HB   GLU 119          HB3       GLU 119  30.213   3.443  -4.518
  854   1HG   GLU 119          HG2       GLU 119  29.416   4.735  -2.589
  855   2HG   GLU 119          HG3       GLU 119  29.465   3.309  -1.560
  856    H    THR 120           H        THR 120  29.158   0.199  -2.734
  857    HA   THR 120           HA       THR 120  26.793  -0.424  -1.403
  858    HB   THR 120           HB       THR 120  29.574  -1.176  -0.438
  859    HG1  THR 120           HG1      THR 120  29.412  -2.820  -2.053
  860   1HG2  THR 120          HG21      THR 120  26.878  -2.606  -0.563
  861   2HG2  THR 120          HG22      THR 120  28.401  -3.380  -0.118
  862   3HG2  THR 120          HG23      THR 120  27.736  -2.085   0.901
  863    H    LEU 121           H        LEU 121  25.822   0.238   0.424
  864    HA   LEU 121           HA       LEU 121  26.815   2.619   1.799
  865   1HB   LEU 121          HB2       LEU 121  24.380   1.856   1.006
  866   2HB   LEU 121          HB3       LEU 121  24.339   1.068   2.569
  867    HG   LEU 121           HG       LEU 121  24.803   4.003   2.075
  868   1HD1  LEU 121          HD11      LEU 121  22.256   2.739   3.103
  869   2HD1  LEU 121          HD12      LEU 121  22.554   4.446   2.667
  870   3HD1  LEU 121          HD13      LEU 121  22.536   3.209   1.411
  871   1HD2  LEU 121          HD21      LEU 121  25.684   3.723   4.225
  872   2HD2  LEU 121          HD22      LEU 121  24.056   4.268   4.508
  873   3HD2  LEU 121          HD23      LEU 121  24.418   2.544   4.692
  874    H    LYS 122           H        LYS 122  26.969   2.577   4.280
  875    HA   LYS 122           HA       LYS 122  27.767  -0.081   5.368
  876   1HB   LYS 122          HB2       LYS 122  29.208   2.559   5.889
  877   2HB   LYS 122          HB3       LYS 122  29.570   0.997   6.571
  878   1HG   LYS 122          HG2       LYS 122  31.209   1.124   4.982
  879   2HG   LYS 122          HG3       LYS 122  29.975   0.236   4.082
  880   1HD   LYS 122          HD2       LYS 122  29.267   2.394   3.016
  881   2HD   LYS 122          HD3       LYS 122  30.506   3.250   3.939
  882   1HE   LYS 122          HE2       LYS 122  32.280   2.153   2.748
  883   2HE   LYS 122          HE3       LYS 122  31.171   0.948   2.066
  884   1HZ   LYS 122          HZ1       LYS 122  30.124   2.619   0.777
  885   2HZ   LYS 122          HZ2       LYS 122  31.046   3.834   1.422
  886   3HZ   LYS 122          HZ3       LYS 122  31.707   2.712   0.435
  887    H    ILE 123           H        ILE 123  27.052  -0.426   7.467
  888    HA   ILE 123           HA       ILE 123  25.675   1.753   8.914
  889    HB   ILE 123           HB       ILE 123  23.934  -0.132   9.399
  890   1HG1  ILE 123          HG12      ILE 123  23.411  -1.575   7.481
  891   2HG1  ILE 123          HG13      ILE 123  24.870  -1.118   6.650
  892   1HG2  ILE 123          HG21      ILE 123  23.946   1.226   6.675
  893   2HG2  ILE 123          HG22      ILE 123  22.534   0.672   7.598
  894   3HG2  ILE 123          HG23      ILE 123  23.510   2.008   8.208
  895   1HD1  ILE 123          HD11      ILE 123  24.841  -3.385   7.806
  896   2HD1  ILE 123          HD12      ILE 123  26.230  -2.368   8.185
  897   3HD1  ILE 123          HD13      ILE 123  24.892  -2.525   9.355
  898    H    ASN 124           H        ASN 124  25.518   1.368  11.203
  899    HA   ASN 124           HA       ASN 124  26.557  -1.058  12.325
  900   1HB   ASN 124          HB2       ASN 124  28.588   0.758  11.637
  901   2HB   ASN 124          HB3       ASN 124  28.321   1.116  13.340
  902   1HD2  ASN 124          HD22      ASN 124  28.386  -1.732  11.156
  903   2HD2  ASN 124          HD21      ASN 124  29.208  -2.798  12.274
  904    H    ILE 125           H        ILE 125  24.239   0.887  12.550
  905    HA   ILE 125           HA       ILE 125  24.459   2.111  15.155
  906    HB   ILE 125           HB       ILE 125  22.065   2.783  14.679
  907   1HG1  ILE 125          HG12      ILE 125  21.219   2.648  12.396
  908   2HG1  ILE 125          HG13      ILE 125  22.564   1.638  11.888
  909   1HG2  ILE 125          HG21      ILE 125  24.033   4.185  14.188
  910   2HG2  ILE 125          HG22      ILE 125  24.145   3.476  12.562
  911   3HG2  ILE 125          HG23      ILE 125  22.728   4.437  13.023
  912   1HD1  ILE 125          HD11      ILE 125  20.481   0.370  12.218
  913   2HD1  ILE 125          HD12      ILE 125  21.749  -0.204  13.306
  914   3HD1  ILE 125          HD13      ILE 125  20.442   0.839  13.926
  915    H    LEU 126           H        LEU 126  24.770  -0.796  15.225
  916    HA   LEU 126           HA       LEU 126  22.801  -1.409  17.309
  917   1HB   LEU 126          HB2       LEU 126  21.674  -2.312  15.342
  918   2HB   LEU 126          HB3       LEU 126  23.145  -3.121  14.811
  919    HG   LEU 126           HG       LEU 126  23.070  -4.600  16.820
  920   1HD1  LEU 126          HD11      LEU 126  20.401  -3.231  17.382
  921   2HD1  LEU 126          HD12      LEU 126  20.995  -4.704  18.178
  922   3HD1  LEU 126          HD13      LEU 126  21.847  -3.177  18.413
  923   1HD2  LEU 126          HD21      LEU 126  22.068  -5.310  14.694
  924   2HD2  LEU 126          HD22      LEU 126  21.180  -5.966  16.077
  925   3HD2  LEU 126          HD23      LEU 126  20.519  -4.587  15.173
  926    H    ASP 127           H        ASP 127  25.423  -2.905  15.279
  927    HA   ASP 127           HA       ASP 127  27.191  -3.281  17.550
  928   1HB   ASP 127          HB2       ASP 127  25.531  -5.154  17.812
  929   2HB   ASP 127          HB3       ASP 127  25.897  -5.677  16.169
  930    H    HIS 128           H        HIS 128  29.188  -4.414  16.728
  931    HA   HIS 128           HA       HIS 128  30.108  -3.427  14.197
  932   1HB   HIS 128          HB2       HIS 128  32.137  -4.501  14.683
  933   2HB   HIS 128          HB3       HIS 128  31.544  -3.896  16.218
  934    HD1  HIS 128           HD1      HIS 128  30.000  -6.169  17.542
  935    HD2  HIS 128           HD2      HIS 128  33.170  -6.832  14.833
  936    HE1  HIS 128           HE1      HIS 128  30.855  -8.517  17.992
  937    H    ASP 129           H        ASP 129  30.974  -4.892  12.440
  938    HA   ASP 129           HA       ASP 129  29.994  -7.564  12.281
  939   1HB   ASP 129          HB2       ASP 129  28.200  -5.614  11.194
  940   2HB   ASP 129          HB3       ASP 129  28.968  -6.329   9.811
  941    H    ILE 130           H        ILE 130  30.641  -5.053   9.875
  942    HA   ILE 130           HA       ILE 130  33.339  -6.120   9.287
  943    HB   ILE 130           HB       ILE 130  31.017  -5.943   7.341
  944   1HG1  ILE 130          HG12      ILE 130  31.268  -8.115   8.412
  945   2HG1  ILE 130          HG13      ILE 130  31.606  -8.197   6.701
  946   1HG2  ILE 130          HG21      ILE 130  32.748  -4.800   6.136
  947   2HG2  ILE 130          HG22      ILE 130  33.963  -6.010   6.598
  948   3HG2  ILE 130          HG23      ILE 130  32.640  -6.437   5.493
  949   1HD1  ILE 130          HD11      ILE 130  34.058  -8.266   7.161
  950   2HD1  ILE 130          HD12      ILE 130  33.726  -8.205   8.904
  951   3HD1  ILE 130          HD13      ILE 130  33.181  -9.581   7.950
  952    HA   PRO 131           HA       PRO 131  33.273  -1.765   7.479
  953   1HB   PRO 131          HB2       PRO 131  31.203  -0.012   7.809
  954   2HB   PRO 131          HB3       PRO 131  31.263  -1.197   6.463
  955   1HG   PRO 131          HG2       PRO 131  29.847  -1.507   9.142
  956   2HG   PRO 131          HG3       PRO 131  29.158  -1.739   7.531
  957   1HD   PRO 131          HD2       PRO 131  30.035  -3.850   8.889
  958   2HD   PRO 131          HD3       PRO 131  30.433  -3.723   7.152
  959    H    GLU 132           H        GLU 132  31.265  -1.899  10.387
  960    HA   GLU 132           HA       GLU 132  31.556  -1.275  12.529
  961   1HB   GLU 132          HB2       GLU 132  33.864  -2.354  12.029
  962   2HB   GLU 132          HB3       GLU 132  34.485  -0.703  12.132
  963   1HG   GLU 132          HG2       GLU 132  33.494  -0.539  14.446
  964   2HG   GLU 132          HG3       GLU 132  32.902  -2.188  14.282
  965    H    ASP 133           H        ASP 133  31.133   0.744  10.221
  966    HA   ASP 133           HA       ASP 133  31.217   3.190  11.861
  967   1HB   ASP 133          HB2       ASP 133  33.404   3.213  10.807
  968   2HB   ASP 133          HB3       ASP 133  32.697   2.874   9.227
  969    HA   PRO 134           HA       PRO 134  27.344   3.184   9.391
  970   1HB   PRO 134          HB2       PRO 134  26.930   5.765  10.871
  971   2HB   PRO 134          HB3       PRO 134  25.801   4.396  10.664
  972   1HG   PRO 134          HG2       PRO 134  27.087   4.834  13.033
  973   2HG   PRO 134          HG3       PRO 134  26.846   3.172  12.412
  974   1HD   PRO 134          HD2       PRO 134  29.322   4.902  12.226
  975   2HD   PRO 134          HD3       PRO 134  29.184   3.177  12.670
  976    H    ALA 135           H        ALA 135  26.619   4.469   7.602
  977    HA   ALA 135           HA       ALA 135  28.113   6.947   6.937
  978   1HB   ALA 135          HB1       ALA 135  28.493   6.096   4.654
  979   2HB   ALA 135          HB2       ALA 135  29.295   5.068   5.854
  980   3HB   ALA 135          HB3       ALA 135  27.774   4.535   5.102
  981    H    GLU 136           H        GLU 136  25.573   7.024   8.023
  982    HA   GLU 136           HA       GLU 136  23.491   6.805   6.106
  983   1HB   GLU 136          HB2       GLU 136  22.084   7.921   7.646
  984   2HB   GLU 136          HB3       GLU 136  23.137   6.834   8.545
  985   1HG   GLU 136          HG2       GLU 136  24.564   8.764   9.204
  986   2HG   GLU 136          HG3       GLU 136  23.508   9.856   8.302
  987    H    GLU 137           H        GLU 137  25.974   9.190   6.268
  988    HA   GLU 137           HA       GLU 137  24.667  11.372   4.940
  989   1HB   GLU 137          HB2       GLU 137  27.544  10.364   4.826
  990   2HB   GLU 137          HB3       GLU 137  27.001  11.897   4.145
  991   1HG   GLU 137          HG2       GLU 137  26.870  11.140   7.099
  992   2HG   GLU 137          HG3       GLU 137  28.094  12.153   6.352
  993    H    TRP 138           H        TRP 138  25.736   8.202   3.790
  994    HA   TRP 138           HA       TRP 138  25.713   8.598   0.976
  995   1HB   TRP 138          HB2       TRP 138  26.302   6.557   2.445
  996   2HB   TRP 138          HB3       TRP 138  24.636   6.202   2.499
  997    HD1  TRP 138           HD1      TRP 138  27.607   5.551   0.463
  998    HE1  TRP 138           HE1      TRP 138  26.972   3.974  -1.440
  999    HE3  TRP 138           HE3      TRP 138  22.496   5.993   0.600
 1000    HZ2  TRP 138           HZ2      TRP 138  24.615   3.275  -2.969
 1001    HZ3  TRP 138           HZ3      TRP 138  21.097   4.776  -1.018
 1002    HH2  TRP 138           HH2      TRP 138  22.141   3.441  -2.833
 1003    H    LEU 139           H        LEU 139  23.254   7.534   3.223
 1004    HA   LEU 139           HA       LEU 139  20.996   7.317   1.615
 1005   1HB   LEU 139          HB2       LEU 139  21.532   7.082   4.307
 1006   2HB   LEU 139          HB3       LEU 139  20.645   8.569   4.338
 1007    HG   LEU 139           HG       LEU 139  19.121   6.839   4.803
 1008   1HD1  LEU 139          HD11      LEU 139  18.401   8.692   3.275
 1009   2HD1  LEU 139          HD12      LEU 139  18.654   7.593   1.902
 1010   3HD1  LEU 139          HD13      LEU 139  17.431   7.213   3.142
 1011   1HD2  LEU 139          HD21      LEU 139  19.901   5.442   2.204
 1012   2HD2  LEU 139          HD22      LEU 139  20.361   4.929   3.842
 1013   3HD2  LEU 139          HD23      LEU 139  18.661   4.929   3.365
 1014    H    GLY 140           H        GLY 140  21.960  10.186   3.503
 1015   1HA   GLY 140          HA2       GLY 140  20.056  12.003   2.499
 1016   2HA   GLY 140          HA3       GLY 140  21.644  12.451   3.144
 1017    H    SER 141           H        SER 141  23.416  11.353   1.187
 1018    HA   SER 141           HA       SER 141  23.433  13.293  -0.800
 1019   1HB   SER 141          HB2       SER 141  24.760  10.586  -0.293
 1020   2HB   SER 141          HB3       SER 141  25.203  11.650  -1.574
 1021    HG   SER 141           HG       SER 141  25.421  11.958   1.199
 1022    H    TRP 142           H        TRP 142  22.895   9.762  -1.066
 1023    HA   TRP 142           HA       TRP 142  22.178   9.575  -3.743
 1024   1HB   TRP 142          HB2       TRP 142  22.812   7.722  -2.345
 1025   2HB   TRP 142          HB3       TRP 142  21.420   7.970  -1.307
 1026    HD1  TRP 142           HD1      TRP 142  22.270   6.645  -4.811
 1027    HE1  TRP 142           HE1      TRP 142  20.359   5.094  -5.589
 1028    HE3  TRP 142           HE3      TRP 142  19.179   7.141  -0.784
 1029    HZ2  TRP 142           HZ2      TRP 142  17.828   4.131  -4.526
 1030    HZ3  TRP 142           HZ3      TRP 142  17.027   5.901  -0.680
 1031    HH2  TRP 142           HH2      TRP 142  16.350   4.395  -2.532
 1032    H    VAL 143           H        VAL 143  20.011  10.197  -0.916
 1033    HA   VAL 143           HA       VAL 143  17.560  10.279  -2.331
 1034    HB   VAL 143           HB       VAL 143  18.624  11.493   0.228
 1035   1HG1  VAL 143          HG11      VAL 143  17.079  13.221  -0.493
 1036   2HG1  VAL 143          HG12      VAL 143  15.832  11.994  -0.844
 1037   3HG1  VAL 143          HG13      VAL 143  16.376  12.296   0.827
 1038   1HG2  VAL 143          HG21      VAL 143  17.077   9.955   1.264
 1039   2HG2  VAL 143          HG22      VAL 143  16.312   9.592  -0.298
 1040   3HG2  VAL 143          HG23      VAL 143  17.963   9.052   0.029
 1041    H    ASN 144           H        ASN 144  19.765  13.069  -1.511
 1042    HA   ASN 144           HA       ASN 144  18.089  14.794  -3.051
 1043   1HB   ASN 144          HB2       ASN 144  19.166  16.492  -2.163
 1044   2HB   ASN 144          HB3       ASN 144  19.869  15.300  -1.084
 1045   1HD2  ASN 144          HD22      ASN 144  21.927  14.150  -2.363
 1046   2HD2  ASN 144          HD21      ASN 144  23.066  15.350  -2.934
 1047    H    LEU 145           H        LEU 145  20.521  12.617  -4.066
 1048    HA   LEU 145           HA       LEU 145  21.093  13.953  -6.606
 1049   1HB   LEU 145          HB2       LEU 145  21.956  11.456  -5.205
 1050   2HB   LEU 145          HB3       LEU 145  21.797  11.306  -6.945
 1051    HG   LEU 145           HG       LEU 145  23.315  13.180  -7.330
 1052   1HD1  LEU 145          HD11      LEU 145  22.942  14.514  -5.283
 1053   2HD1  LEU 145          HD12      LEU 145  23.692  13.234  -4.306
 1054   3HD1  LEU 145          HD13      LEU 145  24.657  14.140  -5.492
 1055   1HD2  LEU 145          HD21      LEU 145  24.444  11.071  -5.433
 1056   2HD2  LEU 145          HD22      LEU 145  24.192  10.877  -7.182
 1057   3HD2  LEU 145          HD23      LEU 145  25.380  12.048  -6.588
 1058    H    LEU 146           H        LEU 146  19.114  11.066  -5.557
 1059    HA   LEU 146           HA       LEU 146  18.197  10.609  -8.209
 1060   1HB   LEU 146          HB2       LEU 146  16.952   8.905  -7.332
 1061   2HB   LEU 146          HB3       LEU 146  18.409   8.938  -6.378
 1062    HG   LEU 146           HG       LEU 146  16.829  10.285  -4.674
 1063   1HD1  LEU 146          HD11      LEU 146  14.824   8.557  -6.200
 1064   2HD1  LEU 146          HD12      LEU 146  14.528   9.373  -4.654
 1065   3HD1  LEU 146          HD13      LEU 146  14.780  10.324  -6.110
 1066   1HD2  LEU 146          HD21      LEU 146  16.697   7.273  -5.071
 1067   2HD2  LEU 146          HD22      LEU 146  17.957   8.166  -4.198
 1068   3HD2  LEU 146          HD23      LEU 146  16.308   8.144  -3.572
 1069    H    LYS 147           H        LYS 147  16.953  12.514  -5.532
 1070    HA   LYS 147           HA       LYS 147  14.366  13.110  -6.545
 1071   1HB   LYS 147          HB2       LYS 147  16.286  14.452  -4.613
 1072   2HB   LYS 147          HB3       LYS 147  14.810  15.272  -5.129
 1073   1HG   LYS 147          HG2       LYS 147  13.438  13.340  -4.395
 1074   2HG   LYS 147          HG3       LYS 147  14.896  12.521  -3.810
 1075   1HD   LYS 147          HD2       LYS 147  15.290  14.344  -2.196
 1076   2HD   LYS 147          HD3       LYS 147  13.889  15.234  -2.830
 1077   1HE   LYS 147          HE2       LYS 147  12.449  13.323  -2.191
 1078   2HE   LYS 147          HE3       LYS 147  13.838  12.484  -1.504
 1079   1HZ   LYS 147          HZ1       LYS 147  12.647  13.593   0.225
 1080   2HZ   LYS 147          HZ2       LYS 147  14.062  14.392   0.050
 1081   3HZ   LYS 147          HZ3       LYS 147  12.680  15.039  -0.544
  Start of MODEL    9
    1   1H    MET   1          H1        MET   1   1.975  -2.021   1.968
    2   2H    MET   1          H2        MET   1   1.461  -3.147   0.883
    3   3H    MET   1          H3        MET   1   3.072  -2.944   1.183
    4    HA   MET   1           HA       MET   1   2.447  -1.984  -0.925
    5   1HB   MET   1          HB2       MET   1   0.138  -1.335  -0.270
    6   2HB   MET   1          HB3       MET   1   0.787  -0.080   0.794
    7   1HG   MET   1          HG2       MET   1   1.817   1.040  -1.164
    8   2HG   MET   1          HG3       MET   1   1.206  -0.239  -2.219
    9   1HE   MET   1          HE1       MET   1   0.188   1.595  -3.822
   10   2HE   MET   1          HE2       MET   1  -0.895   2.895  -3.278
   11   3HE   MET   1          HE3       MET   1   0.801   2.873  -2.747
   12    H    ALA   2           H        ALA   2   4.305  -0.966  -1.534
   13    HA   ALA   2           HA       ALA   2   5.592   1.048   0.171
   14   1HB   ALA   2          HB1       ALA   2   6.777  -1.705  -0.442
   15   2HB   ALA   2          HB2       ALA   2   7.684  -0.350   0.243
   16   3HB   ALA   2          HB3       ALA   2   6.359  -1.087   1.166
   17    H    ASP   3           H        ASP   3   7.499   1.937  -0.912
   18    HA   ASP   3           HA       ASP   3   7.504   1.675  -3.861
   19   1HB   ASP   3          HB2       ASP   3   7.389   3.960  -2.672
   20   2HB   ASP   3          HB3       ASP   3   9.000   3.631  -2.081
   21    H    ILE   4           H        ILE   4   9.309   0.901  -0.948
   22    HA   ILE   4           HA       ILE   4  11.573  -0.140  -2.585
   23    HB   ILE   4           HB       ILE   4  11.745   1.083   0.194
   24   1HG1  ILE   4          HG12      ILE   4  12.342   2.471  -2.447
   25   2HG1  ILE   4          HG13      ILE   4  11.043   2.881  -1.330
   26   1HG2  ILE   4          HG21      ILE   4  14.154   1.096  -0.235
   27   2HG2  ILE   4          HG22      ILE   4  13.524  -0.530  -0.429
   28   3HG2  ILE   4          HG23      ILE   4  13.890   0.438  -1.866
   29   1HD1  ILE   4          HD11      ILE   4  14.002   3.247  -0.852
   30   2HD1  ILE   4          HD12      ILE   4  12.766   4.487  -1.095
   31   3HD1  ILE   4          HD13      ILE   4  12.724   3.494   0.372
   32    H    THR   5           H        THR   5  11.921  -2.295  -2.277
   33    HA   THR   5           HA       THR   5  10.750  -3.637   0.092
   34    HB   THR   5           HB       THR   5  10.274  -4.621  -2.093
   35    HG1  THR   5           HG1      THR   5  10.439  -6.066  -0.447
   36   1HG2  THR   5          HG21      THR   5  12.133  -3.982  -3.468
   37   2HG2  THR   5          HG22      THR   5  13.245  -4.975  -2.506
   38   3HG2  THR   5          HG23      THR   5  11.962  -5.740  -3.458
   39    H    LEU   6           H        LEU   6  12.056  -4.093   1.824
   40    HA   LEU   6           HA       LEU   6  15.001  -3.633   1.608
   41   1HB   LEU   6          HB2       LEU   6  13.090  -3.951   3.946
   42   2HB   LEU   6          HB3       LEU   6  14.812  -4.043   4.136
   43    HG   LEU   6           HG       LEU   6  13.854  -1.921   4.827
   44   1HD1  LEU   6          HD11      LEU   6  15.528  -0.444   3.840
   45   2HD1  LEU   6          HD12      LEU   6  16.212  -2.025   4.227
   46   3HD1  LEU   6          HD13      LEU   6  15.818  -1.614   2.540
   47   1HD2  LEU   6          HD21      LEU   6  13.360  -1.278   1.898
   48   2HD2  LEU   6          HD22      LEU   6  12.099  -1.635   3.099
   49   3HD2  LEU   6          HD23      LEU   6  13.126  -0.203   3.289
   50    H    ILE   7           H        ILE   7  15.889  -5.477   0.807
   51    HA   ILE   7           HA       ILE   7  14.662  -8.091   1.458
   52    HB   ILE   7           HB       ILE   7  16.821  -7.498  -0.605
   53   1HG1  ILE   7          HG12      ILE   7  13.838  -7.790  -1.188
   54   2HG1  ILE   7          HG13      ILE   7  14.636  -6.226  -1.073
   55   1HG2  ILE   7          HG21      ILE   7  16.140  -9.702  -1.493
   56   2HG2  ILE   7          HG22      ILE   7  16.562  -9.868   0.207
   57   3HG2  ILE   7          HG23      ILE   7  14.851  -9.816  -0.278
   58   1HD1  ILE   7          HD11      ILE   7  16.121  -6.737  -2.926
   59   2HD1  ILE   7          HD12      ILE   7  15.399  -8.352  -3.104
   60   3HD1  ILE   7          HD13      ILE   7  14.422  -6.910  -3.399
   61    H    SER   8           H        SER   8  15.376  -8.190   3.608
   62    HA   SER   8           HA       SER   8  18.253  -7.954   4.141
   63   1HB   SER   8          HB2       SER   8  16.161  -8.262   6.266
   64   2HB   SER   8          HB3       SER   8  17.634  -7.282   6.267
   65    HG   SER   8           HG       SER   8  15.074  -6.779   5.366
   66    H    GLY   9           H        GLY   9  19.355  -9.463   5.562
   67   1HA   GLY   9          HA2       GLY   9  19.592 -11.390   6.857
   68   2HA   GLY   9          HA3       GLY   9  17.926 -11.851   6.477
   69    H    SER  10           H        SER  10  21.243 -11.740   5.196
   70    HA   SER  10           HA       SER  10  21.057 -12.559   2.698
   71   1HB   SER  10          HB2       SER  10  23.288 -13.874   4.129
   72   2HB   SER  10          HB3       SER  10  23.325 -12.638   2.869
   73    HG   SER  10           HG       SER  10  24.169 -11.980   4.902
   74    H    THR  11           H        THR  11  21.168 -14.907   5.387
   75    HA   THR  11           HA       THR  11  20.095 -16.978   3.555
   76    HB   THR  11           HB       THR  11  22.357 -17.283   5.555
   77    HG1  THR  11           HG1      THR  11  23.359 -16.872   3.763
   78   1HG2  THR  11          HG21      THR  11  22.487 -19.649   4.656
   79   2HG2  THR  11          HG22      THR  11  21.142 -19.364   5.754
   80   3HG2  THR  11          HG23      THR  11  20.845 -19.432   4.009
   81    H    LEU  12           H        LEU  12  18.397 -15.392   4.629
   82    HA   LEU  12           HA       LEU  12  16.683 -15.011   5.978
   83   1HB   LEU  12          HB2       LEU  12  16.763 -17.999   6.494
   84   2HB   LEU  12          HB3       LEU  12  15.415 -16.936   6.885
   85    HG   LEU  12           HG       LEU  12  16.456 -17.452   4.069
   86   1HD1  LEU  12          HD11      LEU  12  15.381 -19.429   5.068
   87   2HD1  LEU  12          HD12      LEU  12  13.945 -18.462   5.466
   88   3HD1  LEU  12          HD13      LEU  12  14.393 -18.747   3.769
   89   1HD2  LEU  12          HD21      LEU  12  14.013 -15.896   5.030
   90   2HD2  LEU  12          HD22      LEU  12  15.424 -15.231   4.178
   91   3HD2  LEU  12          HD23      LEU  12  14.343 -16.344   3.344
   92    H    GLY  13           H        GLY  13  19.202 -14.477   7.057
   93   1HA   GLY  13          HA2       GLY  13  19.234 -15.171   9.886
   94   2HA   GLY  13          HA3       GLY  13  20.310 -14.055   9.036
   95    H    GLY  14           H        GLY  14  17.121 -13.208   8.289
   96   1HA   GLY  14          HA2       GLY  14  15.569 -11.746   9.129
   97   2HA   GLY  14          HA3       GLY  14  16.436 -11.694  10.663
   98    H    ALA  15           H        ALA  15  18.468 -10.413  10.703
   99    HA   ALA  15           HA       ALA  15  19.298  -8.341  10.815
  100   1HB   ALA  15          HB1       ALA  15  19.072  -8.374   7.784
  101   2HB   ALA  15          HB2       ALA  15  20.151  -7.358   8.756
  102   3HB   ALA  15          HB3       ALA  15  20.380  -9.116   8.735
  103    H    GLU  16           H        GLU  16  16.230  -8.589  10.736
  104    HA   GLU  16           HA       GLU  16  15.182  -6.415   9.300
  105   1HB   GLU  16          HB2       GLU  16  14.035  -7.865  11.714
  106   2HB   GLU  16          HB3       GLU  16  13.136  -6.752  10.669
  107   1HG   GLU  16          HG2       GLU  16  13.661  -8.226   8.705
  108   2HG   GLU  16          HG3       GLU  16  14.391  -9.391   9.816
  109    H    TYR  17           H        TYR  17  16.656  -6.473  12.511
  110    HA   TYR  17           HA       TYR  17  15.598  -4.051  13.549
  111   1HB   TYR  17          HB2       TYR  17  16.908  -5.709  14.837
  112   2HB   TYR  17          HB3       TYR  17  18.349  -5.316  13.915
  113    HD1  TYR  17           HD1      TYR  17  19.505  -3.112  14.240
  114    HD2  TYR  17           HD2      TYR  17  16.107  -4.275  16.633
  115    HE1  TYR  17           HE1      TYR  17  20.130  -1.422  15.927
  116    HE2  TYR  17           HE2      TYR  17  16.711  -2.568  18.322
  117    HH   TYR  17           HH       TYR  17  19.588  -0.442  17.978
  118    H    VAL  18           H        VAL  18  18.452  -4.646  11.422
  119    HA   VAL  18           HA       VAL  18  19.185  -1.819  11.362
  120    HB   VAL  18           HB       VAL  18  20.088  -4.153   9.605
  121   1HG1  VAL  18          HG11      VAL  18  22.079  -2.769   9.169
  122   2HG1  VAL  18          HG12      VAL  18  20.620  -1.950   8.606
  123   3HG1  VAL  18          HG13      VAL  18  21.389  -1.440  10.126
  124   1HG2  VAL  18          HG21      VAL  18  21.336  -3.018  12.150
  125   2HG2  VAL  18          HG22      VAL  18  20.636  -4.642  11.958
  126   3HG2  VAL  18          HG23      VAL  18  22.101  -4.209  11.081
  127    H    ALA  19           H        ALA  19  17.381  -4.150   9.320
  128    HA   ALA  19           HA       ALA  19  16.976  -2.432   7.106
  129   1HB   ALA  19          HB1       ALA  19  15.087  -4.577   8.125
  130   2HB   ALA  19          HB2       ALA  19  15.229  -3.953   6.473
  131   3HB   ALA  19          HB3       ALA  19  16.566  -4.886   7.180
  132    H    GLU  20           H        GLU  20  15.102  -2.734  10.173
  133    HA   GLU  20           HA       GLU  20  13.008  -0.969   9.378
  134   1HB   GLU  20          HB2       GLU  20  12.955  -2.623  11.272
  135   2HB   GLU  20          HB3       GLU  20  14.026  -1.555  12.191
  136   1HG   GLU  20          HG2       GLU  20  12.312   0.249  12.039
  137   2HG   GLU  20          HG3       GLU  20  11.277  -0.812  11.086
  138    H    HIS  21           H        HIS  21  16.166  -0.398  11.022
  139    HA   HIS  21           HA       HIS  21  15.762   2.392  11.538
  140   1HB   HIS  21          HB2       HIS  21  18.181   0.575  11.256
  141   2HB   HIS  21          HB3       HIS  21  18.374   2.305  11.401
  142    HD1  HIS  21           HD1      HIS  21  16.989  -0.668  13.449
  143    HD2  HIS  21           HD2      HIS  21  18.011   3.404  13.810
  144    HE1  HIS  21           HE1      HIS  21  16.836  -0.102  15.933
  145    H    LEU  22           H        LEU  22  17.330   0.651   8.844
  146    HA   LEU  22           HA       LEU  22  17.924   2.832   7.152
  147   1HB   LEU  22          HB2       LEU  22  17.178  -0.076   6.708
  148   2HB   LEU  22          HB3       LEU  22  17.443   0.966   5.339
  149    HG   LEU  22           HG       LEU  22  19.503   0.598   7.573
  150   1HD1  LEU  22          HD11      LEU  22  20.612  -1.047   6.156
  151   2HD1  LEU  22          HD12      LEU  22  18.978  -1.574   6.515
  152   3HD1  LEU  22          HD13      LEU  22  19.336  -0.883   4.918
  153   1HD2  LEU  22          HD21      LEU  22  19.904   2.612   6.242
  154   2HD2  LEU  22          HD22      LEU  22  21.098   1.394   5.807
  155   3HD2  LEU  22          HD23      LEU  22  19.716   1.701   4.734
  156    H    ALA  23           H        ALA  23  15.002   0.766   7.133
  157    HA   ALA  23           HA       ALA  23  13.494   2.142   5.258
  158   1HB   ALA  23          HB1       ALA  23  12.549   0.716   7.773
  159   2HB   ALA  23          HB2       ALA  23  11.509   1.208   6.439
  160   3HB   ALA  23          HB3       ALA  23  12.782   0.006   6.158
  161    H    GLU  24           H        GLU  24  13.778   2.948   8.788
  162    HA   GLU  24           HA       GLU  24  11.878   5.003   8.839
  163   1HB   GLU  24          HB2       GLU  24  13.364   3.936  10.721
  164   2HB   GLU  24          HB3       GLU  24  14.504   5.216  10.359
  165   1HG   GLU  24          HG2       GLU  24  12.747   6.897  10.761
  166   2HG   GLU  24          HG3       GLU  24  11.581   5.622  11.117
  167    H    LYS  25           H        LYS  25  15.395   5.236   8.129
  168    HA   LYS  25           HA       LYS  25  15.479   8.001   7.513
  169   1HB   LYS  25          HB2       LYS  25  17.075   5.700   6.289
  170   2HB   LYS  25          HB3       LYS  25  17.476   7.380   6.148
  171   1HG   LYS  25          HG2       LYS  25  17.345   5.741   8.730
  172   2HG   LYS  25          HG3       LYS  25  18.789   6.222   7.905
  173   1HD   LYS  25          HD2       LYS  25  16.828   8.016   9.323
  174   2HD   LYS  25          HD3       LYS  25  18.442   7.592   9.876
  175   1HE   LYS  25          HE2       LYS  25  19.482   8.840   8.062
  176   2HE   LYS  25          HE3       LYS  25  17.909   9.133   7.298
  177   1HZ   LYS  25          HZ1       LYS  25  18.649  11.051   8.563
  178   2HZ   LYS  25          HZ2       LYS  25  17.247  10.447   9.169
  179   3HZ   LYS  25          HZ3       LYS  25  18.676  10.188   9.950
  180    H    LEU  26           H        LEU  26  14.776   5.231   5.378
  181    HA   LEU  26           HA       LEU  26  14.441   6.837   3.034
  182   1HB   LEU  26          HB2       LEU  26  13.756   4.006   3.804
  183   2HB   LEU  26          HB3       LEU  26  12.890   4.704   2.450
  184    HG   LEU  26           HG       LEU  26  14.728   3.482   1.603
  185   1HD1  LEU  26          HD11      LEU  26  15.666   6.345   1.261
  186   2HD1  LEU  26          HD12      LEU  26  15.505   5.045   0.063
  187   3HD1  LEU  26          HD13      LEU  26  14.069   5.838   0.670
  188   1HD2  LEU  26          HD21      LEU  26  16.205   3.488   3.545
  189   2HD2  LEU  26          HD22      LEU  26  17.071   3.948   2.086
  190   3HD2  LEU  26          HD23      LEU  26  16.606   5.193   3.267
  191    H    GLU  27           H        GLU  27  12.098   5.940   5.610
  192    HA   GLU  27           HA       GLU  27   9.831   6.864   4.177
  193   1HB   GLU  27          HB2       GLU  27  10.426   6.422   7.119
  194   2HB   GLU  27          HB3       GLU  27   8.903   7.099   6.557
  195   1HG   GLU  27          HG2       GLU  27   8.575   5.118   5.068
  196   2HG   GLU  27          HG3       GLU  27  10.021   4.391   5.729
  197    H    GLU  28           H        GLU  28  12.063   8.566   6.484
  198    HA   GLU  28           HA       GLU  28  10.654  11.059   6.054
  199   1HB   GLU  28          HB2       GLU  28  12.307  12.152   7.303
  200   2HB   GLU  28          HB3       GLU  28  11.921  10.639   8.117
  201   1HG   GLU  28          HG2       GLU  28  13.976   9.622   7.322
  202   2HG   GLU  28          HG3       GLU  28  14.380  11.048   6.355
  203    H    ALA  29           H        ALA  29  12.949   9.331   4.103
  204    HA   ALA  29           HA       ALA  29  13.860  11.639   2.594
  205   1HB   ALA  29          HB1       ALA  29  13.855   8.711   1.757
  206   2HB   ALA  29          HB2       ALA  29  14.749  10.032   1.014
  207   3HB   ALA  29          HB3       ALA  29  15.162   9.518   2.657
  208    H    GLY  30           H        GLY  30  10.854   9.902   2.747
  209   1HA   GLY  30          HA2       GLY  30   9.000  11.112   1.884
  210   2HA   GLY  30          HA3       GLY  30   9.922  11.540   0.444
  211    H    PHE  31           H        PHE  31  10.014   8.215   1.605
  212    HA   PHE  31           HA       PHE  31   8.098   7.414  -0.552
  213   1HB   PHE  31          HB2       PHE  31  10.551   5.771   0.001
  214   2HB   PHE  31          HB3       PHE  31   9.508   5.779  -1.393
  215    HD1  PHE  31           HD1      PHE  31   9.719   7.540  -3.160
  216    HD2  PHE  31           HD2      PHE  31  12.405   7.368   0.207
  217    HE1  PHE  31           HE1      PHE  31  11.310   9.027  -4.350
  218    HE2  PHE  31           HE2      PHE  31  14.008   8.835  -0.995
  219    HZ   PHE  31           HZ       PHE  31  13.461   9.670  -3.275
  220    H    THR  32           H        THR  32   7.492   4.963  -0.263
  221    HA   THR  32           HA       THR  32   7.130   4.370   2.630
  222    HB   THR  32           HB       THR  32   5.332   2.805   1.650
  223    HG1  THR  32           HG1      THR  32   4.504   3.560  -0.367
  224   1HG2  THR  32          HG21      THR  32   3.665   4.611   1.614
  225   2HG2  THR  32          HG22      THR  32   4.843   4.843   2.918
  226   3HG2  THR  32          HG23      THR  32   4.958   5.824   1.437
  227    H    THR  33           H        THR  33   7.525   2.192   3.293
  228    HA   THR  33           HA       THR  33   9.343   0.677   1.477
  229    HB   THR  33           HB       THR  33  10.909   0.553   3.287
  230    HG1  THR  33           HG1      THR  33   9.468   0.858   5.074
  231   1HG2  THR  33          HG21      THR  33  11.037   2.550   1.729
  232   2HG2  THR  33          HG22      THR  33  10.204   3.496   2.976
  233   3HG2  THR  33          HG23      THR  33  11.788   2.775   3.322
  234    H    GLU  34           H        GLU  34   9.610  -1.559   1.936
  235    HA   GLU  34           HA       GLU  34   7.681  -2.776   3.809
  236   1HB   GLU  34          HB2       GLU  34   7.906  -2.977   1.062
  237   2HB   GLU  34          HB3       GLU  34   8.897  -4.312   1.578
  238   1HG   GLU  34          HG2       GLU  34   6.746  -5.049   1.290
  239   2HG   GLU  34          HG3       GLU  34   7.041  -5.096   3.023
  240    H    THR  35           H        THR  35   9.005  -2.818   5.680
  241    HA   THR  35           HA       THR  35  11.763  -3.742   5.576
  242    HB   THR  35           HB       THR  35   9.929  -3.604   8.000
  243    HG1  THR  35           HG1      THR  35  10.042  -1.548   7.170
  244   1HG2  THR  35          HG21      THR  35  12.071  -4.917   8.214
  245   2HG2  THR  35          HG22      THR  35  12.962  -3.480   7.682
  246   3HG2  THR  35          HG23      THR  35  12.059  -3.455   9.216
  247    H    LEU  36           H        LEU  36  12.307  -5.864   5.278
  248    HA   LEU  36           HA       LEU  36  10.500  -8.052   6.132
  249   1HB   LEU  36          HB2       LEU  36  11.640  -7.656   3.331
  250   2HB   LEU  36          HB3       LEU  36  10.744  -9.059   3.861
  251    HG   LEU  36           HG       LEU  36   9.514  -6.293   3.735
  252   1HD1  LEU  36          HD11      LEU  36  10.360  -6.954   1.534
  253   2HD1  LEU  36          HD12      LEU  36   9.523  -8.510   1.653
  254   3HD1  LEU  36          HD13      LEU  36   8.588  -6.989   1.581
  255   1HD2  LEU  36          HD21      LEU  36   7.389  -7.552   3.708
  256   2HD2  LEU  36          HD22      LEU  36   8.274  -9.087   3.816
  257   3HD2  LEU  36          HD23      LEU  36   8.309  -7.937   5.168
  258    H    HIS  37           H        HIS  37  11.593 -10.143   5.773
  259    HA   HIS  37           HA       HIS  37  14.563 -10.065   5.810
  260   1HB   HIS  37          HB2       HIS  37  14.354 -12.280   6.959
  261   2HB   HIS  37          HB3       HIS  37  13.744 -10.913   7.876
  262    HD1  HIS  37           HD1      HIS  37  11.092 -10.803   8.321
  263    HD2  HIS  37           HD2      HIS  37  12.511 -14.142   6.165
  264    HE1  HIS  37           HE1      HIS  37   9.170 -12.491   8.242
  265    H    GLY  38           H        GLY  38  13.123  -9.732   3.435
  266   1HA   GLY  38          HA2       GLY  38  12.703 -10.509   1.342
  267   2HA   GLY  38          HA3       GLY  38  14.199 -11.415   1.580
  268    HA   PRO  39           HA       PRO  39  11.149 -14.709   3.019
  269   1HB   PRO  39          HB2       PRO  39   8.407 -14.351   3.056
  270   2HB   PRO  39          HB3       PRO  39   9.497 -13.938   4.414
  271   1HG   PRO  39          HG2       PRO  39   8.424 -12.098   2.253
  272   2HG   PRO  39          HG3       PRO  39   8.451 -11.827   4.026
  273   1HD   PRO  39          HD2       PRO  39  10.360 -10.776   2.410
  274   2HD   PRO  39          HD3       PRO  39  10.778 -11.440   4.024
  275    H    LEU  40           H        LEU  40  10.189 -12.790   0.214
  276    HA   LEU  40           HA       LEU  40   9.598 -15.242  -1.345
  277   1HB   LEU  40          HB2       LEU  40   8.555 -12.365  -1.428
  278   2HB   LEU  40          HB3       LEU  40   8.271 -13.527  -2.690
  279    HG   LEU  40           HG       LEU  40   7.303 -13.825   0.179
  280   1HD1  LEU  40          HD11      LEU  40   5.075 -13.366  -0.756
  281   2HD1  LEU  40          HD12      LEU  40   6.173 -12.009  -1.041
  282   3HD1  LEU  40          HD13      LEU  40   5.784 -13.123  -2.369
  283   1HD2  LEU  40          HD21      LEU  40   6.747 -15.540  -2.286
  284   2HD2  LEU  40          HD22      LEU  40   7.612 -16.043  -0.817
  285   3HD2  LEU  40          HD23      LEU  40   5.891 -15.671  -0.734
  286    H    LEU  41           H        LEU  41  12.158 -13.540  -0.670
  287    HA   LEU  41           HA       LEU  41  13.988 -12.702  -1.577
  288   1HB   LEU  41          HB2       LEU  41  13.360 -14.667  -3.365
  289   2HB   LEU  41          HB3       LEU  41  13.290 -13.273  -4.420
  290    HG   LEU  41           HG       LEU  41  15.617 -14.506  -2.969
  291   1HD1  LEU  41          HD11      LEU  41  15.292 -13.500  -5.830
  292   2HD1  LEU  41          HD12      LEU  41  16.593 -14.534  -5.199
  293   3HD1  LEU  41          HD13      LEU  41  14.930 -15.149  -5.301
  294   1HD2  LEU  41          HD21      LEU  41  16.001 -12.145  -2.444
  295   2HD2  LEU  41          HD22      LEU  41  17.148 -12.720  -3.654
  296   3HD2  LEU  41          HD23      LEU  41  15.776 -11.713  -4.157
  297    H    GLU  42           H        GLU  42  10.954 -11.788  -3.082
  298    HA   GLU  42           HA       GLU  42  11.736  -8.983  -3.463
  299   1HB   GLU  42          HB2       GLU  42  11.209  -9.111  -5.906
  300   2HB   GLU  42          HB3       GLU  42  12.699  -9.899  -5.434
  301   1HG   GLU  42          HG2       GLU  42  11.560 -12.128  -5.566
  302   2HG   GLU  42          HG3       GLU  42  10.106 -11.337  -6.154
  303    H    ASP  43           H        ASP  43  10.071  -8.599  -1.930
  304    HA   ASP  43           HA       ASP  43   7.366  -9.577  -2.368
  305   1HB   ASP  43          HB2       ASP  43   8.065  -8.828  -0.163
  306   2HB   ASP  43          HB3       ASP  43   8.351  -7.187  -0.781
  307    H    LEU  44           H        LEU  44   9.175  -6.584  -3.243
  308    HA   LEU  44           HA       LEU  44   6.885  -5.674  -4.894
  309   1HB   LEU  44          HB2       LEU  44   9.658  -4.493  -4.546
  310   2HB   LEU  44          HB3       LEU  44   8.458  -3.812  -5.567
  311    HG   LEU  44           HG       LEU  44   8.237  -4.037  -2.545
  312   1HD1  LEU  44          HD11      LEU  44   8.378  -1.626  -2.586
  313   2HD1  LEU  44          HD12      LEU  44   9.752  -2.264  -3.514
  314   3HD1  LEU  44          HD13      LEU  44   8.351  -1.593  -4.362
  315   1HD2  LEU  44          HD21      LEU  44   6.208  -2.955  -4.545
  316   2HD2  LEU  44          HD22      LEU  44   5.986  -4.320  -3.422
  317   3HD2  LEU  44          HD23      LEU  44   6.154  -2.686  -2.790
  318    HA   PRO  45           HA       PRO  45   8.191  -7.850  -8.449
  319   1HB   PRO  45          HB2       PRO  45   7.546  -6.106 -10.539
  320   2HB   PRO  45          HB3       PRO  45   6.399  -7.052  -9.589
  321   1HG   PRO  45          HG2       PRO  45   7.279  -4.166  -9.227
  322   2HG   PRO  45          HG3       PRO  45   5.616  -4.807  -9.193
  323   1HD   PRO  45          HD2       PRO  45   7.024  -4.278  -6.916
  324   2HD   PRO  45          HD3       PRO  45   5.880  -5.651  -7.022
  325    H    ALA  46           H        ALA  46   9.219  -7.393 -10.689
  326    HA   ALA  46           HA       ALA  46  11.973  -6.542 -10.342
  327   1HB   ALA  46          HB1       ALA  46  10.428  -7.486 -12.814
  328   2HB   ALA  46          HB2       ALA  46  12.186  -7.292 -12.726
  329   3HB   ALA  46          HB3       ALA  46  11.390  -8.518 -11.724
  330    H    SER  47           H        SER  47  10.209  -4.377  -9.854
  331    HA   SER  47           HA       SER  47  11.148  -2.347 -11.626
  332   1HB   SER  47          HB2       SER  47   8.169  -2.872 -11.537
  333   2HB   SER  47          HB3       SER  47   8.948  -1.481 -12.308
  334    HG   SER  47           HG       SER  47  10.017  -3.814 -13.168
  335    H    GLY  48           H        GLY  48  11.329  -0.491 -10.323
  336   1HA   GLY  48          HA2       GLY  48  10.096   0.874  -8.524
  337   2HA   GLY  48          HA3       GLY  48  10.055  -0.632  -7.615
  338    H    ILE  49           H        ILE  49  11.365  -0.107  -5.969
  339    HA   ILE  49           HA       ILE  49  14.250   0.365  -6.561
  340    HB   ILE  49           HB       ILE  49  12.788   1.145  -4.045
  341   1HG1  ILE  49          HG12      ILE  49  11.745   2.538  -5.746
  342   2HG1  ILE  49          HG13      ILE  49  12.701   3.470  -4.620
  343   1HG2  ILE  49          HG21      ILE  49  15.208   0.880  -3.788
  344   2HG2  ILE  49          HG22      ILE  49  15.504   2.017  -5.106
  345   3HG2  ILE  49          HG23      ILE  49  14.755   2.578  -3.600
  346   1HD1  ILE  49          HD11      ILE  49  14.447   3.826  -6.240
  347   2HD1  ILE  49          HD12      ILE  49  13.673   2.715  -7.402
  348   3HD1  ILE  49          HD13      ILE  49  12.895   4.247  -6.969
  349    H    TRP  50           H        TRP  50  15.551  -1.214  -5.708
  350    HA   TRP  50           HA       TRP  50  14.440  -3.157  -3.720
  351   1HB   TRP  50          HB2       TRP  50  16.199  -3.479  -6.173
  352   2HB   TRP  50          HB3       TRP  50  16.425  -4.530  -4.815
  353    HD1  TRP  50           HD1      TRP  50  12.825  -3.645  -5.869
  354    HE1  TRP  50           HE1      TRP  50  11.716  -5.626  -7.023
  355    HE3  TRP  50           HE3      TRP  50  16.870  -6.773  -6.064
  356    HZ2  TRP  50           HZ2      TRP  50  12.488  -8.281  -7.885
  357    HZ3  TRP  50           HZ3      TRP  50  16.650  -9.032  -7.060
  358    HH2  TRP  50           HH2      TRP  50  14.467  -9.796  -7.972
  359    H    LEU  51           H        LEU  51  15.615  -3.211  -1.830
  360    HA   LEU  51           HA       LEU  51  18.414  -2.163  -1.877
  361   1HB   LEU  51          HB2       LEU  51  16.267  -1.849   0.263
  362   2HB   LEU  51          HB3       LEU  51  17.988  -1.627   0.570
  363    HG   LEU  51           HG       LEU  51  16.262   0.068  -1.293
  364   1HD1  LEU  51          HD11      LEU  51  15.934   0.457   1.134
  365   2HD1  LEU  51          HD12      LEU  51  17.671   0.721   1.336
  366   3HD1  LEU  51          HD13      LEU  51  16.710   1.838   0.347
  367   1HD2  LEU  51          HD21      LEU  51  18.417   1.502  -1.339
  368   2HD2  LEU  51          HD22      LEU  51  19.265   0.041  -0.811
  369   3HD2  LEU  51          HD23      LEU  51  18.382   0.059  -2.348
  370    H    VAL  52           H        VAL  52  19.874  -3.575  -0.987
  371    HA   VAL  52           HA       VAL  52  18.727  -6.147   0.055
  372    HB   VAL  52           HB       VAL  52  21.193  -5.754  -1.684
  373   1HG1  VAL  52          HG11      VAL  52  21.158  -8.243  -1.847
  374   2HG1  VAL  52          HG12      VAL  52  21.452  -7.683  -0.200
  375   3HG1  VAL  52          HG13      VAL  52  19.842  -8.291  -0.654
  376   1HG2  VAL  52          HG21      VAL  52  19.142  -5.416  -3.024
  377   2HG2  VAL  52          HG22      VAL  52  19.902  -6.951  -3.436
  378   3HG2  VAL  52          HG23      VAL  52  18.468  -6.933  -2.391
  379    H    ILE  53           H        ILE  53  19.366  -6.702   2.016
  380    HA   ILE  53           HA       ILE  53  21.663  -5.331   3.303
  381    HB   ILE  53           HB       ILE  53  19.017  -5.840   4.719
  382   1HG1  ILE  53          HG12      ILE  53  18.835  -3.211   4.516
  383   2HG1  ILE  53          HG13      ILE  53  19.751  -3.437   3.032
  384   1HG2  ILE  53          HG21      ILE  53  19.912  -4.207   6.315
  385   2HG2  ILE  53          HG22      ILE  53  21.074  -5.516   6.081
  386   3HG2  ILE  53          HG23      ILE  53  21.341  -3.947   5.289
  387   1HD1  ILE  53          HD11      ILE  53  17.029  -4.579   3.764
  388   2HD1  ILE  53          HD12      ILE  53  17.398  -3.368   2.518
  389   3HD1  ILE  53          HD13      ILE  53  17.882  -5.045   2.289
  390    H    SER  54           H        SER  54  22.615  -7.241   2.456
  391    HA   SER  54           HA       SER  54  22.205  -9.669   4.136
  392   1HB   SER  54          HB2       SER  54  22.285  -9.466   1.098
  393   2HB   SER  54          HB3       SER  54  22.375 -10.968   2.005
  394    HG   SER  54           HG       SER  54  20.204  -9.143   1.921
  395    H    SER  55           H        SER  55  24.135  -7.965   4.792
  396    HA   SER  55           HA       SER  55  26.415  -7.435   3.733
  397   1HB   SER  55          HB2       SER  55  26.191  -8.602   6.514
  398   2HB   SER  55          HB3       SER  55  27.355  -7.386   5.949
  399    HG   SER  55           HG       SER  55  25.467  -6.531   7.054
  400    H    THR  56           H        THR  56  27.419  -8.678   2.183
  401    HA   THR  56           HA       THR  56  28.169 -11.344   2.304
  402    HB   THR  56           HB       THR  56  29.940 -10.491   0.606
  403    HG1  THR  56           HG1      THR  56  29.305  -8.409  -0.196
  404   1HG2  THR  56          HG21      THR  56  27.891 -11.522  -0.141
  405   2HG2  THR  56          HG22      THR  56  26.950 -10.061   0.209
  406   3HG2  THR  56          HG23      THR  56  28.158 -10.065  -1.099
  407    H    HIS  57           H        HIS  57  29.925  -8.493   3.362
  408    HA   HIS  57           HA       HIS  57  31.730  -8.049   4.538
  409   1HB   HIS  57          HB2       HIS  57  31.778  -8.889   6.764
  410   2HB   HIS  57          HB3       HIS  57  30.120  -8.666   6.246
  411    HD1  HIS  57           HD1      HIS  57  28.595 -10.876   6.166
  412    HD2  HIS  57           HD2      HIS  57  32.634 -11.424   7.232
  413    HE1  HIS  57           HE1      HIS  57  28.769 -13.215   7.192
  414    H    GLY  58           H        GLY  58  33.732  -8.879   5.769
  415   1HA   GLY  58          HA2       GLY  58  35.416  -9.837   3.749
  416   2HA   GLY  58          HA3       GLY  58  35.882  -9.462   5.410
  417    H    ALA  59           H        ALA  59  33.685 -12.026   4.238
  418    HA   ALA  59           HA       ALA  59  35.653 -14.123   4.520
  419   1HB   ALA  59          HB1       ALA  59  34.414 -15.442   6.205
  420   2HB   ALA  59          HB2       ALA  59  34.969 -13.908   6.899
  421   3HB   ALA  59          HB3       ALA  59  33.265 -14.108   6.426
  422    H    GLY  60           H        GLY  60  32.234 -13.110   3.984
  423   1HA   GLY  60          HA2       GLY  60  30.591 -13.963   2.676
  424   2HA   GLY  60          HA3       GLY  60  31.824 -14.724   1.684
  425    H    ASP  61           H        ASP  61  30.437 -16.549   1.431
  426    HA   ASP  61           HA       ASP  61  30.997 -18.608   3.409
  427   1HB   ASP  61          HB2       ASP  61  28.685 -17.726   4.020
  428   2HB   ASP  61          HB3       ASP  61  28.148 -18.232   2.413
  429    H    ILE  62           H        ILE  62  30.314 -20.781   2.308
  430    HA   ILE  62           HA       ILE  62  31.824 -21.150   0.063
  431    HB   ILE  62           HB       ILE  62  29.498 -22.807   1.088
  432   1HG1  ILE  62          HG12      ILE  62  32.519 -23.069   1.462
  433   2HG1  ILE  62          HG13      ILE  62  31.411 -22.404   2.657
  434   1HG2  ILE  62          HG21      ILE  62  31.669 -23.650  -0.889
  435   2HG2  ILE  62          HG22      ILE  62  30.436 -24.712  -0.174
  436   3HG2  ILE  62          HG23      ILE  62  29.945 -23.443  -1.273
  437   1HD1  ILE  62          HD11      ILE  62  31.507 -25.286   1.711
  438   2HD1  ILE  62          HD12      ILE  62  31.887 -24.637   3.311
  439   3HD1  ILE  62          HD13      ILE  62  30.210 -24.611   2.730
  440    HA   PRO  63           HA       PRO  63  28.290 -20.859  -3.089
  441   1HB   PRO  63          HB2       PRO  63  25.910 -19.597  -2.495
  442   2HB   PRO  63          HB3       PRO  63  26.191 -21.354  -2.315
  443   1HG   PRO  63          HG2       PRO  63  26.334 -19.215  -0.174
  444   2HG   PRO  63          HG3       PRO  63  25.532 -20.815  -0.097
  445   1HD   PRO  63          HD2       PRO  63  27.992 -20.399   0.958
  446   2HD   PRO  63          HD3       PRO  63  27.590 -21.938   0.143
  447    H    ASP  64           H        ASP  64  28.278 -18.184  -0.722
  448    HA   ASP  64           HA       ASP  64  29.564 -16.234  -2.335
  449   1HB   ASP  64          HB2       ASP  64  27.622 -15.982  -3.696
  450   2HB   ASP  64          HB3       ASP  64  26.524 -16.250  -2.345
  451    H    ASN  65           H        ASN  65  26.787 -16.362  -0.158
  452    HA   ASN  65           HA       ASN  65  27.800 -16.018   2.413
  453   1HB   ASN  65          HB2       ASN  65  28.648 -13.788   1.790
  454   2HB   ASN  65          HB3       ASN  65  27.086 -13.383   1.107
  455   1HD2  ASN  65          HD22      ASN  65  28.948 -13.116   3.977
  456   2HD2  ASN  65          HD21      ASN  65  27.604 -12.739   5.011
  457    H    LEU  66           H        LEU  66  25.491 -14.602   0.099
  458    HA   LEU  66           HA       LEU  66  23.077 -15.288   1.607
  459   1HB   LEU  66          HB2       LEU  66  23.650 -14.498  -1.296
  460   2HB   LEU  66          HB3       LEU  66  22.052 -14.896  -0.693
  461    HG   LEU  66           HG       LEU  66  22.226 -12.955   0.904
  462   1HD1  LEU  66          HD11      LEU  66  23.854 -11.138   0.225
  463   2HD1  LEU  66          HD12      LEU  66  24.641 -12.524   0.972
  464   3HD1  LEU  66          HD13      LEU  66  24.674 -12.318  -0.795
  465   1HD2  LEU  66          HD21      LEU  66  22.422 -12.450  -2.074
  466   2HD2  LEU  66          HD22      LEU  66  20.956 -12.743  -1.150
  467   3HD2  LEU  66          HD23      LEU  66  21.837 -11.244  -0.898
  468    H    SER  67           H        SER  67  21.884 -17.265   1.288
  469    HA   SER  67           HA       SER  67  23.121 -19.164  -0.672
  470   1HB   SER  67          HB2       SER  67  21.762 -20.108   1.837
  471   2HB   SER  67          HB3       SER  67  22.881 -20.938   0.764
  472    HG   SER  67           HG       SER  67  23.376 -18.783   2.546
  473    HA   PRO  68           HA       PRO  68  18.594 -20.218  -1.226
  474   1HB   PRO  68          HB2       PRO  68  16.544 -18.888   0.025
  475   2HB   PRO  68          HB3       PRO  68  17.392 -20.288   0.743
  476   1HG   PRO  68          HG2       PRO  68  17.836 -17.359   1.331
  477   2HG   PRO  68          HG3       PRO  68  17.725 -18.730   2.477
  478   1HD   PRO  68          HD2       PRO  68  20.115 -17.689   1.589
  479   2HD   PRO  68          HD3       PRO  68  19.902 -19.401   2.043
  480    H    PHE  69           H        PHE  69  18.972 -16.773  -0.402
  481    HA   PHE  69           HA       PHE  69  17.514 -15.633  -2.551
  482   1HB   PHE  69          HB2       PHE  69  19.880 -14.703  -0.893
  483   2HB   PHE  69          HB3       PHE  69  19.072 -13.661  -2.034
  484    HD1  PHE  69           HD1      PHE  69  19.293 -12.394   0.314
  485    HD2  PHE  69           HD2      PHE  69  16.454 -15.561  -0.497
  486    HE1  PHE  69           HE1      PHE  69  17.901 -11.641   2.201
  487    HE2  PHE  69           HE2      PHE  69  15.099 -14.808   1.414
  488    HZ   PHE  69           HZ       PHE  69  15.819 -12.858   2.777
  489    H    TYR  70           H        TYR  70  21.024 -16.473  -2.236
  490    HA   TYR  70           HA       TYR  70  21.751 -15.397  -4.745
  491   1HB   TYR  70          HB2       TYR  70  23.362 -15.905  -2.965
  492   2HB   TYR  70          HB3       TYR  70  23.082 -17.625  -3.210
  493    HD1  TYR  70           HD1      TYR  70  24.197 -14.492  -4.967
  494    HD2  TYR  70           HD2      TYR  70  24.355 -18.806  -4.857
  495    HE1  TYR  70           HE1      TYR  70  25.809 -14.480  -6.855
  496    HE2  TYR  70           HE2      TYR  70  25.977 -18.800  -6.720
  497    HH   TYR  70           HH       TYR  70  27.087 -17.505  -8.303
  498    H    GLU  71           H        GLU  71  20.966 -18.864  -3.867
  499    HA   GLU  71           HA       GLU  71  21.253 -19.776  -6.535
  500   1HB   GLU  71          HB2       GLU  71  19.495 -20.871  -4.294
  501   2HB   GLU  71          HB3       GLU  71  19.881 -21.699  -5.812
  502   1HG   GLU  71          HG2       GLU  71  22.369 -21.242  -5.115
  503   2HG   GLU  71          HG3       GLU  71  21.733 -21.013  -3.511
  504    H    ALA  72           H        ALA  72  18.347 -18.478  -4.823
  505    HA   ALA  72           HA       ALA  72  16.570 -18.973  -7.017
  506   1HB   ALA  72          HB1       ALA  72  15.059 -17.451  -5.790
  507   2HB   ALA  72          HB2       ALA  72  15.794 -18.646  -4.703
  508   3HB   ALA  72          HB3       ALA  72  16.410 -16.975  -4.727
  509    H    LEU  73           H        LEU  73  18.772 -16.215  -6.337
  510    HA   LEU  73           HA       LEU  73  17.705 -14.480  -8.345
  511   1HB   LEU  73          HB2       LEU  73  20.446 -14.848  -7.076
  512   2HB   LEU  73          HB3       LEU  73  20.240 -13.784  -8.428
  513    HG   LEU  73           HG       LEU  73  18.865 -13.557  -5.722
  514   1HD1  LEU  73          HD11      LEU  73  21.257 -12.993  -5.721
  515   2HD1  LEU  73          HD12      LEU  73  21.000 -11.836  -7.046
  516   3HD1  LEU  73          HD13      LEU  73  20.262 -11.556  -5.452
  517   1HD2  LEU  73          HD21      LEU  73  18.616 -11.736  -8.157
  518   2HD2  LEU  73          HD22      LEU  73  17.307 -12.635  -7.356
  519   3HD2  LEU  73          HD23      LEU  73  18.086 -11.309  -6.512
  520    H    GLN  74           H        GLN  74  20.459 -16.794  -8.502
  521    HA   GLN  74           HA       GLN  74  20.806 -16.462 -11.303
  522   1HB   GLN  74          HB2       GLN  74  21.527 -19.016  -9.839
  523   2HB   GLN  74          HB3       GLN  74  22.229 -18.350 -11.315
  524   1HG   GLN  74          HG2       GLN  74  22.826 -16.293  -9.758
  525   2HG   GLN  74          HG3       GLN  74  22.547 -17.471  -8.470
  526   1HE2  GLN  74          HE21      GLN  74  24.628 -16.439 -11.055
  527   2HE2  GLN  74          HE22      GLN  74  25.945 -17.577 -10.775
  528    H    GLU  75           H        GLU  75  18.571 -18.438  -9.575
  529    HA   GLU  75           HA       GLU  75  18.058 -20.341 -11.584
  530   1HB   GLU  75          HB2       GLU  75  17.420 -20.574  -9.212
  531   2HB   GLU  75          HB3       GLU  75  16.176 -19.342  -9.436
  532   1HG   GLU  75          HG2       GLU  75  14.966 -20.802 -10.993
  533   2HG   GLU  75          HG3       GLU  75  16.276 -21.986 -10.942
  534    H    GLN  76           H        GLN  76  16.781 -17.110 -11.124
  535    HA   GLN  76           HA       GLN  76  15.101 -17.411 -13.585
  536   1HB   GLN  76          HB2       GLN  76  13.731 -15.510 -12.501
  537   2HB   GLN  76          HB3       GLN  76  13.492 -17.167 -11.959
  538   1HG   GLN  76          HG2       GLN  76  14.495 -16.837  -9.917
  539   2HG   GLN  76          HG3       GLN  76  15.498 -15.493 -10.473
  540   1HE2  GLN  76          HE22      GLN  76  14.808 -14.599  -8.371
  541   2HE2  GLN  76          HE21      GLN  76  13.403 -13.539  -8.407
  542    H    LYS  77           H        LYS  77  17.539 -15.415 -12.043
  543    HA   LYS  77           HA       LYS  77  18.241 -13.256 -12.443
  544   1HB   LYS  77          HB2       LYS  77  18.697 -14.672 -15.064
  545   2HB   LYS  77          HB3       LYS  77  19.444 -13.125 -14.634
  546   1HG   LYS  77          HG2       LYS  77  20.519 -14.108 -12.716
  547   2HG   LYS  77          HG3       LYS  77  19.715 -15.656 -12.975
  548   1HD   LYS  77          HD2       LYS  77  21.645 -14.443 -14.976
  549   2HD   LYS  77          HD3       LYS  77  22.127 -15.562 -13.686
  550   1HE   LYS  77          HE2       LYS  77  20.537 -17.231 -14.583
  551   2HE   LYS  77          HE3       LYS  77  20.094 -16.135 -15.895
  552   1HZ   LYS  77          HZ1       LYS  77  21.749 -17.741 -16.606
  553   2HZ   LYS  77          HZ2       LYS  77  22.392 -16.248 -16.674
  554   3HZ   LYS  77          HZ3       LYS  77  22.802 -17.266 -15.460
  555    HA   PRO  78           HA       PRO  78  14.215 -12.111 -14.459
  556   1HB   PRO  78          HB2       PRO  78  13.320 -10.254 -12.569
  557   2HB   PRO  78          HB3       PRO  78  12.958 -11.990 -12.613
  558   1HG   PRO  78          HG2       PRO  78  15.048 -10.525 -11.008
  559   2HG   PRO  78          HG3       PRO  78  14.010 -11.878 -10.480
  560   1HD   PRO  78          HD2       PRO  78  16.629 -12.209 -11.220
  561   2HD   PRO  78          HD3       PRO  78  15.389 -13.455 -11.535
  562    H    ASP  79           H        ASP  79  13.320 -10.117 -15.225
  563    HA   ASP  79           HA       ASP  79  15.445  -8.537 -16.432
  564   1HB   ASP  79          HB2       ASP  79  13.629  -9.409 -17.794
  565   2HB   ASP  79          HB3       ASP  79  12.442  -8.493 -16.856
  566    H    LEU  80           H        LEU  80  16.015  -7.720 -14.247
  567    HA   LEU  80           HA       LEU  80  14.415  -5.720 -12.939
  568   1HB   LEU  80          HB2       LEU  80  17.296  -6.600 -12.814
  569   2HB   LEU  80          HB3       LEU  80  16.769  -5.273 -11.868
  570    HG   LEU  80           HG       LEU  80  16.115  -6.447 -10.191
  571   1HD1  LEU  80          HD11      LEU  80  14.473  -8.246 -11.991
  572   2HD1  LEU  80          HD12      LEU  80  14.442  -8.227 -10.213
  573   3HD1  LEU  80          HD13      LEU  80  13.934  -6.801 -11.099
  574   1HD2  LEU  80          HD21      LEU  80  18.060  -7.821 -10.812
  575   2HD2  LEU  80          HD22      LEU  80  16.824  -8.748  -9.950
  576   3HD2  LEU  80          HD23      LEU  80  16.977  -8.920 -11.709
  577    H    SER  81           H        SER  81  15.199  -5.173 -15.895
  578    HA   SER  81           HA       SER  81  17.079  -3.008 -15.914
  579   1HB   SER  81          HB2       SER  81  16.258  -2.733 -18.259
  580   2HB   SER  81          HB3       SER  81  16.785  -4.380 -17.881
  581    HG   SER  81           HG       SER  81  14.840  -5.111 -18.125
  582    H    ALA  82           H        ALA  82  14.055  -3.200 -14.630
  583    HA   ALA  82           HA       ALA  82  13.364  -0.334 -15.097
  584   1HB   ALA  82          HB1       ALA  82  11.736  -1.859 -16.140
  585   2HB   ALA  82          HB2       ALA  82  11.523  -2.707 -14.592
  586   3HB   ALA  82          HB3       ALA  82  11.009  -1.014 -14.762
  587    H    VAL  83           H        VAL  83  14.930  -2.174 -12.886
  588    HA   VAL  83           HA       VAL  83  13.853  -0.459 -10.720
  589    HB   VAL  83           HB       VAL  83  12.884  -2.453 -10.133
  590   1HG1  VAL  83          HG11      VAL  83  13.892  -4.016 -11.673
  591   2HG1  VAL  83          HG12      VAL  83  15.432  -3.925 -10.776
  592   3HG1  VAL  83          HG13      VAL  83  13.995  -4.663 -10.033
  593   1HG2  VAL  83          HG21      VAL  83  13.843  -3.256  -8.143
  594   2HG2  VAL  83          HG22      VAL  83  15.476  -2.753  -8.596
  595   3HG2  VAL  83          HG23      VAL  83  14.236  -1.547  -8.205
  596    H    ARG  84           H        ARG  84  15.268   0.193  -9.119
  597    HA   ARG  84           HA       ARG  84  18.143   0.045  -9.906
  598   1HB   ARG  84          HB2       ARG  84  18.571   2.064  -8.962
  599   2HB   ARG  84          HB3       ARG  84  17.017   2.351  -9.741
  600   1HG   ARG  84          HG2       ARG  84  15.954   1.945  -7.432
  601   2HG   ARG  84          HG3       ARG  84  17.595   1.949  -6.768
  602   1HD   ARG  84          HD2       ARG  84  16.073   4.209  -8.059
  603   2HD   ARG  84          HD3       ARG  84  16.790   4.156  -6.444
  604    HE   ARG  84           HE       ARG  84  19.040   4.048  -7.631
  605   1HH1  ARG  84          HH11      ARG  84  16.293   5.847  -9.055
  606   2HH1  ARG  84          HH12      ARG  84  17.233   6.548 -10.316
  607   1HH2  ARG  84          HH21      ARG  84  20.197   4.831  -9.394
  608   2HH2  ARG  84          HH22      ARG  84  19.546   6.038 -10.473
  609    H    PHE  85           H        PHE  85  19.651  -0.359  -8.267
  610    HA   PHE  85           HA       PHE  85  18.613  -2.038  -6.018
  611   1HB   PHE  85          HB2       PHE  85  19.333  -3.609  -7.502
  612   2HB   PHE  85          HB3       PHE  85  20.482  -2.538  -8.290
  613    HD1  PHE  85           HD1      PHE  85  20.219  -3.857  -4.736
  614    HD2  PHE  85           HD2      PHE  85  22.520  -3.542  -8.375
  615    HE1  PHE  85           HE1      PHE  85  22.121  -5.017  -3.651
  616    HE2  PHE  85           HE2      PHE  85  24.404  -4.729  -7.285
  617    HZ   PHE  85           HZ       PHE  85  24.199  -5.466  -4.922
  618    H    GLY  86           H        GLY  86  19.690  -1.699  -4.055
  619   1HA   GLY  86          HA2       GLY  86  22.143  -0.017  -4.043
  620   2HA   GLY  86          HA3       GLY  86  20.791   0.351  -2.966
  621    H    ALA  87           H        ALA  87  23.613  -1.532  -3.350
  622    HA   ALA  87           HA       ALA  87  22.943  -3.742  -1.562
  623   1HB   ALA  87          HB1       ALA  87  24.726  -3.936  -3.279
  624   2HB   ALA  87          HB2       ALA  87  25.574  -2.546  -2.577
  625   3HB   ALA  87          HB3       ALA  87  25.434  -4.052  -1.675
  626    H    ILE  88           H        ILE  88  23.110  -3.660   0.725
  627    HA   ILE  88           HA       ILE  88  24.425  -1.284   1.943
  628    HB   ILE  88           HB       ILE  88  21.740  -2.485   2.738
  629   1HG1  ILE  88          HG12      ILE  88  22.374   0.045   1.185
  630   2HG1  ILE  88          HG13      ILE  88  21.355  -1.303   0.715
  631   1HG2  ILE  88          HG21      ILE  88  22.882  -1.731   4.685
  632   2HG2  ILE  88          HG22      ILE  88  23.441  -0.248   3.897
  633   3HG2  ILE  88          HG23      ILE  88  21.736  -0.469   4.307
  634   1HD1  ILE  88          HD11      ILE  88  19.970   0.568   1.259
  635   2HD1  ILE  88          HD12      ILE  88  19.721  -0.688   2.493
  636   3HD1  ILE  88          HD13      ILE  88  20.708   0.765   2.835
  637    H    GLY  89           H        GLY  89  25.868  -1.947   3.459
  638   1HA   GLY  89          HA2       GLY  89  26.705  -3.144   5.319
  639   2HA   GLY  89          HA3       GLY  89  25.358  -4.291   5.190
  640    H    ILE  90           H        ILE  90  25.828  -4.616   2.316
  641    HA   ILE  90           HA       ILE  90  27.559  -6.761   1.957
  642    HB   ILE  90           HB       ILE  90  26.612  -4.500   0.169
  643   1HG1  ILE  90          HG12      ILE  90  24.741  -5.804   1.151
  644   2HG1  ILE  90          HG13      ILE  90  24.797  -5.872  -0.590
  645   1HG2  ILE  90          HG21      ILE  90  27.682  -7.161  -0.801
  646   2HG2  ILE  90          HG22      ILE  90  26.958  -5.895  -1.792
  647   3HG2  ILE  90          HG23      ILE  90  28.486  -5.587  -0.965
  648   1HD1  ILE  90          HD11      ILE  90  25.850  -8.083   1.187
  649   2HD1  ILE  90          HD12      ILE  90  24.219  -8.028   0.484
  650   3HD1  ILE  90          HD13      ILE  90  25.627  -8.137  -0.578
  651    H    GLY  91           H        GLY  91  29.769  -6.915   1.623
  652   1HA   GLY  91          HA2       GLY  91  31.389  -4.426   2.090
  653   2HA   GLY  91          HA3       GLY  91  31.759  -6.030   2.730
  654    H    SER  92           H        SER  92  30.839  -7.195   0.096
  655    HA   SER  92           HA       SER  92  33.192  -7.866  -1.121
  656   1HB   SER  92          HB2       SER  92  31.489  -8.373  -3.054
  657   2HB   SER  92          HB3       SER  92  31.364  -9.205  -1.495
  658    HG   SER  92           HG       SER  92  29.731  -7.160  -2.526
  659    H    ARG  93           H        ARG  93  31.238  -4.982  -1.773
  660    HA   ARG  93           HA       ARG  93  32.171  -4.311  -4.264
  661   1HB   ARG  93          HB2       ARG  93  30.370  -3.172  -2.944
  662   2HB   ARG  93          HB3       ARG  93  31.610  -2.397  -1.969
  663   1HG   ARG  93          HG2       ARG  93  30.933  -0.757  -3.467
  664   2HG   ARG  93          HG3       ARG  93  32.467  -1.294  -4.129
  665   1HD   ARG  93          HD2       ARG  93  29.754  -2.325  -5.110
  666   2HD   ARG  93          HD3       ARG  93  30.500  -0.865  -5.735
  667    HE   ARG  93           HE       ARG  93  32.313  -2.088  -6.647
  668   1HH1  ARG  93          HH11      ARG  93  29.696  -4.265  -5.453
  669   2HH1  ARG  93          HH12      ARG  93  30.351  -5.608  -6.373
  670   1HH2  ARG  93          HH21      ARG  93  32.971  -3.979  -7.884
  671   2HH2  ARG  93          HH22      ARG  93  32.039  -5.450  -7.676
  672    H    GLU  94           H        GLU  94  33.755  -3.686  -1.183
  673    HA   GLU  94           HA       GLU  94  36.320  -4.010  -2.031
  674   1HB   GLU  94          HB2       GLU  94  35.451  -1.319  -2.829
  675   2HB   GLU  94          HB3       GLU  94  36.698  -1.195  -1.606
  676   1HG   GLU  94          HG2       GLU  94  38.172  -2.703  -2.907
  677   2HG   GLU  94          HG3       GLU  94  36.954  -2.801  -4.176
  678    H    TYR  95           H        TYR  95  34.412  -1.797  -0.055
  679    HA   TYR  95           HA       TYR  95  36.216  -1.212   1.879
  680   1HB   TYR  95          HB2       TYR  95  33.187  -1.444   2.099
  681   2HB   TYR  95          HB3       TYR  95  34.207  -0.615   3.262
  682    HD1  TYR  95           HD1      TYR  95  35.782   1.265   2.393
  683    HD2  TYR  95           HD2      TYR  95  32.330  -0.180   0.231
  684    HE1  TYR  95           HE1      TYR  95  35.772   3.332   1.033
  685    HE2  TYR  95           HE2      TYR  95  32.325   1.879  -1.140
  686    HH   TYR  95           HH       TYR  95  33.405   3.892  -1.623
  687    H    ASP  96           H        ASP  96  34.340  -4.221   1.836
  688    HA   ASP  96           HA       ASP  96  36.125  -5.208   3.908
  689   1HB   ASP  96          HB2       ASP  96  34.268  -4.290   5.281
  690   2HB   ASP  96          HB3       ASP  96  33.125  -5.323   4.424
  691    H    THR  97           H        THR  97  36.298  -5.703   1.356
  692    HA   THR  97           HA       THR  97  34.646  -7.922   0.517
  693    HB   THR  97           HB       THR  97  35.487  -6.173  -1.003
  694    HG1  THR  97           HG1      THR  97  35.350  -7.576  -2.510
  695   1HG2  THR  97          HG21      THR  97  38.199  -7.551  -0.794
  696   2HG2  THR  97          HG22      THR  97  37.747  -6.217  -1.877
  697   3HG2  THR  97          HG23      THR  97  37.827  -5.948  -0.130
  698    H    PHE  98           H        PHE  98  36.003  -9.788  -0.540
  699    HA   PHE  98           HA       PHE  98  38.094 -10.856   1.257
  700   1HB   PHE  98          HB2       PHE  98  35.902 -11.804   1.993
  701   2HB   PHE  98          HB3       PHE  98  35.651 -12.448   0.381
  702    HD1  PHE  98           HD1      PHE  98  37.964 -12.581   3.331
  703    HD2  PHE  98           HD2      PHE  98  36.565 -14.568  -0.236
  704    HE1  PHE  98           HE1      PHE  98  39.191 -14.634   3.990
  705    HE2  PHE  98           HE2      PHE  98  37.798 -16.618   0.427
  706    HZ   PHE  98           HZ       PHE  98  39.112 -16.656   2.541
  707    H    CYS  99           H        CYS  99  39.305  -9.922  -0.468
  708    HA   CYS  99           HA       CYS  99  40.340  -9.733  -2.443
  709   1HB   CYS  99          HB2       CYS  99  40.034 -12.759  -2.477
  710   2HB   CYS  99          HB3       CYS  99  41.227 -11.818  -3.383
  711    HG   CYS  99           HG       CYS  99  40.805 -11.980  -0.098
  712    H    GLY 100           H        GLY 100  37.380  -9.437  -2.668
  713   1HA   GLY 100          HA2       GLY 100  35.894  -9.038  -4.338
  714   2HA   GLY 100          HA3       GLY 100  37.156  -9.407  -5.516
  715    H    ALA 101           H        ALA 101  36.927 -12.152  -3.557
  716    HA   ALA 101           HA       ALA 101  35.762 -13.710  -5.663
  717   1HB   ALA 101          HB1       ALA 101  36.137 -15.584  -4.117
  718   2HB   ALA 101          HB2       ALA 101  37.548 -14.512  -4.130
  719   3HB   ALA 101          HB3       ALA 101  36.397 -14.455  -2.773
  720    H    ILE 102           H        ILE 102  34.205 -11.744  -3.541
  721    HA   ILE 102           HA       ILE 102  31.738 -13.387  -3.307
  722    HB   ILE 102           HB       ILE 102  31.415 -12.173  -1.135
  723   1HG1  ILE 102          HG12      ILE 102  34.387 -11.486  -1.277
  724   2HG1  ILE 102          HG13      ILE 102  33.165 -10.329  -1.761
  725   1HG2  ILE 102          HG21      ILE 102  32.248 -14.499  -1.245
  726   2HG2  ILE 102          HG22      ILE 102  33.925 -13.912  -1.308
  727   3HG2  ILE 102          HG23      ILE 102  32.938 -13.635   0.131
  728   1HD1  ILE 102          HD11      ILE 102  33.780  -9.936   0.564
  729   2HD1  ILE 102          HD12      ILE 102  32.109 -10.490   0.494
  730   3HD1  ILE 102          HD13      ILE 102  33.397 -11.608   0.991
  731    H    ASP 103           H        ASP 103  32.914 -10.997  -5.125
  732    HA   ASP 103           HA       ASP 103  30.910  -8.915  -5.009
  733   1HB   ASP 103          HB2       ASP 103  33.105  -8.697  -6.098
  734   2HB   ASP 103          HB3       ASP 103  32.685  -9.981  -7.232
  735    H    LYS 104           H        LYS 104  30.616 -12.186  -5.685
  736    HA   LYS 104           HA       LYS 104  29.301 -12.458  -8.091
  737   1HB   LYS 104          HB2       LYS 104  28.838 -14.094  -5.566
  738   2HB   LYS 104          HB3       LYS 104  28.496 -14.598  -7.216
  739   1HG   LYS 104          HG2       LYS 104  30.870 -14.593  -7.736
  740   2HG   LYS 104          HG3       LYS 104  31.281 -13.909  -6.163
  741   1HD   LYS 104          HD2       LYS 104  31.784 -16.243  -6.092
  742   2HD   LYS 104          HD3       LYS 104  30.396 -15.937  -5.036
  743   1HE   LYS 104          HE2       LYS 104  28.875 -16.723  -6.849
  744   2HE   LYS 104          HE3       LYS 104  30.278 -17.044  -7.882
  745   1HZ   LYS 104          HZ1       LYS 104  29.620 -18.392  -5.325
  746   2HZ   LYS 104          HZ2       LYS 104  29.566 -19.057  -6.816
  747   3HZ   LYS 104          HZ3       LYS 104  31.009 -18.658  -6.171
  748    H    LEU 105           H        LEU 105  27.741 -11.864  -4.874
  749    HA   LEU 105           HA       LEU 105  25.078 -12.013  -5.760
  750   1HB   LEU 105          HB2       LEU 105  25.677 -11.945  -3.434
  751   2HB   LEU 105          HB3       LEU 105  26.397 -10.357  -3.565
  752    HG   LEU 105           HG       LEU 105  24.147 -10.581  -2.430
  753   1HD1  LEU 105          HD11      LEU 105  23.322  -8.450  -3.099
  754   2HD1  LEU 105          HD12      LEU 105  25.090  -8.394  -3.185
  755   3HD1  LEU 105          HD13      LEU 105  24.122  -8.545  -4.669
  756   1HD2  LEU 105          HD21      LEU 105  22.970 -10.636  -5.238
  757   2HD2  LEU 105          HD22      LEU 105  23.090 -12.055  -4.188
  758   3HD2  LEU 105          HD23      LEU 105  22.113 -10.657  -3.696
  759    H    GLU 106           H        GLU 106  27.115  -9.053  -5.449
  760    HA   GLU 106           HA       GLU 106  25.102  -7.329  -6.482
  761   1HB   GLU 106          HB2       GLU 106  28.131  -6.885  -6.555
  762   2HB   GLU 106          HB3       GLU 106  26.883  -5.648  -6.615
  763   1HG   GLU 106          HG2       GLU 106  26.224  -6.121  -4.302
  764   2HG   GLU 106          HG3       GLU 106  27.335  -7.481  -4.212
  765    H    ALA 107           H        ALA 107  27.759  -9.135  -7.995
  766    HA   ALA 107           HA       ALA 107  27.603  -8.017 -10.594
  767   1HB   ALA 107          HB1       ALA 107  29.483  -9.430  -9.832
  768   2HB   ALA 107          HB2       ALA 107  28.407 -10.842  -9.758
  769   3HB   ALA 107          HB3       ALA 107  28.752 -10.070 -11.316
  770    H    GLU 108           H        GLU 108  25.898 -10.949  -9.174
  771    HA   GLU 108           HA       GLU 108  24.591 -11.580 -11.623
  772   1HB   GLU 108          HB2       GLU 108  24.065 -12.247  -8.724
  773   2HB   GLU 108          HB3       GLU 108  23.009 -12.794 -10.012
  774   1HG   GLU 108          HG2       GLU 108  25.956 -13.487  -9.733
  775   2HG   GLU 108          HG3       GLU 108  24.570 -14.539  -9.435
  776    H    LEU 109           H        LEU 109  23.668  -9.383  -8.955
  777    HA   LEU 109           HA       LEU 109  20.970  -8.985  -9.898
  778   1HB   LEU 109          HB2       LEU 109  22.863  -7.329  -8.174
  779   2HB   LEU 109          HB3       LEU 109  21.228  -6.788  -8.546
  780    HG   LEU 109           HG       LEU 109  21.857  -9.439  -7.174
  781   1HD1  LEU 109          HD11      LEU 109  22.520  -7.473  -5.809
  782   2HD1  LEU 109          HD12      LEU 109  20.871  -6.835  -5.945
  783   3HD1  LEU 109          HD13      LEU 109  21.175  -8.373  -5.096
  784   1HD2  LEU 109          HD21      LEU 109  19.255  -7.901  -7.576
  785   2HD2  LEU 109          HD22      LEU 109  19.668  -9.491  -8.260
  786   3HD2  LEU 109          HD23      LEU 109  19.449  -9.313  -6.517
  787    H    LYS 110           H        LYS 110  24.028  -7.201 -10.508
  788    HA   LYS 110           HA       LYS 110  22.836  -5.217 -12.179
  789   1HB   LYS 110          HB2       LYS 110  25.694  -6.251 -11.908
  790   2HB   LYS 110          HB3       LYS 110  25.245  -4.766 -12.764
  791   1HG   LYS 110          HG2       LYS 110  24.479  -3.706 -10.757
  792   2HG   LYS 110          HG3       LYS 110  24.428  -5.177  -9.854
  793   1HD   LYS 110          HD2       LYS 110  26.298  -4.256  -8.969
  794   2HD   LYS 110          HD3       LYS 110  26.999  -5.331 -10.167
  795   1HE   LYS 110          HE2       LYS 110  27.408  -3.491 -11.704
  796   2HE   LYS 110          HE3       LYS 110  26.433  -2.388 -10.725
  797   1HZ   LYS 110          HZ1       LYS 110  28.760  -2.024 -10.295
  798   2HZ   LYS 110          HZ2       LYS 110  28.061  -2.626  -8.935
  799   3HZ   LYS 110          HZ3       LYS 110  29.006  -3.583  -9.883
  800    H    ASN 111           H        ASN 111  24.265  -8.410 -12.809
  801    HA   ASN 111           HA       ASN 111  24.140  -8.349 -15.672
  802   1HB   ASN 111          HB2       ASN 111  25.456 -10.064 -15.046
  803   2HB   ASN 111          HB3       ASN 111  24.708 -10.262 -13.496
  804   1HD2  ASN 111          HD21      ASN 111  22.854 -11.567 -13.166
  805   2HD2  ASN 111          HD22      ASN 111  22.635 -12.927 -14.223
  806    H    SER 112           H        SER 112  21.803  -9.261 -13.120
  807    HA   SER 112           HA       SER 112  19.846 -10.318 -14.923
  808   1HB   SER 112          HB2       SER 112  19.482  -9.191 -12.145
  809   2HB   SER 112          HB3       SER 112  18.315 -10.178 -13.040
  810    HG   SER 112           HG       SER 112  20.865 -10.923 -12.069
  811    H    GLY 113           H        GLY 113  20.469  -7.055 -13.567
  812   1HA   GLY 113          HA2       GLY 113  20.061  -5.592 -15.724
  813   2HA   GLY 113          HA3       GLY 113  18.373  -5.878 -15.305
  814    H    ALA 114           H        ALA 114  19.509  -5.719 -12.241
  815    HA   ALA 114           HA       ALA 114  18.292  -3.143 -12.065
  816   1HB   ALA 114          HB1       ALA 114  18.065  -4.853 -10.235
  817   2HB   ALA 114          HB2       ALA 114  19.781  -4.596  -9.844
  818   3HB   ALA 114          HB3       ALA 114  18.592  -3.267  -9.701
  819    H    LYS 115           H        LYS 115  19.174  -1.114 -11.663
  820    HA   LYS 115           HA       LYS 115  22.047  -0.879 -12.335
  821   1HB   LYS 115          HB2       LYS 115  21.623   1.559 -12.388
  822   2HB   LYS 115          HB3       LYS 115  20.713   0.604 -13.553
  823   1HG   LYS 115          HG2       LYS 115  18.670   0.813 -12.123
  824   2HG   LYS 115          HG3       LYS 115  19.605   1.781 -10.977
  825   1HD   LYS 115          HD2       LYS 115  18.303   3.263 -12.317
  826   2HD   LYS 115          HD3       LYS 115  20.007   3.480 -12.743
  827   1HE   LYS 115          HE2       LYS 115  19.681   2.048 -14.757
  828   2HE   LYS 115          HE3       LYS 115  17.992   1.788 -14.304
  829   1HZ   LYS 115          HZ1       LYS 115  17.615   4.168 -14.604
  830   2HZ   LYS 115          HZ2       LYS 115  19.181   4.410 -15.014
  831   3HZ   LYS 115          HZ3       LYS 115  18.212   3.517 -15.970
  832    H    GLN 116           H        GLN 116  23.452  -1.188 -10.692
  833    HA   GLN 116           HA       GLN 116  22.754  -0.687  -7.932
  834   1HB   GLN 116          HB2       GLN 116  24.522  -2.315  -8.570
  835   2HB   GLN 116          HB3       GLN 116  25.524  -0.960  -9.116
  836   1HG   GLN 116          HG2       GLN 116  25.533  -0.002  -6.849
  837   2HG   GLN 116          HG3       GLN 116  24.351  -1.196  -6.314
  838   1HE2  GLN 116          HE22      GLN 116  25.738  -1.836  -4.602
  839   2HE2  GLN 116          HE21      GLN 116  27.116  -2.846  -4.846
  840    H    THR 117           H        THR 117  22.371   1.349  -7.221
  841    HA   THR 117           HA       THR 117  23.420   3.653  -8.760
  842    HB   THR 117           HB       THR 117  21.524   3.492  -6.392
  843    HG1  THR 117           HG1      THR 117  20.954   2.426  -8.458
  844   1HG2  THR 117          HG21      THR 117  20.746   5.719  -7.142
  845   2HG2  THR 117          HG22      THR 117  22.457   5.798  -6.737
  846   3HG2  THR 117          HG23      THR 117  21.972   5.722  -8.436
  847    H    GLY 118           H        GLY 118  24.690   5.319  -7.782
  848   1HA   GLY 118          HA2       GLY 118  26.283   6.234  -6.423
  849   2HA   GLY 118          HA3       GLY 118  25.426   5.483  -5.072
  850    H    GLU 119           H        GLU 119  26.711   4.227  -3.905
  851    HA   GLU 119           HA       GLU 119  28.073   2.006  -5.098
  852   1HB   GLU 119          HB2       GLU 119  30.262   2.338  -4.168
  853   2HB   GLU 119          HB3       GLU 119  29.876   3.728  -5.177
  854   1HG   GLU 119          HG2       GLU 119  29.226   4.979  -3.051
  855   2HG   GLU 119          HG3       GLU 119  29.871   3.600  -2.151
  856    H    THR 120           H        THR 120  28.542   0.401  -3.424
  857    HA   THR 120           HA       THR 120  26.484  -0.191  -1.887
  858    HB   THR 120           HB       THR 120  29.394  -0.945  -1.488
  859    HG1  THR 120           HG1      THR 120  28.454  -2.687  -2.940
  860   1HG2  THR 120          HG21      THR 120  28.409  -3.130  -0.750
  861   2HG2  THR 120          HG22      THR 120  28.165  -1.799   0.395
  862   3HG2  THR 120          HG23      THR 120  26.824  -2.321  -0.629
  863    H    LEU 121           H        LEU 121  25.641   0.221   0.091
  864    HA   LEU 121           HA       LEU 121  26.728   2.477   1.641
  865   1HB   LEU 121          HB2       LEU 121  24.260   2.039   0.787
  866   2HB   LEU 121          HB3       LEU 121  24.154   0.946   2.129
  867    HG   LEU 121           HG       LEU 121  25.226   3.566   2.971
  868   1HD1  LEU 121          HD11      LEU 121  23.776   4.377   1.117
  869   2HD1  LEU 121          HD12      LEU 121  22.410   3.455   1.776
  870   3HD1  LEU 121          HD13      LEU 121  23.100   4.808   2.697
  871   1HD2  LEU 121          HD21      LEU 121  23.507   3.423   4.684
  872   2HD2  LEU 121          HD22      LEU 121  22.708   2.086   3.835
  873   3HD2  LEU 121          HD23      LEU 121  24.321   1.867   4.548
  874    H    LYS 122           H        LYS 122  26.725   2.216   4.105
  875    HA   LYS 122           HA       LYS 122  27.326  -0.579   4.959
  876   1HB   LYS 122          HB2       LYS 122  29.042   1.898   5.271
  877   2HB   LYS 122          HB3       LYS 122  29.289   0.458   6.233
  878   1HG   LYS 122          HG2       LYS 122  29.863  -0.870   4.372
  879   2HG   LYS 122          HG3       LYS 122  29.268   0.283   3.187
  880   1HD   LYS 122          HD2       LYS 122  31.661   0.811   4.972
  881   2HD   LYS 122          HD3       LYS 122  31.735   0.158   3.328
  882   1HE   LYS 122          HE2       LYS 122  30.533   2.194   2.482
  883   2HE   LYS 122          HE3       LYS 122  30.583   2.869   4.118
  884   1HZ   LYS 122          HZ1       LYS 122  32.396   3.734   2.892
  885   2HZ   LYS 122          HZ2       LYS 122  33.038   2.689   3.991
  886   3HZ   LYS 122          HZ3       LYS 122  32.920   2.254   2.413
  887    H    ILE 123           H        ILE 123  26.896  -0.985   7.083
  888    HA   ILE 123           HA       ILE 123  25.533   1.001   8.799
  889    HB   ILE 123           HB       ILE 123  23.760  -0.836   9.092
  890   1HG1  ILE 123          HG12      ILE 123  23.270  -2.198   7.078
  891   2HG1  ILE 123          HG13      ILE 123  24.798  -1.796   6.375
  892   1HG2  ILE 123          HG21      ILE 123  23.396   1.340   7.936
  893   2HG2  ILE 123          HG22      ILE 123  23.778   0.547   6.392
  894   3HG2  ILE 123          HG23      ILE 123  22.377   0.024   7.346
  895   1HD1  ILE 123          HD11      ILE 123  25.979  -3.121   8.016
  896   2HD1  ILE 123          HD12      ILE 123  24.532  -3.236   9.054
  897   3HD1  ILE 123          HD13      ILE 123  24.592  -4.074   7.493
  898    H    ASN 124           H        ASN 124  24.980  -0.099  10.884
  899    HA   ASN 124           HA       ASN 124  26.715  -2.339  11.721
  900   1HB   ASN 124          HB2       ASN 124  26.538   0.383  13.115
  901   2HB   ASN 124          HB3       ASN 124  27.009  -1.084  13.957
  902   1HD2  ASN 124          HD22      ASN 124  28.398  -1.268  10.815
  903   2HD2  ASN 124          HD21      ASN 124  29.921  -0.529  11.235
  904    H    ILE 125           H        ILE 125  25.794  -3.119  13.927
  905    HA   ILE 125           HA       ILE 125  22.851  -2.639  14.016
  906    HB   ILE 125           HB       ILE 125  23.527  -4.864  13.283
  907   1HG1  ILE 125          HG12      ILE 125  22.151  -5.063  15.981
  908   2HG1  ILE 125          HG13      ILE 125  21.394  -4.383  14.539
  909   1HG2  ILE 125          HG21      ILE 125  24.696  -5.280  16.061
  910   2HG2  ILE 125          HG22      ILE 125  24.540  -6.502  14.790
  911   3HG2  ILE 125          HG23      ILE 125  25.626  -5.148  14.544
  912   1HD1  ILE 125          HD11      ILE 125  21.758  -6.550  13.348
  913   2HD1  ILE 125          HD12      ILE 125  22.388  -7.239  14.865
  914   3HD1  ILE 125          HD13      ILE 125  20.710  -6.681  14.774
  915    H    LEU 126           H        LEU 126  25.529  -1.568  15.411
  916    HA   LEU 126           HA       LEU 126  26.030  -0.324  17.163
  917   1HB   LEU 126          HB2       LEU 126  23.215  -0.685  18.234
  918   2HB   LEU 126          HB3       LEU 126  24.413   0.482  18.767
  919    HG   LEU 126           HG       LEU 126  23.075   0.423  16.026
  920   1HD1  LEU 126          HD11      LEU 126  21.987   2.491  16.773
  921   2HD1  LEU 126          HD12      LEU 126  21.608   1.156  17.871
  922   3HD1  LEU 126          HD13      LEU 126  22.804   2.378  18.349
  923   1HD2  LEU 126          HD21      LEU 126  25.340   1.321  15.760
  924   2HD2  LEU 126          HD22      LEU 126  24.169   2.636  15.669
  925   3HD2  LEU 126          HD23      LEU 126  25.110   2.397  17.158
  926    H    ASP 127           H        ASP 127  24.169  -3.222  18.104
  927    HA   ASP 127           HA       ASP 127  25.697  -3.801  20.483
  928   1HB   ASP 127          HB2       ASP 127  23.510  -4.815  20.018
  929   2HB   ASP 127          HB3       ASP 127  24.148  -5.591  18.567
  930    H    HIS 128           H        HIS 128  26.342  -4.085  17.054
  931    HA   HIS 128           HA       HIS 128  29.041  -5.000  17.483
  932   1HB   HIS 128          HB2       HIS 128  27.581  -7.124  17.372
  933   2HB   HIS 128          HB3       HIS 128  27.205  -6.679  15.714
  934    HD1  HIS 128           HD1      HIS 128  30.650  -6.887  17.585
  935    HD2  HIS 128           HD2      HIS 128  28.540  -8.353  14.247
  936    HE1  HIS 128           HE1      HIS 128  32.265  -8.386  16.321
  937    H    ASP 129           H        ASP 129  30.051  -5.186  15.143
  938    HA   ASP 129           HA       ASP 129  28.971  -3.254  13.254
  939   1HB   ASP 129          HB2       ASP 129  30.903  -1.890  13.213
  940   2HB   ASP 129          HB3       ASP 129  30.495  -2.021  14.919
  941    H    ILE 130           H        ILE 130  30.053  -3.505  11.138
  942    HA   ILE 130           HA       ILE 130  31.432  -6.121  10.833
  943    HB   ILE 130           HB       ILE 130  28.869  -5.245   9.497
  944   1HG1  ILE 130          HG12      ILE 130  28.595  -6.429  11.624
  945   2HG1  ILE 130          HG13      ILE 130  27.922  -7.276  10.250
  946   1HG2  ILE 130          HG21      ILE 130  29.052  -7.299   8.086
  947   2HG2  ILE 130          HG22      ILE 130  30.232  -6.062   7.663
  948   3HG2  ILE 130          HG23      ILE 130  30.745  -7.469   8.609
  949   1HD1  ILE 130          HD11      ILE 130  30.562  -8.002  11.597
  950   2HD1  ILE 130          HD12      ILE 130  29.007  -8.819  11.815
  951   3HD1  ILE 130          HD13      ILE 130  29.805  -8.870  10.241
  952    HA   PRO 131           HA       PRO 131  32.863  -3.894   7.067
  953   1HB   PRO 131          HB2       PRO 131  31.905  -1.523   6.084
  954   2HB   PRO 131          HB3       PRO 131  31.154  -3.110   5.742
  955   1HG   PRO 131          HG2       PRO 131  30.313  -1.072   7.832
  956   2HG   PRO 131          HG3       PRO 131  29.289  -1.971   6.677
  957   1HD   PRO 131          HD2       PRO 131  29.607  -2.786   9.260
  958   2HD   PRO 131          HD3       PRO 131  29.427  -3.930   7.896
  959    H    GLU 132           H        GLU 132  31.792  -1.074   8.966
  960    HA   GLU 132           HA       GLU 132  34.183  -0.467  10.321
  961   1HB   GLU 132          HB2       GLU 132  34.799   1.615   9.188
  962   2HB   GLU 132          HB3       GLU 132  35.046   0.254   8.112
  963   1HG   GLU 132          HG2       GLU 132  32.932   0.760   6.935
  964   2HG   GLU 132          HG3       GLU 132  32.635   2.124   8.006
  965    H    ASP 133           H        ASP 133  33.754   2.127  10.986
  966    HA   ASP 133           HA       ASP 133  31.110   2.289  12.176
  967   1HB   ASP 133          HB2       ASP 133  32.973   3.288  13.320
  968   2HB   ASP 133          HB3       ASP 133  33.420   4.239  11.901
  969    HA   PRO 134           HA       PRO 134  29.592   3.763   8.172
  970   1HB   PRO 134          HB2       PRO 134  26.914   3.824   8.650
  971   2HB   PRO 134          HB3       PRO 134  27.843   2.294   8.618
  972   1HG   PRO 134          HG2       PRO 134  27.086   3.935  11.061
  973   2HG   PRO 134          HG3       PRO 134  26.797   2.186  10.775
  974   1HD   PRO 134          HD2       PRO 134  28.975   3.052  12.152
  975   2HD   PRO 134          HD3       PRO 134  29.087   1.675  11.017
  976    H    ALA 135           H        ALA 135  28.034   5.569   7.343
  977    HA   ALA 135           HA       ALA 135  27.736   7.877   9.129
  978   1HB   ALA 135          HB1       ALA 135  29.948   8.267   8.070
  979   2HB   ALA 135          HB2       ALA 135  29.225   8.037   6.460
  980   3HB   ALA 135          HB3       ALA 135  28.739   9.417   7.471
  981    H    GLU 136           H        GLU 136  25.889   8.980   8.639
  982    HA   GLU 136           HA       GLU 136  23.958   7.833   6.880
  983   1HB   GLU 136          HB2       GLU 136  22.533   9.668   7.560
  984   2HB   GLU 136          HB3       GLU 136  23.387   9.013   8.956
  985   1HG   GLU 136          HG2       GLU 136  25.018  10.913   8.825
  986   2HG   GLU 136          HG3       GLU 136  24.114  11.577   7.464
  987    H    GLU 137           H        GLU 137  26.537  10.024   6.242
  988    HA   GLU 137           HA       GLU 137  25.487  11.624   4.185
  989   1HB   GLU 137          HB2       GLU 137  28.297  10.496   4.547
  990   2HB   GLU 137          HB3       GLU 137  27.857  11.778   3.409
  991   1HG   GLU 137          HG2       GLU 137  27.038  13.169   5.321
  992   2HG   GLU 137          HG3       GLU 137  27.582  11.920   6.444
  993    H    TRP 138           H        TRP 138  26.460   8.186   4.080
  994    HA   TRP 138           HA       TRP 138  26.525   7.962   1.234
  995   1HB   TRP 138          HB2       TRP 138  26.684   6.144   3.514
  996   2HB   TRP 138          HB3       TRP 138  25.493   5.577   2.402
  997    HD1  TRP 138           HD1      TRP 138  26.196   4.681   0.076
  998    HE1  TRP 138           HE1      TRP 138  28.402   3.913  -0.913
  999    HE3  TRP 138           HE3      TRP 138  29.337   6.823   3.492
 1000    HZ2  TRP 138           HZ2      TRP 138  31.257   4.287  -0.338
 1001    HZ3  TRP 138           HZ3      TRP 138  31.802   6.669   3.208
 1002    HH2  TRP 138           HH2      TRP 138  32.767   5.430   1.273
 1003    H    LEU 139           H        LEU 139  23.910   7.707   3.632
 1004    HA   LEU 139           HA       LEU 139  21.826   6.775   1.918
 1005   1HB   LEU 139          HB2       LEU 139  22.198   7.107   4.622
 1006   2HB   LEU 139          HB3       LEU 139  21.325   8.567   4.314
 1007    HG   LEU 139           HG       LEU 139  19.798   6.921   5.079
 1008   1HD1  LEU 139          HD11      LEU 139  19.378   7.206   2.095
 1009   2HD1  LEU 139          HD12      LEU 139  18.126   6.998   3.338
 1010   3HD1  LEU 139          HD13      LEU 139  19.075   8.496   3.277
 1011   1HD2  LEU 139          HD21      LEU 139  19.329   4.808   3.982
 1012   2HD2  LEU 139          HD22      LEU 139  20.547   5.120   2.735
 1013   3HD2  LEU 139          HD23      LEU 139  21.040   4.869   4.424
 1014    H    GLY 140           H        GLY 140  22.735   9.967   3.206
 1015   1HA   GLY 140          HA2       GLY 140  20.896  11.578   1.810
 1016   2HA   GLY 140          HA3       GLY 140  22.487  12.113   2.380
 1017    H    SER 141           H        SER 141  24.241  10.549   0.704
 1018    HA   SER 141           HA       SER 141  24.351  11.958  -1.678
 1019   1HB   SER 141          HB2       SER 141  25.474   9.349  -0.573
 1020   2HB   SER 141          HB3       SER 141  25.928  10.035  -2.094
 1021    HG   SER 141           HG       SER 141  26.292  11.013   0.508
 1022    H    TRP 142           H        TRP 142  23.517   8.492  -1.119
 1023    HA   TRP 142           HA       TRP 142  22.743   7.924  -3.744
 1024   1HB   TRP 142          HB2       TRP 142  23.271   6.230  -2.162
 1025   2HB   TRP 142          HB3       TRP 142  21.986   6.735  -1.080
 1026    HD1  TRP 142           HD1      TRP 142  22.264   5.233  -4.637
 1027    HE1  TRP 142           HE1      TRP 142  20.130   3.868  -5.124
 1028    HE3  TRP 142           HE3      TRP 142  19.850   6.019  -0.224
 1029    HZ2  TRP 142           HZ2      TRP 142  17.706   3.128  -3.685
 1030    HZ3  TRP 142           HZ3      TRP 142  17.670   4.974   0.215
 1031    HH2  TRP 142           HH2      TRP 142  16.560   3.546  -1.513
 1032    H    VAL 143           H        VAL 143  20.628   9.025  -1.031
 1033    HA   VAL 143           HA       VAL 143  18.196   8.888  -2.492
 1034    HB   VAL 143           HB       VAL 143  19.085  10.450  -0.051
 1035   1HG1  VAL 143          HG11      VAL 143  16.735  11.056   0.371
 1036   2HG1  VAL 143          HG12      VAL 143  17.355  11.867  -1.059
 1037   3HG1  VAL 143          HG13      VAL 143  16.288  10.450  -1.247
 1038   1HG2  VAL 143          HG21      VAL 143  17.563   8.883   1.087
 1039   2HG2  VAL 143          HG22      VAL 143  17.050   8.197  -0.471
 1040   3HG2  VAL 143          HG23      VAL 143  18.710   7.975   0.092
 1041    H    ASN 144           H        ASN 144  20.420  11.755  -2.037
 1042    HA   ASN 144           HA       ASN 144  18.674  13.291  -3.705
 1043   1HB   ASN 144          HB2       ASN 144  19.864  15.129  -3.353
 1044   2HB   ASN 144          HB3       ASN 144  20.314  14.208  -1.925
 1045   1HD2  ASN 144          HD22      ASN 144  22.416  13.024  -2.044
 1046   2HD2  ASN 144          HD21      ASN 144  23.667  13.618  -3.120
 1047    H    LEU 145           H        LEU 145  21.100  10.991  -4.500
 1048    HA   LEU 145           HA       LEU 145  21.448  11.933  -7.260
 1049   1HB   LEU 145          HB2       LEU 145  22.450   9.649  -5.595
 1050   2HB   LEU 145          HB3       LEU 145  22.189   9.296  -7.292
 1051    HG   LEU 145           HG       LEU 145  23.639  11.121  -7.993
 1052   1HD1  LEU 145          HD11      LEU 145  24.242  11.587  -5.043
 1053   2HD1  LEU 145          HD12      LEU 145  25.064  12.351  -6.417
 1054   3HD1  LEU 145          HD13      LEU 145  23.362  12.706  -6.100
 1055   1HD2  LEU 145          HD21      LEU 145  24.577   8.873  -7.611
 1056   2HD2  LEU 145          HD22      LEU 145  25.772  10.127  -7.250
 1057   3HD2  LEU 145          HD23      LEU 145  24.933   9.294  -5.922
 1058    H    LEU 146           H        LEU 146  19.505   9.330  -5.611
 1059    HA   LEU 146           HA       LEU 146  18.415   8.420  -8.078
 1060   1HB   LEU 146          HB2       LEU 146  17.256   6.925  -6.870
 1061   2HB   LEU 146          HB3       LEU 146  18.647   7.186  -5.862
 1062    HG   LEU 146           HG       LEU 146  16.921   8.827  -4.583
 1063   1HD1  LEU 146          HD11      LEU 146  15.079   6.771  -5.895
 1064   2HD1  LEU 146          HD12      LEU 146  14.644   7.833  -4.547
 1065   3HD1  LEU 146          HD13      LEU 146  14.990   8.527  -6.125
 1066   1HD2  LEU 146          HD21      LEU 146  16.826   5.799  -4.356
 1067   2HD2  LEU 146          HD22      LEU 146  18.049   6.855  -3.623
 1068   3HD2  LEU 146          HD23      LEU 146  16.366   6.964  -3.095
 1069    H    LYS 147           H        LYS 147  17.365  10.792  -5.720
 1070    HA   LYS 147           HA       LYS 147  14.764  11.380  -6.646
 1071   1HB   LYS 147          HB2       LYS 147  16.925  12.910  -5.167
 1072   2HB   LYS 147          HB3       LYS 147  15.475  13.752  -5.726
 1073   1HG   LYS 147          HG2       LYS 147  14.027  12.164  -4.511
 1074   2HG   LYS 147          HG3       LYS 147  15.454  11.299  -3.917
 1075   1HD   LYS 147          HD2       LYS 147  16.233  13.363  -2.783
 1076   2HD   LYS 147          HD3       LYS 147  14.808  14.238  -3.347
 1077   1HE   LYS 147          HE2       LYS 147  14.700  11.739  -1.593
 1078   2HE   LYS 147          HE3       LYS 147  14.737  13.379  -0.948
 1079   1HZ   LYS 147          HZ1       LYS 147  12.640  13.823  -2.016
 1080   2HZ   LYS 147          HZ2       LYS 147  12.597  12.339  -2.714
 1081   3HZ   LYS 147          HZ3       LYS 147  12.516  12.478  -1.086
  Start of MODEL   10
    1   1H    MET   1          H1        MET   1   2.160  -1.187   2.120
    2   2H    MET   1          H2        MET   1   1.727  -2.495   1.217
    3   3H    MET   1          H3        MET   1   3.307  -2.248   1.630
    4    HA   MET   1           HA       MET   1   2.950  -1.703  -0.652
    5   1HB   MET   1          HB2       MET   1   0.596  -0.986  -0.479
    6   2HB   MET   1          HB3       MET   1   1.078   0.440   0.452
    7   1HG   MET   1          HG2       MET   1   0.660   0.950  -1.931
    8   2HG   MET   1          HG3       MET   1   2.307   1.333  -1.445
    9   1HE   MET   1          HE1       MET   1   3.236   1.549  -3.849
   10   2HE   MET   1          HE2       MET   1   2.898   0.395  -5.157
   11   3HE   MET   1          HE3       MET   1   1.571   1.337  -4.440
   12    H    ALA   2           H        ALA   2   4.662  -0.516  -1.444
   13    HA   ALA   2           HA       ALA   2   5.925   1.571   0.196
   14   1HB   ALA   2          HB1       ALA   2   7.140  -1.174  -0.378
   15   2HB   ALA   2          HB2       ALA   2   8.045   0.210   0.248
   16   3HB   ALA   2          HB3       ALA   2   6.753  -0.515   1.224
   17    H    ASP   3           H        ASP   3   7.806   2.452  -0.925
   18    HA   ASP   3           HA       ASP   3   7.705   2.305  -3.867
   19   1HB   ASP   3          HB2       ASP   3   7.732   4.523  -2.618
   20   2HB   ASP   3          HB3       ASP   3   9.319   4.096  -2.010
   21    H    ILE   4           H        ILE   4   9.579   1.328  -1.069
   22    HA   ILE   4           HA       ILE   4  11.728   0.213  -2.803
   23    HB   ILE   4           HB       ILE   4  12.113   1.529  -0.087
   24   1HG1  ILE   4          HG12      ILE   4  12.932   2.678  -2.785
   25   2HG1  ILE   4          HG13      ILE   4  11.544   3.239  -1.856
   26   1HG2  ILE   4          HG21      ILE   4  14.525   1.314  -0.626
   27   2HG2  ILE   4          HG22      ILE   4  13.729  -0.246  -0.577
   28   3HG2  ILE   4          HG23      ILE   4  14.101   0.489  -2.144
   29   1HD1  ILE   4          HD11      ILE   4  13.026   3.895   0.016
   30   2HD1  ILE   4          HD12      ILE   4  14.434   3.489  -0.989
   31   3HD1  ILE   4          HD13      ILE   4  13.330   4.771  -1.495
   32    H    THR   5           H        THR   5  11.947  -1.942  -2.486
   33    HA   THR   5           HA       THR   5  10.848  -3.226  -0.054
   34    HB   THR   5           HB       THR   5  10.352  -4.302  -2.246
   35    HG1  THR   5           HG1      THR   5  10.533  -5.782  -0.708
   36   1HG2  THR   5          HG21      THR   5  12.236  -3.591  -3.614
   37   2HG2  THR   5          HG22      THR   5  13.333  -4.632  -2.674
   38   3HG2  THR   5          HG23      THR   5  12.029  -5.344  -3.637
   39    H    LEU   6           H        LEU   6  12.258  -3.823   1.634
   40    HA   LEU   6           HA       LEU   6  15.198  -3.429   1.203
   41   1HB   LEU   6          HB2       LEU   6  13.480  -3.098   3.678
   42   2HB   LEU   6          HB3       LEU   6  15.185  -3.428   3.769
   43    HG   LEU   6           HG       LEU   6  15.491  -1.379   2.157
   44   1HD1  LEU   6          HD11      LEU   6  13.098  -0.982   1.692
   45   2HD1  LEU   6          HD12      LEU   6  12.796  -0.746   3.424
   46   3HD1  LEU   6          HD13      LEU   6  13.816   0.404   2.520
   47   1HD2  LEU   6          HD21      LEU   6  15.637   0.130   4.122
   48   2HD2  LEU   6          HD22      LEU   6  14.784  -1.100   5.087
   49   3HD2  LEU   6          HD23      LEU   6  16.380  -1.450   4.408
   50    H    ILE   7           H        ILE   7  15.641  -5.362   0.423
   51    HA   ILE   7           HA       ILE   7  14.419  -7.797   1.425
   52    HB   ILE   7           HB       ILE   7  16.683  -7.439  -0.592
   53   1HG1  ILE   7          HG12      ILE   7  13.673  -7.641  -1.116
   54   2HG1  ILE   7          HG13      ILE   7  14.636  -6.177  -1.302
   55   1HG2  ILE   7          HG21      ILE   7  16.046  -9.705  -1.317
   56   2HG2  ILE   7          HG22      ILE   7  16.401  -9.728   0.405
   57   3HG2  ILE   7          HG23      ILE   7  14.710  -9.726  -0.143
   58   1HD1  ILE   7          HD11      ILE   7  14.291  -7.101  -3.469
   59   2HD1  ILE   7          HD12      ILE   7  16.007  -7.291  -3.055
   60   3HD1  ILE   7          HD13      ILE   7  14.900  -8.687  -2.982
   61    H    SER   8           H        SER   8  15.061  -8.542   3.333
   62    HA   SER   8           HA       SER   8  17.926  -8.534   4.132
   63   1HB   SER   8          HB2       SER   8  15.614  -8.320   6.065
   64   2HB   SER   8          HB3       SER   8  17.306  -7.840   6.279
   65    HG   SER   8           HG       SER   8  15.333  -6.588   4.661
   66    H    GLY   9           H        GLY   9  17.354 -10.168   6.507
   67   1HA   GLY   9          HA2       GLY   9  16.897 -12.298   7.132
   68   2HA   GLY   9          HA3       GLY   9  15.819 -12.468   5.742
   69    H    SER  10           H        SER  10  19.244 -11.631   5.435
   70    HA   SER  10           HA       SER  10  19.968 -12.832   3.272
   71   1HB   SER  10          HB2       SER  10  21.800 -13.022   5.672
   72   2HB   SER  10          HB3       SER  10  22.202 -12.548   4.014
   73    HG   SER  10           HG       SER  10  22.004 -10.849   5.695
   74    H    THR  11           H        THR  11  20.173 -14.683   6.368
   75    HA   THR  11           HA       THR  11  20.357 -17.216   4.802
   76    HB   THR  11           HB       THR  11  21.830 -17.986   6.723
   77    HG1  THR  11           HG1      THR  11  21.400 -16.370   8.228
   78   1HG2  THR  11          HG21      THR  11  22.775 -17.293   4.522
   79   2HG2  THR  11          HG22      THR  11  22.931 -15.631   5.120
   80   3HG2  THR  11          HG23      THR  11  23.860 -16.943   5.871
   81    H    LEU  12           H        LEU  12  17.943 -16.310   5.242
   82    HA   LEU  12           HA       LEU  12  15.958 -16.555   6.136
   83   1HB   LEU  12          HB2       LEU  12  16.540 -19.007   5.945
   84   2HB   LEU  12          HB3       LEU  12  16.930 -18.991   7.662
   85    HG   LEU  12           HG       LEU  12  14.573 -18.404   8.205
   86   1HD1  LEU  12          HD11      LEU  12  13.865 -17.136   6.239
   87   2HD1  LEU  12          HD12      LEU  12  14.127 -18.550   5.189
   88   3HD1  LEU  12          HD13      LEU  12  12.836 -18.553   6.411
   89   1HD2  LEU  12          HD21      LEU  12  14.824 -20.789   6.330
   90   2HD2  LEU  12          HD22      LEU  12  15.270 -20.762   8.050
   91   3HD2  LEU  12          HD23      LEU  12  13.578 -20.549   7.576
   92    H    GLY  13           H        GLY  13  17.933 -14.920   7.230
   93   1HA   GLY  13          HA2       GLY  13  16.770 -13.587   9.334
   94   2HA   GLY  13          HA3       GLY  13  17.906 -14.726  10.093
   95    H    GLY  14           H        GLY  14  18.140 -11.740   9.878
   96   1HA   GLY  14          HA2       GLY  14  20.908 -11.513   9.028
   97   2HA   GLY  14          HA3       GLY  14  19.742 -10.822   7.888
   98    H    ALA  15           H        ALA  15  20.712  -8.763   8.374
   99    HA   ALA  15           HA       ALA  15  20.700  -7.639  11.039
  100   1HB   ALA  15          HB1       ALA  15  21.698  -5.698   9.922
  101   2HB   ALA  15          HB2       ALA  15  22.480  -7.184   9.365
  102   3HB   ALA  15          HB3       ALA  15  21.284  -6.364   8.330
  103    H    GLU  16           H        GLU  16  18.032  -8.372  10.385
  104    HA   GLU  16           HA       GLU  16  16.484  -6.459   9.089
  105   1HB   GLU  16          HB2       GLU  16  15.767  -8.371  11.339
  106   2HB   GLU  16          HB3       GLU  16  14.591  -7.270  10.615
  107   1HG   GLU  16          HG2       GLU  16  14.301  -9.340   9.520
  108   2HG   GLU  16          HG3       GLU  16  15.049  -8.242   8.368
  109    H    TYR  17           H        TYR  17  17.642  -6.313  12.469
  110    HA   TYR  17           HA       TYR  17  15.982  -4.163  13.339
  111   1HB   TYR  17          HB2       TYR  17  17.328  -5.502  14.873
  112   2HB   TYR  17          HB3       TYR  17  18.817  -4.972  14.102
  113    HD1  TYR  17           HD1      TYR  17  15.891  -3.790  16.122
  114    HD2  TYR  17           HD2      TYR  17  19.895  -2.928  14.752
  115    HE1  TYR  17           HE1      TYR  17  16.011  -1.870  17.683
  116    HE2  TYR  17           HE2      TYR  17  20.024  -1.010  16.305
  117    HH   TYR  17           HH       TYR  17  18.918   0.235  17.938
  118    H    VAL  18           H        VAL  18  19.064  -4.205  11.506
  119    HA   VAL  18           HA       VAL  18  19.360  -1.307  11.573
  120    HB   VAL  18           HB       VAL  18  20.757  -3.322   9.759
  121   1HG1  VAL  18          HG11      VAL  18  21.557  -0.549  10.758
  122   2HG1  VAL  18          HG12      VAL  18  22.557  -1.627   9.763
  123   3HG1  VAL  18          HG13      VAL  18  21.055  -0.964   9.104
  124   1HG2  VAL  18          HG21      VAL  18  21.156  -4.076  12.064
  125   2HG2  VAL  18          HG22      VAL  18  22.609  -3.309  11.436
  126   3HG2  VAL  18          HG23      VAL  18  21.566  -2.418  12.562
  127    H    ALA  19           H        ALA  19  18.123  -3.827   9.323
  128    HA   ALA  19           HA       ALA  19  17.553  -2.110   7.140
  129   1HB   ALA  19          HB1       ALA  19  17.503  -4.599   7.041
  130   2HB   ALA  19          HB2       ALA  19  15.989  -4.573   7.980
  131   3HB   ALA  19          HB3       ALA  19  16.050  -3.833   6.374
  132    H    GLU  20           H        GLU  20  15.545  -2.897  10.055
  133    HA   GLU  20           HA       GLU  20  13.317  -1.346   9.251
  134   1HB   GLU  20          HB2       GLU  20  13.411  -3.065  11.091
  135   2HB   GLU  20          HB3       GLU  20  14.257  -1.882  12.099
  136   1HG   GLU  20          HG2       GLU  20  12.313  -0.343  11.899
  137   2HG   GLU  20          HG3       GLU  20  11.497  -1.502  10.850
  138    H    HIS  21           H        HIS  21  16.286  -0.387  11.066
  139    HA   HIS  21           HA       HIS  21  15.426   2.302  11.588
  140   1HB   HIS  21          HB2       HIS  21  17.319   1.127  12.728
  141   2HB   HIS  21          HB3       HIS  21  18.261   1.242  11.240
  142    HD1  HIS  21           HD1      HIS  21  17.248   3.314  14.249
  143    HD2  HIS  21           HD2      HIS  21  18.951   3.811  10.430
  144    HE1  HIS  21           HE1      HIS  21  18.288   5.637  14.226
  145    H    LEU  22           H        LEU  22  17.279   0.827   8.907
  146    HA   LEU  22           HA       LEU  22  17.802   3.164   7.383
  147   1HB   LEU  22          HB2       LEU  22  17.456   0.210   6.791
  148   2HB   LEU  22          HB3       LEU  22  17.671   1.322   5.472
  149    HG   LEU  22           HG       LEU  22  19.602   1.279   7.839
  150   1HD1  LEU  22          HD11      LEU  22  19.482  -1.016   6.988
  151   2HD1  LEU  22          HD12      LEU  22  19.776  -0.440   5.335
  152   3HD1  LEU  22          HD13      LEU  22  21.026  -0.271   6.606
  153   1HD2  LEU  22          HD21      LEU  22  21.211   2.159   6.178
  154   2HD2  LEU  22          HD22      LEU  22  19.954   2.107   4.923
  155   3HD2  LEU  22          HD23      LEU  22  19.795   3.209   6.306
  156    H    ALA  23           H        ALA  23  15.154   0.791   7.090
  157    HA   ALA  23           HA       ALA  23  13.560   2.026   5.187
  158   1HB   ALA  23          HB1       ALA  23  12.724   0.478   7.676
  159   2HB   ALA  23          HB2       ALA  23  11.638   0.881   6.351
  160   3HB   ALA  23          HB3       ALA  23  13.019  -0.178   6.057
  161    H    GLU  24           H        GLU  24  13.510   2.667   8.758
  162    HA   GLU  24           HA       GLU  24  11.450   4.559   8.760
  163   1HB   GLU  24          HB2       GLU  24  12.777   3.455  10.722
  164   2HB   GLU  24          HB3       GLU  24  13.923   4.755  10.533
  165   1HG   GLU  24          HG2       GLU  24  12.478   5.440  12.258
  166   2HG   GLU  24          HG3       GLU  24  12.058   6.418  10.859
  167    H    LYS  25           H        LYS  25  15.001   5.186   8.588
  168    HA   LYS  25           HA       LYS  25  14.884   7.965   8.168
  169   1HB   LYS  25          HB2       LYS  25  16.803   5.851   7.083
  170   2HB   LYS  25          HB3       LYS  25  17.091   7.564   6.960
  171   1HG   LYS  25          HG2       LYS  25  16.785   5.962   9.547
  172   2HG   LYS  25          HG3       LYS  25  18.284   6.481   8.853
  173   1HD   LYS  25          HD2       LYS  25  16.132   8.067  10.229
  174   2HD   LYS  25          HD3       LYS  25  17.819   7.914  10.680
  175   1HE   LYS  25          HE2       LYS  25  16.653   9.549   8.387
  176   2HE   LYS  25          HE3       LYS  25  17.362  10.129   9.887
  177   1HZ   LYS  25          HZ1       LYS  25  18.986  10.357   8.192
  178   2HZ   LYS  25          HZ2       LYS  25  19.527   9.119   9.116
  179   3HZ   LYS  25          HZ3       LYS  25  18.830   8.820   7.676
  180    H    LEU  26           H        LEU  26  14.613   5.358   5.754
  181    HA   LEU  26           HA       LEU  26  14.483   7.199   3.530
  182   1HB   LEU  26          HB2       LEU  26  13.773   4.276   3.841
  183   2HB   LEU  26          HB3       LEU  26  13.634   5.139   2.300
  184    HG   LEU  26           HG       LEU  26  16.224   4.881   3.885
  185   1HD1  LEU  26          HD11      LEU  26  16.878   3.219   2.237
  186   2HD1  LEU  26          HD12      LEU  26  15.420   2.696   3.082
  187   3HD1  LEU  26          HD13      LEU  26  15.295   3.345   1.429
  188   1HD2  LEU  26          HD21      LEU  26  16.311   6.848   2.473
  189   2HD2  LEU  26          HD22      LEU  26  17.262   5.583   1.714
  190   3HD2  LEU  26          HD23      LEU  26  15.636   5.951   1.094
  191    H    GLU  27           H        GLU  27  11.889   5.943   5.727
  192    HA   GLU  27           HA       GLU  27   9.839   6.986   4.005
  193   1HB   GLU  27          HB2       GLU  27   9.838   6.341   6.983
  194   2HB   GLU  27          HB3       GLU  27   8.455   6.825   6.009
  195   1HG   GLU  27          HG2       GLU  27   9.269   4.794   4.460
  196   2HG   GLU  27          HG3       GLU  27   9.967   4.249   5.987
  197    H    GLU  28           H        GLU  28  11.832   8.310   6.725
  198    HA   GLU  28           HA       GLU  28  10.635  10.877   6.781
  199   1HB   GLU  28          HB2       GLU  28  13.449   9.893   7.413
  200   2HB   GLU  28          HB3       GLU  28  12.902  11.516   7.713
  201   1HG   GLU  28          HG2       GLU  28  11.634   9.046   8.953
  202   2HG   GLU  28          HG3       GLU  28  12.910  10.003   9.693
  203    H    ALA  29           H        ALA  29  12.894   9.409   4.479
  204    HA   ALA  29           HA       ALA  29  13.700  11.874   3.220
  205   1HB   ALA  29          HB1       ALA  29  13.730   9.046   2.078
  206   2HB   ALA  29          HB2       ALA  29  14.592  10.444   1.457
  207   3HB   ALA  29          HB3       ALA  29  15.031   9.783   3.041
  208    H    GLY  30           H        GLY  30  10.650  10.322   3.247
  209   1HA   GLY  30          HA2       GLY  30   8.840  11.554   2.383
  210   2HA   GLY  30          HA3       GLY  30   9.808  12.078   1.005
  211    H    PHE  31           H        PHE  31   9.824   8.706   2.002
  212    HA   PHE  31           HA       PHE  31   8.023   7.959  -0.264
  213   1HB   PHE  31          HB2       PHE  31  10.481   6.371   0.448
  214   2HB   PHE  31          HB3       PHE  31   9.484   6.262  -0.981
  215    HD1  PHE  31           HD1      PHE  31  12.482   7.649   0.404
  216    HD2  PHE  31           HD2      PHE  31   9.481   8.288  -2.629
  217    HE1  PHE  31           HE1      PHE  31  14.056   9.099  -0.849
  218    HE2  PHE  31           HE2      PHE  31  11.062   9.734  -3.882
  219    HZ   PHE  31           HZ       PHE  31  13.355  10.126  -3.004
  220    H    THR  32           H        THR  32   7.944   5.240   0.105
  221    HA   THR  32           HA       THR  32   7.512   4.719   2.974
  222    HB   THR  32           HB       THR  32   5.653   3.139   2.188
  223    HG1  THR  32           HG1      THR  32   4.535   3.893   0.330
  224   1HG2  THR  32          HG21      THR  32   3.941   4.885   2.451
  225   2HG2  THR  32          HG22      THR  32   5.289   5.143   3.572
  226   3HG2  THR  32          HG23      THR  32   5.150   6.149   2.113
  227    H    THR  33           H        THR  33   8.111   2.624   3.563
  228    HA   THR  33           HA       THR  33   9.616   1.090   1.486
  229    HB   THR  33           HB       THR  33  11.510   1.064   3.001
  230    HG1  THR  33           HG1      THR  33  11.301   2.851   4.705
  231   1HG2  THR  33          HG21      THR  33  10.717   3.976   2.683
  232   2HG2  THR  33          HG22      THR  33  12.330   3.212   2.542
  233   3HG2  THR  33          HG23      THR  33  11.125   2.972   1.284
  234    H    GLU  34           H        GLU  34  10.051  -1.119   1.959
  235    HA   GLU  34           HA       GLU  34   8.248  -2.312   3.976
  236   1HB   GLU  34          HB2       GLU  34   8.188  -2.357   1.228
  237   2HB   GLU  34          HB3       GLU  34   9.110  -3.785   1.556
  238   1HG   GLU  34          HG2       GLU  34   6.899  -4.369   1.458
  239   2HG   GLU  34          HG3       GLU  34   7.332  -4.505   3.154
  240    H    THR  35           H        THR  35   9.739  -2.584   5.722
  241    HA   THR  35           HA       THR  35  12.327  -3.842   5.321
  242    HB   THR  35           HB       THR  35  10.741  -3.929   7.909
  243    HG1  THR  35           HG1      THR  35  10.718  -1.798   7.536
  244   1HG2  THR  35          HG21      THR  35  13.716  -3.668   7.288
  245   2HG2  THR  35          HG22      THR  35  12.980  -3.955   8.884
  246   3HG2  THR  35          HG23      THR  35  12.909  -5.207   7.631
  247    H    LEU  36           H        LEU  36  12.566  -5.934   4.714
  248    HA   LEU  36           HA       LEU  36  10.457  -7.943   5.441
  249   1HB   LEU  36          HB2       LEU  36  11.674  -7.238   2.735
  250   2HB   LEU  36          HB3       LEU  36  10.727  -8.688   3.010
  251    HG   LEU  36           HG       LEU  36   9.599  -5.916   3.500
  252   1HD1  LEU  36          HD11      LEU  36   8.580  -6.166   1.242
  253   2HD1  LEU  36          HD12      LEU  36  10.344  -5.983   1.245
  254   3HD1  LEU  36          HD13      LEU  36   9.628  -7.590   0.971
  255   1HD2  LEU  36          HD21      LEU  36   8.344  -7.798   4.548
  256   2HD2  LEU  36          HD22      LEU  36   7.426  -7.036   3.246
  257   3HD2  LEU  36          HD23      LEU  36   8.228  -8.590   2.959
  258    H    HIS  37           H        HIS  37  11.209 -10.030   5.720
  259    HA   HIS  37           HA       HIS  37  14.105 -10.519   5.399
  260   1HB   HIS  37          HB2       HIS  37  13.662 -12.617   6.589
  261   2HB   HIS  37          HB3       HIS  37  13.108 -11.219   7.492
  262    HD1  HIS  37           HD1      HIS  37  11.538 -13.927   5.191
  263    HD2  HIS  37           HD2      HIS  37  10.691 -11.425   8.466
  264    HE1  HIS  37           HE1      HIS  37   9.221 -14.614   6.043
  265    H    GLY  38           H        GLY  38  12.648  -9.932   3.074
  266   1HA   GLY  38          HA2       GLY  38  11.890 -10.597   1.037
  267   2HA   GLY  38          HA3       GLY  38  13.243 -11.718   1.113
  268    HA   PRO  39           HA       PRO  39   9.690 -14.425   2.808
  269   1HB   PRO  39          HB2       PRO  39   7.084 -13.512   2.880
  270   2HB   PRO  39          HB3       PRO  39   8.253 -13.294   4.214
  271   1HG   PRO  39          HG2       PRO  39   7.526 -11.329   2.028
  272   2HG   PRO  39          HG3       PRO  39   7.655 -11.030   3.792
  273   1HD   PRO  39          HD2       PRO  39   9.681 -10.429   2.080
  274   2HD   PRO  39          HD3       PRO  39  10.011 -11.075   3.721
  275    H    LEU  40           H        LEU  40   9.109 -12.361  -0.000
  276    HA   LEU  40           HA       LEU  40   7.997 -14.638  -1.529
  277   1HB   LEU  40          HB2       LEU  40   7.526 -11.613  -1.586
  278   2HB   LEU  40          HB3       LEU  40   6.998 -12.692  -2.844
  279    HG   LEU  40           HG       LEU  40   6.050 -12.813   0.043
  280   1HD1  LEU  40          HD11      LEU  40   5.260 -10.812  -1.156
  281   2HD1  LEU  40          HD12      LEU  40   4.640 -11.829  -2.474
  282   3HD1  LEU  40          HD13      LEU  40   3.931 -11.937  -0.846
  283   1HD2  LEU  40          HD21      LEU  40   5.129 -14.384  -2.408
  284   2HD2  LEU  40          HD22      LEU  40   5.910 -15.047  -0.954
  285   3HD2  LEU  40          HD23      LEU  40   4.294 -14.353  -0.839
  286    H    LEU  41           H        LEU  41  10.861 -13.656  -0.910
  287    HA   LEU  41           HA       LEU  41  12.815 -13.207  -1.814
  288   1HB   LEU  41          HB2       LEU  41  12.065 -15.051  -3.406
  289   2HB   LEU  41          HB3       LEU  41  11.620 -13.778  -4.535
  290    HG   LEU  41           HG       LEU  41  14.086 -12.960  -4.306
  291   1HD1  LEU  41          HD11      LEU  41  15.705 -14.643  -3.702
  292   2HD1  LEU  41          HD12      LEU  41  14.620 -14.420  -2.319
  293   3HD1  LEU  41          HD13      LEU  41  14.432 -15.839  -3.358
  294   1HD2  LEU  41          HD21      LEU  41  13.401 -15.598  -5.653
  295   2HD2  LEU  41          HD22      LEU  41  13.174 -13.973  -6.319
  296   3HD2  LEU  41          HD23      LEU  41  14.815 -14.575  -6.026
  297    H    GLU  42           H        GLU  42  10.115 -11.532  -3.288
  298    HA   GLU  42           HA       GLU  42  11.442  -8.930  -3.494
  299   1HB   GLU  42          HB2       GLU  42  11.089  -8.858  -5.991
  300   2HB   GLU  42          HB3       GLU  42  12.441  -9.826  -5.445
  301   1HG   GLU  42          HG2       GLU  42  11.115 -11.908  -5.798
  302   2HG   GLU  42          HG3       GLU  42   9.775 -10.951  -6.411
  303    H    ASP  43           H        ASP  43   9.790  -8.353  -2.088
  304    HA   ASP  43           HA       ASP  43   7.014  -8.928  -2.593
  305   1HB   ASP  43          HB2       ASP  43   7.792  -8.256  -0.380
  306   2HB   ASP  43          HB3       ASP  43   8.301  -6.680  -1.023
  307    H    LEU  44           H        LEU  44   9.199  -6.191  -3.505
  308    HA   LEU  44           HA       LEU  44   6.981  -5.111  -5.185
  309   1HB   LEU  44          HB2       LEU  44   9.770  -4.001  -4.820
  310   2HB   LEU  44          HB3       LEU  44   8.534  -3.284  -5.783
  311    HG   LEU  44           HG       LEU  44   8.407  -3.592  -2.766
  312   1HD1  LEU  44          HD11      LEU  44   8.505  -1.091  -4.508
  313   2HD1  LEU  44          HD12      LEU  44   8.587  -1.179  -2.737
  314   3HD1  LEU  44          HD13      LEU  44   9.921  -1.806  -3.731
  315   1HD2  LEU  44          HD21      LEU  44   6.338  -2.207  -2.911
  316   2HD2  LEU  44          HD22      LEU  44   6.345  -2.409  -4.675
  317   3HD2  LEU  44          HD23      LEU  44   6.130  -3.813  -3.602
  318    HA   PRO  45           HA       PRO  45   8.300  -7.428  -8.621
  319   1HB   PRO  45          HB2       PRO  45   7.642  -5.767 -10.773
  320   2HB   PRO  45          HB3       PRO  45   6.506  -6.691  -9.790
  321   1HG   PRO  45          HG2       PRO  45   7.326  -3.778  -9.571
  322   2HG   PRO  45          HG3       PRO  45   5.681  -4.462  -9.453
  323   1HD   PRO  45          HD2       PRO  45   7.189  -3.782  -7.248
  324   2HD   PRO  45          HD3       PRO  45   6.009  -5.133  -7.239
  325    H    ALA  46           H        ALA  46   9.324  -7.068 -10.882
  326    HA   ALA  46           HA       ALA  46  12.072  -6.195 -10.552
  327   1HB   ALA  46          HB1       ALA  46  12.330  -7.065 -12.880
  328   2HB   ALA  46          HB2       ALA  46  11.509  -8.241 -11.840
  329   3HB   ALA  46          HB3       ALA  46  10.574  -7.263 -12.998
  330    H    SER  47           H        SER  47  10.287  -4.027 -10.193
  331    HA   SER  47           HA       SER  47  11.296  -2.061 -11.993
  332   1HB   SER  47          HB2       SER  47   8.318  -2.604 -12.016
  333   2HB   SER  47          HB3       SER  47   9.103  -1.199 -12.755
  334    HG   SER  47           HG       SER  47  10.206  -3.568 -13.539
  335    H    GLY  48           H        GLY  48  11.471  -0.203 -10.709
  336   1HA   GLY  48          HA2       GLY  48  10.219   1.194  -8.934
  337   2HA   GLY  48          HA3       GLY  48  10.166  -0.318  -8.023
  338    H    ILE  49           H        ILE  49  11.517   0.319  -6.359
  339    HA   ILE  49           HA       ILE  49  14.403   0.495  -7.039
  340    HB   ILE  49           HB       ILE  49  12.864   2.023  -4.907
  341   1HG1  ILE  49          HG12      ILE  49  14.120   2.822  -7.552
  342   2HG1  ILE  49          HG13      ILE  49  12.457   3.031  -7.006
  343   1HG2  ILE  49          HG21      ILE  49  15.013   3.062  -4.295
  344   2HG2  ILE  49          HG22      ILE  49  15.096   1.327  -4.069
  345   3HG2  ILE  49          HG23      ILE  49  15.859   2.052  -5.486
  346   1HD1  ILE  49          HD11      ILE  49  14.887   4.575  -6.076
  347   2HD1  ILE  49          HD12      ILE  49  13.532   5.160  -7.044
  348   3HD1  ILE  49          HD13      ILE  49  13.269   4.719  -5.338
  349    H    TRP  50           H        TRP  50  15.701  -0.819  -5.783
  350    HA   TRP  50           HA       TRP  50  14.384  -2.619  -3.804
  351   1HB   TRP  50          HB2       TRP  50  16.267  -3.144  -6.135
  352   2HB   TRP  50          HB3       TRP  50  16.338  -4.145  -4.724
  353    HD1  TRP  50           HD1      TRP  50  12.875  -3.153  -6.102
  354    HE1  TRP  50           HE1      TRP  50  11.766  -5.152  -7.224
  355    HE3  TRP  50           HE3      TRP  50  16.789  -6.445  -5.863
  356    HZ2  TRP  50           HZ2      TRP  50  12.459  -7.883  -7.860
  357    HZ3  TRP  50           HZ3      TRP  50  16.534  -8.742  -6.757
  358    HH2  TRP  50           HH2      TRP  50  14.374  -9.475  -7.751
  359    H    LEU  51           H        LEU  51  15.740  -3.128  -2.048
  360    HA   LEU  51           HA       LEU  51  18.501  -2.090  -2.026
  361   1HB   LEU  51          HB2       LEU  51  16.358  -1.606   0.079
  362   2HB   LEU  51          HB3       LEU  51  18.071  -1.644   0.491
  363    HG   LEU  51           HG       LEU  51  16.753   0.335  -1.418
  364   1HD1  LEU  51          HD11      LEU  51  17.949   0.669   1.369
  365   2HD1  LEU  51          HD12      LEU  51  17.288   1.957   0.342
  366   3HD1  LEU  51          HD13      LEU  51  16.222   0.690   0.967
  367   1HD2  LEU  51          HD21      LEU  51  19.024   1.503  -1.228
  368   2HD2  LEU  51          HD22      LEU  51  19.665  -0.015  -0.565
  369   3HD2  LEU  51          HD23      LEU  51  18.997   0.047  -2.212
  370    H    VAL  52           H        VAL  52  19.850  -3.547  -1.038
  371    HA   VAL  52           HA       VAL  52  18.576  -5.971   0.128
  372    HB   VAL  52           HB       VAL  52  19.026  -6.548  -2.100
  373   1HG1  VAL  52          HG11      VAL  52  20.574  -4.815  -2.834
  374   2HG1  VAL  52          HG12      VAL  52  21.872  -5.518  -1.829
  375   3HG1  VAL  52          HG13      VAL  52  21.215  -6.411  -3.209
  376   1HG2  VAL  52          HG21      VAL  52  19.624  -8.218  -0.373
  377   2HG2  VAL  52          HG22      VAL  52  20.537  -8.415  -1.876
  378   3HG2  VAL  52          HG23      VAL  52  21.317  -7.683  -0.459
  379    H    ILE  53           H        ILE  53  19.366  -6.520   2.025
  380    HA   ILE  53           HA       ILE  53  21.727  -5.044   3.068
  381    HB   ILE  53           HB       ILE  53  19.172  -5.717   4.597
  382   1HG1  ILE  53          HG12      ILE  53  19.026  -3.064   4.596
  383   2HG1  ILE  53          HG13      ILE  53  19.888  -3.202   3.068
  384   1HG2  ILE  53          HG21      ILE  53  20.120  -4.210   6.290
  385   2HG2  ILE  53          HG22      ILE  53  21.253  -5.514   5.936
  386   3HG2  ILE  53          HG23      ILE  53  21.533  -3.897   5.257
  387   1HD1  ILE  53          HD11      ILE  53  17.223  -4.513   3.739
  388   2HD1  ILE  53          HD12      ILE  53  17.446  -3.027   2.790
  389   3HD1  ILE  53          HD13      ILE  53  18.010  -4.569   2.154
  390    H    SER  54           H        SER  54  23.306  -6.503   3.334
  391    HA   SER  54           HA       SER  54  22.723  -9.109   4.545
  392   1HB   SER  54          HB2       SER  54  24.162  -9.046   1.882
  393   2HB   SER  54          HB3       SER  54  23.535 -10.435   2.781
  394    HG   SER  54           HG       SER  54  21.416  -9.355   2.468
  395    H    SER  55           H        SER  55  25.310 -10.264   4.132
  396    HA   SER  55           HA       SER  55  27.191  -8.283   5.210
  397   1HB   SER  55          HB2       SER  55  27.252  -9.751   7.374
  398   2HB   SER  55          HB3       SER  55  25.892  -8.637   7.188
  399    HG   SER  55           HG       SER  55  25.205 -10.721   7.852
  400    H    THR  56           H        THR  56  28.069  -9.151   3.116
  401    HA   THR  56           HA       THR  56  28.978 -11.829   2.956
  402    HB   THR  56           HB       THR  56  30.331 -10.725   1.066
  403    HG1  THR  56           HG1      THR  56  30.098  -8.644   0.812
  404   1HG2  THR  56          HG21      THR  56  28.362  -9.978  -0.243
  405   2HG2  THR  56          HG22      THR  56  28.172 -11.562   0.470
  406   3HG2  THR  56          HG23      THR  56  27.338 -10.162   1.196
  407    H    HIS  57           H        HIS  57  30.544  -8.862   4.206
  408    HA   HIS  57           HA       HIS  57  33.066 -10.068   4.831
  409   1HB   HIS  57          HB2       HIS  57  32.866  -7.698   4.794
  410   2HB   HIS  57          HB3       HIS  57  31.552  -7.686   5.980
  411    HD1  HIS  57           HD1      HIS  57  32.329  -7.605   8.573
  412    HD2  HIS  57           HD2      HIS  57  35.383  -8.120   5.713
  413    HE1  HIS  57           HE1      HIS  57  34.516  -7.368   9.812
  414    H    GLY  58           H        GLY  58  30.027  -9.796   6.741
  415   1HA   GLY  58          HA2       GLY  58  31.299 -10.719   9.173
  416   2HA   GLY  58          HA3       GLY  58  29.589 -10.357   8.923
  417    H    ALA  59           H        ALA  59  29.204 -12.227   6.698
  418    HA   ALA  59           HA       ALA  59  29.475 -14.882   7.992
  419   1HB   ALA  59          HB1       ALA  59  27.016 -15.151   7.925
  420   2HB   ALA  59          HB2       ALA  59  27.462 -13.776   8.946
  421   3HB   ALA  59          HB3       ALA  59  26.838 -13.493   7.305
  422    H    GLY  60           H        GLY  60  30.692 -13.814   5.530
  423   1HA   GLY  60          HA2       GLY  60  29.381 -14.525   3.169
  424   2HA   GLY  60          HA3       GLY  60  31.135 -14.637   3.420
  425    H    ASP  61           H        ASP  61  29.418 -16.511   1.872
  426    HA   ASP  61           HA       ASP  61  29.797 -19.023   3.394
  427   1HB   ASP  61          HB2       ASP  61  27.533 -18.011   3.976
  428   2HB   ASP  61          HB3       ASP  61  27.091 -18.193   2.277
  429    H    ILE  62           H        ILE  62  29.062 -20.890   1.991
  430    HA   ILE  62           HA       ILE  62  30.705 -21.042  -0.238
  431    HB   ILE  62           HB       ILE  62  28.307 -22.783   0.428
  432   1HG1  ILE  62          HG12      ILE  62  29.801 -22.737   2.329
  433   2HG1  ILE  62          HG13      ILE  62  29.893 -24.287   1.527
  434   1HG2  ILE  62          HG21      ILE  62  28.976 -23.260  -1.845
  435   2HG2  ILE  62          HG22      ILE  62  30.687 -23.338  -1.387
  436   3HG2  ILE  62          HG23      ILE  62  29.542 -24.570  -0.811
  437   1HD1  ILE  62          HD11      ILE  62  32.063 -23.619   0.480
  438   2HD1  ILE  62          HD12      ILE  62  31.968 -22.056   1.329
  439   3HD1  ILE  62          HD13      ILE  62  32.104 -23.561   2.248
  440    HA   PRO  63           HA       PRO  63  27.122 -20.312  -3.338
  441   1HB   PRO  63          HB2       PRO  63  24.963 -18.762  -2.458
  442   2HB   PRO  63          HB3       PRO  63  24.970 -20.539  -2.658
  443   1HG   PRO  63          HG2       PRO  63  25.376 -18.919  -0.142
  444   2HG   PRO  63          HG3       PRO  63  24.438 -20.430  -0.365
  445   1HD   PRO  63          HD2       PRO  63  26.911 -20.446   0.710
  446   2HD   PRO  63          HD3       PRO  63  26.383 -21.750  -0.386
  447    H    ASP  64           H        ASP  64  27.104 -17.759  -0.804
  448    HA   ASP  64           HA       ASP  64  29.201 -16.276  -1.938
  449   1HB   ASP  64          HB2       ASP  64  27.455 -15.563  -3.626
  450   2HB   ASP  64          HB3       ASP  64  26.488 -14.918  -2.314
  451    H    ASN  65           H        ASN  65  26.089 -15.837  -0.201
  452    HA   ASN  65           HA       ASN  65  27.253 -15.636   2.401
  453   1HB   ASN  65          HB2       ASN  65  27.958 -13.413   1.855
  454   2HB   ASN  65          HB3       ASN  65  26.459 -13.068   1.015
  455   1HD2  ASN  65          HD22      ASN  65  26.989 -14.306   4.418
  456   2HD2  ASN  65          HD21      ASN  65  26.244 -12.869   5.057
  457    H    LEU  66           H        LEU  66  24.544 -14.275   0.458
  458    HA   LEU  66           HA       LEU  66  22.490 -15.141   2.333
  459   1HB   LEU  66          HB2       LEU  66  22.167 -14.432  -0.613
  460   2HB   LEU  66          HB3       LEU  66  20.937 -14.558   0.640
  461    HG   LEU  66           HG       LEU  66  21.977 -12.543   1.781
  462   1HD1  LEU  66          HD11      LEU  66  23.240 -11.014   0.151
  463   2HD1  LEU  66          HD12      LEU  66  24.170 -12.318   0.836
  464   3HD1  LEU  66          HD13      LEU  66  23.552 -12.455  -0.832
  465   1HD2  LEU  66          HD21      LEU  66  20.877 -12.204  -1.043
  466   2HD2  LEU  66          HD22      LEU  66  19.925 -12.378   0.456
  467   3HD2  LEU  66          HD23      LEU  66  20.916 -10.948   0.203
  468    H    SER  67           H        SER  67  21.365 -17.185   2.240
  469    HA   SER  67           HA       SER  67  22.726 -19.159   0.545
  470   1HB   SER  67          HB2       SER  67  20.965 -20.597   2.027
  471   2HB   SER  67          HB3       SER  67  22.631 -20.218   2.474
  472    HG   SER  67           HG       SER  67  21.169 -19.754   4.144
  473    HA   PRO  68           HA       PRO  68  18.399 -19.949  -1.114
  474   1HB   PRO  68          HB2       PRO  68  16.191 -18.492  -0.383
  475   2HB   PRO  68          HB3       PRO  68  16.831 -19.852   0.579
  476   1HG   PRO  68          HG2       PRO  68  17.269 -16.913   1.059
  477   2HG   PRO  68          HG3       PRO  68  16.848 -18.173   2.253
  478   1HD   PRO  68          HD2       PRO  68  19.396 -17.341   1.896
  479   2HD   PRO  68          HD3       PRO  68  18.989 -19.025   2.315
  480    H    PHE  69           H        PHE  69  18.792 -16.469  -0.463
  481    HA   PHE  69           HA       PHE  69  17.414 -15.538  -2.708
  482   1HB   PHE  69          HB2       PHE  69  19.697 -14.320  -1.128
  483   2HB   PHE  69          HB3       PHE  69  18.793 -13.462  -2.338
  484    HD1  PHE  69           HD1      PHE  69  18.645 -14.840   1.097
  485    HD2  PHE  69           HD2      PHE  69  16.492 -12.752  -2.011
  486    HE1  PHE  69           HE1      PHE  69  16.862 -14.263   2.707
  487    HE2  PHE  69           HE2      PHE  69  14.724 -12.173  -0.393
  488    HZ   PHE  69           HZ       PHE  69  14.909 -12.930   1.989
  489    H    TYR  70           H        TYR  70  20.951 -16.181  -2.309
  490    HA   TYR  70           HA       TYR  70  21.707 -15.192  -4.840
  491   1HB   TYR  70          HB2       TYR  70  23.305 -15.605  -3.039
  492   2HB   TYR  70          HB3       TYR  70  22.998 -17.336  -3.160
  493    HD1  TYR  70           HD1      TYR  70  24.247 -18.675  -4.712
  494    HD2  TYR  70           HD2      TYR  70  24.170 -14.384  -5.167
  495    HE1  TYR  70           HE1      TYR  70  25.948 -18.837  -6.501
  496    HE2  TYR  70           HE2      TYR  70  25.810 -14.545  -7.003
  497    HH   TYR  70           HH       TYR  70  27.138 -15.973  -8.309
  498    H    GLU  71           H        GLU  71  20.892 -18.598  -3.844
  499    HA   GLU  71           HA       GLU  71  21.248 -19.666  -6.446
  500   1HB   GLU  71          HB2       GLU  71  19.414 -20.640  -4.211
  501   2HB   GLU  71          HB3       GLU  71  19.918 -21.563  -5.637
  502   1HG   GLU  71          HG2       GLU  71  22.332 -21.059  -4.848
  503   2HG   GLU  71          HG3       GLU  71  21.630 -20.596  -3.318
  504    H    ALA  72           H        ALA  72  18.274 -18.394  -4.823
  505    HA   ALA  72           HA       ALA  72  16.534 -18.867  -7.011
  506   1HB   ALA  72          HB1       ALA  72  16.414 -16.651  -4.927
  507   2HB   ALA  72          HB2       ALA  72  15.079 -17.198  -5.963
  508   3HB   ALA  72          HB3       ALA  72  15.753 -18.294  -4.737
  509    H    LEU  73           H        LEU  73  18.748 -16.071  -6.429
  510    HA   LEU  73           HA       LEU  73  17.742 -14.426  -8.518
  511   1HB   LEU  73          HB2       LEU  73  20.454 -14.732  -7.171
  512   2HB   LEU  73          HB3       LEU  73  20.273 -13.720  -8.566
  513    HG   LEU  73           HG       LEU  73  18.819 -13.396  -5.917
  514   1HD1  LEU  73          HD11      LEU  73  21.216 -12.831  -5.849
  515   2HD1  LEU  73          HD12      LEU  73  21.008 -11.722  -7.221
  516   3HD1  LEU  73          HD13      LEU  73  20.212 -11.386  -5.667
  517   1HD2  LEU  73          HD21      LEU  73  17.330 -12.524  -7.643
  518   2HD2  LEU  73          HD22      LEU  73  18.089 -11.168  -6.828
  519   3HD2  LEU  73          HD23      LEU  73  18.676 -11.669  -8.430
  520    H    GLN  74           H        GLN  74  20.494 -16.736  -8.539
  521    HA   GLN  74           HA       GLN  74  20.926 -16.517 -11.337
  522   1HB   GLN  74          HB2       GLN  74  21.496 -19.083  -9.835
  523   2HB   GLN  74          HB3       GLN  74  22.292 -18.423 -11.262
  524   1HG   GLN  74          HG2       GLN  74  22.847 -16.411  -9.579
  525   2HG   GLN  74          HG3       GLN  74  22.551 -17.680  -8.383
  526   1HE2  GLN  74          HE21      GLN  74  24.648 -16.497 -10.895
  527   2HE2  GLN  74          HE22      GLN  74  25.981 -17.624 -10.626
  528    H    GLU  75           H        GLU  75  18.563 -18.386  -9.607
  529    HA   GLU  75           HA       GLU  75  18.075 -20.287 -11.643
  530   1HB   GLU  75          HB2       GLU  75  17.467 -20.525  -9.242
  531   2HB   GLU  75          HB3       GLU  75  16.160 -19.364  -9.490
  532   1HG   GLU  75          HG2       GLU  75  15.057 -20.886 -11.065
  533   2HG   GLU  75          HG3       GLU  75  16.425 -22.000 -10.989
  534    H    GLN  76           H        GLN  76  16.788 -17.053 -11.129
  535    HA   GLN  76           HA       GLN  76  15.099 -17.364 -13.584
  536   1HB   GLN  76          HB2       GLN  76  13.668 -15.541 -12.560
  537   2HB   GLN  76          HB3       GLN  76  13.524 -17.165 -11.904
  538   1HG   GLN  76          HG2       GLN  76  14.471 -16.634  -9.881
  539   2HG   GLN  76          HG3       GLN  76  15.457 -15.325 -10.531
  540   1HE2  GLN  76          HE22      GLN  76  14.671 -14.288  -8.480
  541   2HE2  GLN  76          HE21      GLN  76  13.226 -13.299  -8.612
  542    H    LYS  77           H        LYS  77  17.549 -15.379 -12.093
  543    HA   LYS  77           HA       LYS  77  18.241 -13.217 -12.489
  544   1HB   LYS  77          HB2       LYS  77  18.749 -14.683 -15.071
  545   2HB   LYS  77          HB3       LYS  77  19.495 -13.132 -14.650
  546   1HG   LYS  77          HG2       LYS  77  20.490 -14.096 -12.666
  547   2HG   LYS  77          HG3       LYS  77  19.711 -15.650 -12.959
  548   1HD   LYS  77          HD2       LYS  77  21.718 -14.428 -14.877
  549   2HD   LYS  77          HD3       LYS  77  22.153 -15.531 -13.555
  550   1HE   LYS  77          HE2       LYS  77  20.625 -17.225 -14.514
  551   2HE   LYS  77          HE3       LYS  77  20.222 -16.140 -15.847
  552   1HZ   LYS  77          HZ1       LYS  77  22.924 -17.236 -15.299
  553   2HZ   LYS  77          HZ2       LYS  77  21.923 -17.727 -16.485
  554   3HZ   LYS  77          HZ3       LYS  77  22.552 -16.227 -16.533
  555    HA   PRO  78           HA       PRO  78  14.284 -12.032 -14.605
  556   1HB   PRO  78          HB2       PRO  78  13.355 -10.165 -12.747
  557   2HB   PRO  78          HB3       PRO  78  12.991 -11.901 -12.773
  558   1HG   PRO  78          HG2       PRO  78  15.051 -10.418 -11.151
  559   2HG   PRO  78          HG3       PRO  78  13.997 -11.756 -10.622
  560   1HD   PRO  78          HD2       PRO  78  16.632 -12.110 -11.311
  561   2HD   PRO  78          HD3       PRO  78  15.389 -13.356 -11.624
  562    H    ASP  79           H        ASP  79  13.420  -9.992 -15.345
  563    HA   ASP  79           HA       ASP  79  15.567  -8.429 -16.527
  564   1HB   ASP  79          HB2       ASP  79  13.700  -9.238 -17.884
  565   2HB   ASP  79          HB3       ASP  79  12.551  -8.317 -16.905
  566    H    LEU  80           H        LEU  80  16.153  -7.713 -14.301
  567    HA   LEU  80           HA       LEU  80  14.602  -5.661 -12.986
  568   1HB   LEU  80          HB2       LEU  80  17.450  -6.635 -12.780
  569   2HB   LEU  80          HB3       LEU  80  16.911  -5.298 -11.856
  570    HG   LEU  80           HG       LEU  80  16.280  -6.469 -10.186
  571   1HD1  LEU  80          HD11      LEU  80  14.062  -6.619 -11.054
  572   2HD1  LEU  80          HD12      LEU  80  14.452  -8.101 -11.967
  573   3HD1  LEU  80          HD13      LEU  80  14.459  -8.092 -10.186
  574   1HD2  LEU  80          HD21      LEU  80  16.936  -8.966 -11.760
  575   2HD2  LEU  80          HD22      LEU  80  18.085  -7.979 -10.816
  576   3HD2  LEU  80          HD23      LEU  80  16.778  -8.839  -9.996
  577    H    SER  81           H        SER  81  15.839  -5.262 -15.964
  578    HA   SER  81           HA       SER  81  17.546  -3.095 -15.973
  579   1HB   SER  81          HB2       SER  81  15.427  -3.914 -18.000
  580   2HB   SER  81          HB3       SER  81  17.031  -3.241 -18.272
  581    HG   SER  81           HG       SER  81  16.249  -5.790 -18.074
  582    H    ALA  82           H        ALA  82  14.399  -3.207 -14.845
  583    HA   ALA  82           HA       ALA  82  13.816  -0.348 -15.475
  584   1HB   ALA  82          HB1       ALA  82  12.179  -1.878 -16.496
  585   2HB   ALA  82          HB2       ALA  82  11.886  -2.636 -14.914
  586   3HB   ALA  82          HB3       ALA  82  11.433  -0.940 -15.189
  587    H    VAL  83           H        VAL  83  15.242  -2.132 -13.116
  588    HA   VAL  83           HA       VAL  83  14.195  -0.248 -11.082
  589    HB   VAL  83           HB       VAL  83  13.051  -2.135 -10.460
  590   1HG1  VAL  83          HG11      VAL  83  13.948  -4.416 -10.209
  591   2HG1  VAL  83          HG12      VAL  83  13.999  -3.846 -11.880
  592   3HG1  VAL  83          HG13      VAL  83  15.488  -3.857 -10.896
  593   1HG2  VAL  83          HG21      VAL  83  14.402  -1.255  -8.509
  594   2HG2  VAL  83          HG22      VAL  83  13.823  -2.907  -8.390
  595   3HG2  VAL  83          HG23      VAL  83  15.523  -2.599  -8.776
  596    H    ARG  84           H        ARG  84  15.631   0.310  -9.365
  597    HA   ARG  84           HA       ARG  84  18.515  -0.108 -10.054
  598   1HB   ARG  84          HB2       ARG  84  19.041   1.895  -9.010
  599   2HB   ARG  84          HB3       ARG  84  17.622   2.290  -9.981
  600   1HG   ARG  84          HG2       ARG  84  16.266   1.909  -7.794
  601   2HG   ARG  84          HG3       ARG  84  17.829   1.917  -6.964
  602   1HD   ARG  84          HD2       ARG  84  16.433   4.151  -8.422
  603   2HD   ARG  84          HD3       ARG  84  16.996   4.114  -6.745
  604    HE   ARG  84           HE       ARG  84  19.353   3.961  -7.785
  605   1HH1  ARG  84          HH21      ARG  84  16.714   5.938  -9.169
  606   2HH1  ARG  84          HH22      ARG  84  17.734   6.753 -10.294
  607   1HH2  ARG  84          HH11      ARG  84  20.619   4.897  -9.382
  608   2HH2  ARG  84          HH12      ARG  84  20.050   6.217 -10.370
  609    H    PHE  85           H        PHE  85  19.894  -0.745  -8.302
  610    HA   PHE  85           HA       PHE  85  18.465  -1.558  -5.817
  611   1HB   PHE  85          HB2       PHE  85  19.405  -3.552  -5.566
  612   2HB   PHE  85          HB3       PHE  85  19.052  -3.562  -7.273
  613    HD1  PHE  85           HD1      PHE  85  21.023  -3.096  -8.908
  614    HD2  PHE  85           HD2      PHE  85  21.612  -3.907  -4.719
  615    HE1  PHE  85           HE1      PHE  85  23.263  -3.964  -9.400
  616    HE2  PHE  85           HE2      PHE  85  23.912  -4.698  -5.206
  617    HZ   PHE  85           HZ       PHE  85  24.734  -4.773  -7.546
  618    H    GLY  86           H        GLY  86  19.778  -1.488  -3.951
  619   1HA   GLY  86          HA2       GLY  86  22.452  -0.230  -4.191
  620   2HA   GLY  86          HA3       GLY  86  21.264   0.465  -3.075
  621    H    ALA  87           H        ALA  87  23.872  -1.181  -2.614
  622    HA   ALA  87           HA       ALA  87  22.743  -3.543  -1.174
  623   1HB   ALA  87          HB1       ALA  87  25.067  -4.445  -1.402
  624   2HB   ALA  87          HB2       ALA  87  24.244  -4.223  -2.957
  625   3HB   ALA  87          HB3       ALA  87  25.479  -3.059  -2.420
  626    H    ILE  88           H        ILE  88  23.264  -3.784   0.983
  627    HA   ILE  88           HA       ILE  88  24.787  -1.588   2.296
  628    HB   ILE  88           HB       ILE  88  22.043  -2.656   3.064
  629   1HG1  ILE  88          HG12      ILE  88  22.763  -0.071   1.643
  630   2HG1  ILE  88          HG13      ILE  88  21.730  -1.367   1.059
  631   1HG2  ILE  88          HG21      ILE  88  23.615  -0.334   4.268
  632   2HG2  ILE  88          HG22      ILE  88  22.003  -0.881   4.735
  633   3HG2  ILE  88          HG23      ILE  88  23.365  -1.928   5.012
  634   1HD1  ILE  88          HD11      ILE  88  21.050   0.559   3.300
  635   2HD1  ILE  88          HD12      ILE  88  20.367   0.500   1.679
  636   3HD1  ILE  88          HD13      ILE  88  20.051  -0.832   2.807
  637    H    GLY  89           H        GLY  89  26.043  -2.275   3.959
  638   1HA   GLY  89          HA2       GLY  89  26.686  -3.514   5.846
  639   2HA   GLY  89          HA3       GLY  89  25.376  -4.667   5.543
  640    H    ILE  90           H        ILE  90  26.065  -5.098   2.775
  641    HA   ILE  90           HA       ILE  90  27.953  -7.147   2.653
  642    HB   ILE  90           HB       ILE  90  26.874  -5.146   0.638
  643   1HG1  ILE  90          HG12      ILE  90  26.034  -7.875   1.590
  644   2HG1  ILE  90          HG13      ILE  90  25.095  -6.403   1.466
  645   1HG2  ILE  90          HG21      ILE  90  29.032  -6.095  -0.230
  646   2HG2  ILE  90          HG22      ILE  90  28.287  -7.704  -0.150
  647   3HG2  ILE  90          HG23      ILE  90  27.620  -6.451  -1.206
  648   1HD1  ILE  90          HD11      ILE  90  25.906  -8.230  -0.820
  649   2HD1  ILE  90          HD12      ILE  90  24.283  -7.930  -0.182
  650   3HD1  ILE  90          HD13      ILE  90  25.135  -6.644  -1.048
  651    H    GLY  91           H        GLY  91  30.128  -7.166   2.715
  652   1HA   GLY  91          HA2       GLY  91  31.561  -4.591   3.108
  653   2HA   GLY  91          HA3       GLY  91  32.108  -6.186   3.582
  654    H    SER  92           H        SER  92  31.129  -7.011   0.749
  655    HA   SER  92           HA       SER  92  33.435  -7.775  -0.291
  656   1HB   SER  92          HB2       SER  92  30.941  -7.062  -1.836
  657   2HB   SER  92          HB3       SER  92  32.129  -8.339  -2.233
  658    HG   SER  92           HG       SER  92  30.712  -9.471  -1.112
  659    H    ARG  93           H        ARG  93  32.188  -4.487  -0.855
  660    HA   ARG  93           HA       ARG  93  33.756  -4.132  -3.256
  661   1HB   ARG  93          HB2       ARG  93  31.629  -2.815  -2.252
  662   2HB   ARG  93          HB3       ARG  93  32.895  -1.748  -1.631
  663   1HG   ARG  93          HG2       ARG  93  33.801  -1.608  -4.020
  664   2HG   ARG  93          HG3       ARG  93  32.426  -2.606  -4.522
  665   1HD   ARG  93          HD2       ARG  93  31.005  -0.712  -3.308
  666   2HD   ARG  93          HD3       ARG  93  32.465   0.242  -3.508
  667    HE   ARG  93           HE       ARG  93  32.121   0.342  -5.790
  668   1HH1  ARG  93          HH11      ARG  93  29.818  -2.043  -4.421
  669   2HH1  ARG  93          HH12      ARG  93  28.920  -2.183  -5.896
  670   1HH2  ARG  93          HH21      ARG  93  30.833   0.161  -7.707
  671   2HH2  ARG  93          HH22      ARG  93  29.474  -0.903  -7.742
  672    H    GLU  94           H        GLU  94  34.563  -4.022   0.133
  673    HA   GLU  94           HA       GLU  94  37.170  -2.709  -0.484
  674   1HB   GLU  94          HB2       GLU  94  35.155  -2.002   1.639
  675   2HB   GLU  94          HB3       GLU  94  36.827  -1.429   1.682
  676   1HG   GLU  94          HG2       GLU  94  36.523  -0.258  -0.461
  677   2HG   GLU  94          HG3       GLU  94  34.855  -0.827  -0.564
  678    H    TYR  95           H        TYR  95  35.380  -5.003   1.502
  679    HA   TYR  95           HA       TYR  95  37.811  -5.645   3.055
  680   1HB   TYR  95          HB2       TYR  95  34.839  -5.787   3.724
  681   2HB   TYR  95          HB3       TYR  95  36.162  -6.171   4.779
  682    HD1  TYR  95           HD1      TYR  95  37.827  -4.283   5.439
  683    HD2  TYR  95           HD2      TYR  95  33.974  -3.566   3.630
  684    HE1  TYR  95           HE1      TYR  95  37.876  -1.957   6.274
  685    HE2  TYR  95           HE2      TYR  95  34.012  -1.234   4.464
  686    HH   TYR  95           HH       TYR  95  36.751   0.085   6.382
  687    H    ASP  96           H        ASP  96  38.088  -7.773   3.706
  688    HA   ASP  96           HA       ASP  96  38.350  -9.946   3.420
  689   1HB   ASP  96          HB2       ASP  96  36.380  -9.808   4.843
  690   2HB   ASP  96          HB3       ASP  96  35.324  -9.969   3.444
  691    H    THR  97           H        THR  97  38.516  -8.544   0.938
  692    HA   THR  97           HA       THR  97  38.059 -10.833  -0.899
  693    HB   THR  97           HB       THR  97  38.188  -8.983  -2.685
  694    HG1  THR  97           HG1      THR  97  37.740  -6.914  -1.968
  695   1HG2  THR  97          HG21      THR  97  36.083 -10.130  -1.953
  696   2HG2  THR  97          HG22      THR  97  35.822  -8.829  -0.774
  697   3HG2  THR  97          HG23      THR  97  35.840  -8.475  -2.518
  698    H    PHE  98           H        PHE  98  40.260 -10.158   1.046
  699    HA   PHE  98           HA       PHE  98  42.525  -9.215  -0.399
  700   1HB   PHE  98          HB2       PHE  98  42.569 -10.886   2.132
  701   2HB   PHE  98          HB3       PHE  98  43.740  -9.680   1.616
  702    HD1  PHE  98           HD1      PHE  98  41.374 -10.214   4.030
  703    HD2  PHE  98           HD2      PHE  98  42.332  -7.257   1.031
  704    HE1  PHE  98           HE1      PHE  98  40.164  -8.493   5.335
  705    HE2  PHE  98           HE2      PHE  98  41.098  -5.546   2.333
  706    HZ   PHE  98           HZ       PHE  98  40.024  -6.151   4.494
  707    H    CYS  99           H        CYS  99  41.171 -12.436   0.008
  708    HA   CYS  99           HA       CYS  99  43.226 -13.612  -1.750
  709   1HB   CYS  99          HB2       CYS  99  43.501 -15.508  -0.096
  710   2HB   CYS  99          HB3       CYS  99  44.178 -13.967   0.434
  711    HG   CYS  99           HG       CYS  99  43.138 -15.210   2.482
  712    H    GLY 100           H        GLY 100  40.311 -12.915  -1.998
  713   1HA   GLY 100          HA2       GLY 100  39.277 -15.217  -3.263
  714   2HA   GLY 100          HA3       GLY 100  38.604 -15.128  -1.624
  715    H    ALA 101           H        ALA 101  36.594 -14.855  -3.104
  716    HA   ALA 101           HA       ALA 101  36.023 -11.966  -3.408
  717   1HB   ALA 101          HB1       ALA 101  34.864 -12.408  -5.545
  718   2HB   ALA 101          HB2       ALA 101  36.595 -12.778  -5.669
  719   3HB   ALA 101          HB3       ALA 101  35.412 -14.098  -5.505
  720    H    ILE 102           H        ILE 102  33.935 -11.447  -2.916
  721    HA   ILE 102           HA       ILE 102  31.995 -13.495  -2.039
  722    HB   ILE 102           HB       ILE 102  31.749 -12.229   0.131
  723   1HG1  ILE 102          HG12      ILE 102  34.547 -11.144  -0.368
  724   2HG1  ILE 102          HG13      ILE 102  33.124 -10.195  -0.776
  725   1HG2  ILE 102          HG21      ILE 102  34.464 -13.557  -0.164
  726   2HG2  ILE 102          HG22      ILE 102  33.479 -13.412   1.302
  727   3HG2  ILE 102          HG23      ILE 102  32.914 -14.418  -0.036
  728   1HD1  ILE 102          HD11      ILE 102  32.377 -10.204   1.548
  729   2HD1  ILE 102          HD12      ILE 102  33.748 -11.237   2.012
  730   3HD1  ILE 102          HD13      ILE 102  34.022  -9.589   1.419
  731    H    ASP 103           H        ASP 103  32.160 -11.532  -4.299
  732    HA   ASP 103           HA       ASP 103  30.164  -9.466  -3.519
  733   1HB   ASP 103          HB2       ASP 103  31.079  -8.076  -5.136
  734   2HB   ASP 103          HB3       ASP 103  32.499  -8.827  -4.419
  735    H    LYS 104           H        LYS 104  29.824 -12.472  -4.563
  736    HA   LYS 104           HA       LYS 104  28.992 -12.167  -7.292
  737   1HB   LYS 104          HB2       LYS 104  28.304 -14.435  -5.404
  738   2HB   LYS 104          HB3       LYS 104  28.200 -14.444  -7.158
  739   1HG   LYS 104          HG2       LYS 104  30.606 -14.220  -7.340
  740   2HG   LYS 104          HG3       LYS 104  30.791 -14.136  -5.579
  741   1HD   LYS 104          HD2       LYS 104  29.773 -16.396  -5.375
  742   2HD   LYS 104          HD3       LYS 104  29.687 -16.524  -7.134
  743   1HE   LYS 104          HE2       LYS 104  32.250 -16.134  -5.514
  744   2HE   LYS 104          HE3       LYS 104  31.647 -17.694  -6.074
  745   1HZ   LYS 104          HZ1       LYS 104  31.882 -16.910  -8.357
  746   2HZ   LYS 104          HZ2       LYS 104  32.473 -15.470  -7.848
  747   3HZ   LYS 104          HZ3       LYS 104  33.306 -16.842  -7.576
  748    H    LEU 105           H        LEU 105  27.207 -11.907  -4.199
  749    HA   LEU 105           HA       LEU 105  24.578 -11.916  -5.185
  750   1HB   LEU 105          HB2       LEU 105  25.153 -11.785  -2.818
  751   2HB   LEU 105          HB3       LEU 105  25.894 -10.210  -3.021
  752    HG   LEU 105           HG       LEU 105  23.709 -10.187  -1.908
  753   1HD1  LEU 105          HD11      LEU 105  24.523  -8.178  -3.208
  754   2HD1  LEU 105          HD12      LEU 105  23.367  -8.643  -4.478
  755   3HD1  LEU 105          HD13      LEU 105  22.793  -8.259  -2.855
  756   1HD2  LEU 105          HD21      LEU 105  21.619 -10.571  -3.079
  757   2HD2  LEU 105          HD22      LEU 105  22.478 -10.942  -4.585
  758   3HD2  LEU 105          HD23      LEU 105  22.621 -12.028  -3.184
  759    H    GLU 106           H        GLU 106  26.824  -9.075  -4.894
  760    HA   GLU 106           HA       GLU 106  24.961  -7.298  -6.150
  761   1HB   GLU 106          HB2       GLU 106  28.000  -7.001  -6.153
  762   2HB   GLU 106          HB3       GLU 106  26.807  -5.731  -6.370
  763   1HG   GLU 106          HG2       GLU 106  26.028  -6.006  -4.047
  764   2HG   GLU 106          HG3       GLU 106  27.198  -7.303  -3.783
  765    H    ALA 107           H        ALA 107  27.604  -9.350  -7.415
  766    HA   ALA 107           HA       ALA 107  27.689  -8.283 -10.028
  767   1HB   ALA 107          HB1       ALA 107  28.815 -10.358 -10.641
  768   2HB   ALA 107          HB2       ALA 107  29.405  -9.814  -9.057
  769   3HB   ALA 107          HB3       ALA 107  28.240 -11.157  -9.171
  770    H    GLU 108           H        GLU 108  25.725 -11.078  -8.720
  771    HA   GLU 108           HA       GLU 108  24.553 -11.621 -11.253
  772   1HB   GLU 108          HB2       GLU 108  23.839 -12.355  -8.415
  773   2HB   GLU 108          HB3       GLU 108  22.869 -12.857  -9.791
  774   1HG   GLU 108          HG2       GLU 108  25.802 -13.544  -9.356
  775   2HG   GLU 108          HG3       GLU 108  24.421 -14.625  -9.171
  776    H    LEU 109           H        LEU 109  23.601  -9.308  -8.693
  777    HA   LEU 109           HA       LEU 109  20.979  -8.827  -9.832
  778   1HB   LEU 109          HB2       LEU 109  22.801  -7.132  -8.074
  779   2HB   LEU 109          HB3       LEU 109  21.203  -6.604  -8.585
  780    HG   LEU 109           HG       LEU 109  21.739  -9.116  -6.942
  781   1HD1  LEU 109          HD11      LEU 109  20.818  -7.864  -5.064
  782   2HD1  LEU 109          HD12      LEU 109  22.220  -7.003  -5.721
  783   3HD1  LEU 109          HD13      LEU 109  20.583  -6.429  -6.089
  784   1HD2  LEU 109          HD21      LEU 109  19.279  -9.028  -6.523
  785   2HD2  LEU 109          HD22      LEU 109  19.136  -7.738  -7.740
  786   3HD2  LEU 109          HD23      LEU 109  19.669  -9.370  -8.208
  787    H    LYS 110           H        LYS 110  24.187  -7.287 -10.322
  788    HA   LYS 110           HA       LYS 110  23.288  -5.273 -12.142
  789   1HB   LYS 110          HB2       LYS 110  25.999  -6.648 -11.854
  790   2HB   LYS 110          HB3       LYS 110  25.710  -5.171 -12.779
  791   1HG   LYS 110          HG2       LYS 110  25.134  -3.928 -10.785
  792   2HG   LYS 110          HG3       LYS 110  25.066  -5.372  -9.814
  793   1HD   LYS 110          HD2       LYS 110  27.103  -4.500  -9.163
  794   2HD   LYS 110          HD3       LYS 110  27.565  -5.718 -10.352
  795   1HE   LYS 110          HE2       LYS 110  27.594  -3.859 -12.108
  796   2HE   LYS 110          HE3       LYS 110  27.318  -2.705 -10.805
  797   1HZ   LYS 110          HZ1       LYS 110  29.673  -4.493 -11.043
  798   2HZ   LYS 110          HZ2       LYS 110  29.662  -2.889 -11.316
  799   3HZ   LYS 110          HZ3       LYS 110  29.417  -3.454  -9.806
  800    H    ASN 111           H        ASN 111  24.422  -8.612 -12.557
  801    HA   ASN 111           HA       ASN 111  24.389  -8.688 -15.417
  802   1HB   ASN 111          HB2       ASN 111  25.587 -10.422 -14.684
  803   2HB   ASN 111          HB3       ASN 111  24.822 -10.497 -13.135
  804   1HD2  ASN 111          HD21      ASN 111  22.836 -11.686 -12.804
  805   2HD2  ASN 111          HD22      ASN 111  22.610 -13.106 -13.780
  806    H    SER 112           H        SER 112  21.918  -9.321 -12.924
  807    HA   SER 112           HA       SER 112  20.018 -10.441 -14.772
  808   1HB   SER 112          HB2       SER 112  19.565  -9.208 -12.055
  809   2HB   SER 112          HB3       SER 112  18.396 -10.179 -12.972
  810    HG   SER 112           HG       SER 112  20.863 -10.975 -11.844
  811    H    GLY 113           H        GLY 113  20.668  -7.150 -13.524
  812   1HA   GLY 113          HA2       GLY 113  20.307  -5.753 -15.727
  813   2HA   GLY 113          HA3       GLY 113  18.609  -5.999 -15.329
  814    H    ALA 114           H        ALA 114  19.589  -5.770 -12.254
  815    HA   ALA 114           HA       ALA 114  18.541  -3.108 -12.187
  816   1HB   ALA 114          HB1       ALA 114  19.754  -4.767  -9.935
  817   2HB   ALA 114          HB2       ALA 114  18.940  -3.186  -9.750
  818   3HB   ALA 114          HB3       ALA 114  18.021  -4.568 -10.280
  819    H    LYS 115           H        LYS 115  19.589  -1.138 -11.785
  820    HA   LYS 115           HA       LYS 115  22.484  -1.163 -12.405
  821   1HB   LYS 115          HB2       LYS 115  22.284   1.298 -12.429
  822   2HB   LYS 115          HB3       LYS 115  21.247   0.483 -13.594
  823   1HG   LYS 115          HG2       LYS 115  19.275   0.860 -12.114
  824   2HG   LYS 115          HG3       LYS 115  20.330   1.651 -10.936
  825   1HD   LYS 115          HD2       LYS 115  19.172   3.340 -12.170
  826   2HD   LYS 115          HD3       LYS 115  20.887   3.401 -12.605
  827   1HE   LYS 115          HE2       LYS 115  20.397   2.131 -14.692
  828   2HE   LYS 115          HE3       LYS 115  18.692   2.028 -14.236
  829   1HZ   LYS 115          HZ1       LYS 115  18.576   4.448 -14.395
  830   2HZ   LYS 115          HZ2       LYS 115  20.157   4.543 -14.807
  831   3HZ   LYS 115          HZ3       LYS 115  19.093   3.818 -15.803
  832    H    GLN 116           H        GLN 116  24.022  -1.083 -10.797
  833    HA   GLN 116           HA       GLN 116  23.122  -0.829  -8.017
  834   1HB   GLN 116          HB2       GLN 116  25.018  -2.341  -8.527
  835   2HB   GLN 116          HB3       GLN 116  25.961  -0.957  -9.069
  836   1HG   GLN 116          HG2       GLN 116  25.942   0.041  -6.867
  837   2HG   GLN 116          HG3       GLN 116  24.613  -0.988  -6.343
  838   1HE2  GLN 116          HE22      GLN 116  25.610  -1.779  -4.517
  839   2HE2  GLN 116          HE21      GLN 116  26.925  -2.924  -4.558
  840    H    THR 117           H        THR 117  22.596   1.180  -7.314
  841    HA   THR 117           HA       THR 117  23.776   3.561  -8.647
  842    HB   THR 117           HB       THR 117  21.748   3.348  -6.395
  843    HG1  THR 117           HG1      THR 117  21.251   2.388  -8.524
  844   1HG2  THR 117          HG21      THR 117  21.110   5.634  -7.100
  845   2HG2  THR 117          HG22      THR 117  22.805   5.615  -6.609
  846   3HG2  THR 117          HG23      THR 117  22.400   5.622  -8.333
  847    H    GLY 118           H        GLY 118  24.990   5.130  -7.423
  848   1HA   GLY 118          HA2       GLY 118  26.421   5.909  -5.820
  849   2HA   GLY 118          HA3       GLY 118  25.519   4.939  -4.655
  850    H    GLU 119           H        GLU 119  26.775   3.601  -3.600
  851    HA   GLU 119           HA       GLU 119  28.206   1.532  -4.920
  852   1HB   GLU 119          HB2       GLU 119  30.400   1.810  -3.991
  853   2HB   GLU 119          HB3       GLU 119  30.006   3.265  -4.891
  854   1HG   GLU 119          HG2       GLU 119  29.402   4.366  -2.688
  855   2HG   GLU 119          HG3       GLU 119  30.033   2.914  -1.891
  856    H    THR 120           H        THR 120  28.973  -0.081  -3.152
  857    HA   THR 120           HA       THR 120  26.922  -0.776  -1.516
  858    HB   THR 120           HB       THR 120  29.811  -1.415  -0.883
  859    HG1  THR 120           HG1      THR 120  28.540  -2.937  -2.840
  860   1HG2  THR 120          HG21      THR 120  28.075  -2.486   0.513
  861   2HG2  THR 120          HG22      THR 120  27.301  -3.142  -0.943
  862   3HG2  THR 120          HG23      THR 120  28.937  -3.669  -0.493
  863    H    LEU 121           H        LEU 121  26.217  -0.322   0.462
  864    HA   LEU 121           HA       LEU 121  27.281   2.037   1.864
  865   1HB   LEU 121          HB2       LEU 121  24.776   1.254   1.054
  866   2HB   LEU 121          HB3       LEU 121  24.783   0.573   2.672
  867    HG   LEU 121           HG       LEU 121  25.168   3.440   1.871
  868   1HD1  LEU 121          HD11      LEU 121  22.861   2.617   1.620
  869   2HD1  LEU 121          HD12      LEU 121  22.842   2.183   3.347
  870   3HD1  LEU 121          HD13      LEU 121  23.004   3.883   2.844
  871   1HD2  LEU 121          HD21      LEU 121  26.416   3.215   3.918
  872   2HD2  LEU 121          HD22      LEU 121  24.896   3.979   4.332
  873   3HD2  LEU 121          HD23      LEU 121  25.114   2.254   4.675
  874    H    LYS 122           H        LYS 122  27.763   1.889   4.179
  875    HA   LYS 122           HA       LYS 122  27.976  -0.859   5.309
  876   1HB   LYS 122          HB2       LYS 122  30.030   1.388   5.548
  877   2HB   LYS 122          HB3       LYS 122  29.931   0.023   6.629
  878   1HG   LYS 122          HG2       LYS 122  31.656  -0.487   5.146
  879   2HG   LYS 122          HG3       LYS 122  30.321  -1.564   4.771
  880   1HD   LYS 122          HD2       LYS 122  31.572  -0.729   2.789
  881   2HD   LYS 122          HD3       LYS 122  29.850  -0.375   2.712
  882   1HE   LYS 122          HE2       LYS 122  30.255   1.955   3.405
  883   2HE   LYS 122          HE3       LYS 122  31.970   1.605   3.671
  884   1HZ   LYS 122          HZ1       LYS 122  32.270   1.250   1.359
  885   2HZ   LYS 122          HZ2       LYS 122  30.643   1.406   1.030
  886   3HZ   LYS 122          HZ3       LYS 122  31.536   2.692   1.544
  887    H    ILE 123           H        ILE 123  27.412  -0.951   7.479
  888    HA   ILE 123           HA       ILE 123  26.286   1.469   8.753
  889    HB   ILE 123           HB       ILE 123  24.381  -0.142   9.438
  890   1HG1  ILE 123          HG12      ILE 123  23.695  -1.775   7.704
  891   2HG1  ILE 123          HG13      ILE 123  25.205  -1.600   6.863
  892   1HG2  ILE 123          HG21      ILE 123  24.159   1.835   7.955
  893   2HG2  ILE 123          HG22      ILE 123  24.518   0.810   6.548
  894   3HG2  ILE 123          HG23      ILE 123  23.057   0.528   7.515
  895   1HD1  ILE 123          HD11      ILE 123  24.951  -3.667   8.294
  896   2HD1  ILE 123          HD12      ILE 123  26.404  -2.731   8.636
  897   3HD1  ILE 123          HD13      ILE 123  24.997  -2.625   9.730
  898    H    ASN 124           H        ASN 124  26.085   1.205  11.132
  899    HA   ASN 124           HA       ASN 124  27.362  -1.017  12.365
  900   1HB   ASN 124          HB2       ASN 124  29.220   0.820  11.313
  901   2HB   ASN 124          HB3       ASN 124  29.074   1.328  12.991
  902   1HD2  ASN 124          HD22      ASN 124  29.361  -1.610  10.961
  903   2HD2  ASN 124          HD21      ASN 124  30.497  -2.457  12.020
  904    H    ILE 125           H        ILE 125  27.938  -0.394  14.775
  905    HA   ILE 125           HA       ILE 125  25.943   1.573  15.790
  906    HB   ILE 125           HB       ILE 125  25.459  -0.001  17.647
  907   1HG1  ILE 125          HG12      ILE 125  26.830  -2.122  15.927
  908   2HG1  ILE 125          HG13      ILE 125  27.501  -1.440  17.411
  909   1HG2  ILE 125          HG21      ILE 125  23.973   0.322  15.671
  910   2HG2  ILE 125          HG22      ILE 125  24.724  -1.090  14.902
  911   3HG2  ILE 125          HG23      ILE 125  23.807  -1.271  16.410
  912   1HD1  ILE 125          HD11      ILE 125  24.963  -3.101  17.184
  913   2HD1  ILE 125          HD12      ILE 125  26.504  -3.566  17.919
  914   3HD1  ILE 125          HD13      ILE 125  25.520  -2.297  18.674
  915    H    LEU 126           H        LEU 126  29.233   0.313  16.081
  916    HA   LEU 126           HA       LEU 126  29.855   2.576  17.756
  917   1HB   LEU 126          HB2       LEU 126  28.992   0.798  19.394
  918   2HB   LEU 126          HB3       LEU 126  30.412  -0.155  19.023
  919    HG   LEU 126           HG       LEU 126  30.435   2.699  20.127
  920   1HD1  LEU 126          HD11      LEU 126  30.823   0.044  21.576
  921   2HD1  LEU 126          HD12      LEU 126  30.972   1.663  22.296
  922   3HD1  LEU 126          HD13      LEU 126  29.404   1.108  21.701
  923   1HD2  LEU 126          HD21      LEU 126  32.788   2.153  20.818
  924   2HD2  LEU 126          HD22      LEU 126  32.691   0.661  19.862
  925   3HD2  LEU 126          HD23      LEU 126  32.589   2.258  19.078
  926    H    ASP 127           H        ASP 127  31.258  -0.688  17.213
  927    HA   ASP 127           HA       ASP 127  33.407   0.445  15.493
  928   1HB   ASP 127          HB2       ASP 127  34.187   0.603  17.825
  929   2HB   ASP 127          HB3       ASP 127  33.825  -1.104  18.080
  930    H    HIS 128           H        HIS 128  31.225  -2.112  16.234
  931    HA   HIS 128           HA       HIS 128  32.062  -3.524  13.888
  932   1HB   HIS 128          HB2       HIS 128  33.411  -4.721  15.591
  933   2HB   HIS 128          HB3       HIS 128  31.963  -4.979  16.568
  934    HD1  HIS 128           HD1      HIS 128  30.681  -7.215  16.035
  935    HD2  HIS 128           HD2      HIS 128  33.243  -5.885  12.964
  936    HE1  HIS 128           HE1      HIS 128  30.615  -8.999  14.222
  937    H    ASP 129           H        ASP 129  30.285  -4.927  13.213
  938    HA   ASP 129           HA       ASP 129  27.834  -5.111  14.684
  939   1HB   ASP 129          HB2       ASP 129  27.856  -2.763  13.502
  940   2HB   ASP 129          HB3       ASP 129  27.610  -3.537  12.035
  941    H    ILE 130           H        ILE 130  28.756  -4.649  11.462
  942    HA   ILE 130           HA       ILE 130  29.073  -7.532  10.773
  943    HB   ILE 130           HB       ILE 130  27.388  -5.529   9.232
  944   1HG1  ILE 130          HG12      ILE 130  26.098  -6.768  10.802
  945   2HG1  ILE 130          HG13      ILE 130  25.708  -7.266   9.171
  946   1HG2  ILE 130          HG21      ILE 130  27.344  -7.040   7.337
  947   2HG2  ILE 130          HG22      ILE 130  28.980  -6.509   7.615
  948   3HG2  ILE 130          HG23      ILE 130  28.529  -8.128   8.143
  949   1HD1  ILE 130          HD11      ILE 130  25.725  -9.205  10.609
  950   2HD1  ILE 130          HD12      ILE 130  27.110  -9.348   9.519
  951   3HD1  ILE 130          HD13      ILE 130  27.351  -8.851  11.196
  952    HA   PRO 131           HA       PRO 131  32.429  -4.959   8.796
  953   1HB   PRO 131          HB2       PRO 131  32.231  -2.525   7.737
  954   2HB   PRO 131          HB3       PRO 131  31.309  -3.853   6.980
  955   1HG   PRO 131          HG2       PRO 131  30.274  -1.912   9.099
  956   2HG   PRO 131          HG3       PRO 131  29.656  -2.169   7.470
  957   1HD   PRO 131          HD2       PRO 131  28.661  -3.574   9.634
  958   2HD   PRO 131          HD3       PRO 131  28.827  -4.352   8.035
  959    H    GLU 132           H        GLU 132  32.697  -1.868   9.326
  960    HA   GLU 132           HA       GLU 132  32.956  -1.962  12.294
  961   1HB   GLU 132          HB2       GLU 132  35.361  -1.557  12.219
  962   2HB   GLU 132          HB3       GLU 132  34.946  -3.085  11.451
  963   1HG   GLU 132          HG2       GLU 132  35.194  -2.061   9.211
  964   2HG   GLU 132          HG3       GLU 132  35.522  -0.492   9.945
  965    H    ASP 133           H        ASP 133  32.054  -0.074   9.666
  966    HA   ASP 133           HA       ASP 133  32.490   2.445  11.137
  967   1HB   ASP 133          HB2       ASP 133  34.544   2.213   9.855
  968   2HB   ASP 133          HB3       ASP 133  33.643   1.827   8.390
  969    HA   PRO 134           HA       PRO 134  28.491   2.619   8.971
  970   1HB   PRO 134          HB2       PRO 134  27.412   4.829  10.145
  971   2HB   PRO 134          HB3       PRO 134  27.578   3.274  11.017
  972   1HG   PRO 134          HG2       PRO 134  29.400   5.691  11.152
  973   2HG   PRO 134          HG3       PRO 134  28.759   4.703  12.503
  974   1HD   PRO 134          HD2       PRO 134  31.267   4.356  11.400
  975   2HD   PRO 134          HD3       PRO 134  30.345   3.019  12.135
  976    H    ALA 135           H        ALA 135  27.669   3.845   7.223
  977    HA   ALA 135           HA       ALA 135  29.172   6.261   6.350
  978   1HB   ALA 135          HB1       ALA 135  30.168   4.254   5.293
  979   2HB   ALA 135          HB2       ALA 135  28.568   3.784   4.676
  980   3HB   ALA 135          HB3       ALA 135  29.344   5.273   4.102
  981    H    GLU 136           H        GLU 136  26.694   6.277   7.662
  982    HA   GLU 136           HA       GLU 136  24.369   5.941   6.213
  983   1HB   GLU 136          HB2       GLU 136  24.525   6.331   8.619
  984   2HB   GLU 136          HB3       GLU 136  25.025   8.010   8.348
  985   1HG   GLU 136          HG2       GLU 136  22.856   8.523   7.324
  986   2HG   GLU 136          HG3       GLU 136  22.343   6.838   7.495
  987    H    GLU 137           H        GLU 137  26.612   8.659   5.923
  988    HA   GLU 137           HA       GLU 137  25.032  10.550   4.563
  989   1HB   GLU 137          HB2       GLU 137  27.960   9.808   4.164
  990   2HB   GLU 137          HB3       GLU 137  27.189  11.268   3.525
  991   1HG   GLU 137          HG2       GLU 137  26.616  11.972   5.850
  992   2HG   GLU 137          HG3       GLU 137  27.463  10.559   6.479
  993    H    TRP 138           H        TRP 138  26.279   7.454   3.354
  994    HA   TRP 138           HA       TRP 138  25.996   7.849   0.557
  995   1HB   TRP 138          HB2       TRP 138  25.680   5.496   2.413
  996   2HB   TRP 138          HB3       TRP 138  25.214   5.367   0.736
  997    HD1  TRP 138           HD1      TRP 138  26.713   3.662  -0.086
  998    HE1  TRP 138           HE1      TRP 138  29.179   3.353  -0.448
  999    HE3  TRP 138           HE3      TRP 138  28.408   7.804   2.455
 1000    HZ2  TRP 138           HZ2      TRP 138  31.650   4.779   0.197
 1001    HZ3  TRP 138           HZ3      TRP 138  30.825   8.284   2.553
 1002    HH2  TRP 138           HH2      TRP 138  32.458   6.785   1.429
 1003    H    LEU 139           H        LEU 139  23.577   7.109   3.118
 1004    HA   LEU 139           HA       LEU 139  21.395   6.418   1.356
 1005   1HB   LEU 139          HB2       LEU 139  21.844   6.266   4.048
 1006   2HB   LEU 139          HB3       LEU 139  21.007   7.779   4.043
 1007    HG   LEU 139           HG       LEU 139  19.088   6.685   2.801
 1008   1HD1  LEU 139          HD11      LEU 139  20.614   4.139   3.535
 1009   2HD1  LEU 139          HD12      LEU 139  18.925   4.187   3.008
 1010   3HD1  LEU 139          HD13      LEU 139  20.202   4.676   1.893
 1011   1HD2  LEU 139          HD21      LEU 139  19.865   5.611   5.549
 1012   2HD2  LEU 139          HD22      LEU 139  19.008   7.128   5.206
 1013   3HD2  LEU 139          HD23      LEU 139  18.225   5.579   4.866
 1014    H    GLY 140           H        GLY 140  22.322   9.345   3.108
 1015   1HA   GLY 140          HA2       GLY 140  20.359  11.137   2.181
 1016   2HA   GLY 140          HA3       GLY 140  22.000  11.605   2.669
 1017    H    SER 141           H        SER 141  23.662  10.525   0.689
 1018    HA   SER 141           HA       SER 141  23.388  12.191  -1.520
 1019   1HB   SER 141          HB2       SER 141  24.923   9.701  -0.685
 1020   2HB   SER 141          HB3       SER 141  25.109  10.394  -2.266
 1021    HG   SER 141           HG       SER 141  26.628  11.239  -0.740
 1022    H    TRP 142           H        TRP 142  22.876   8.630  -1.267
 1023    HA   TRP 142           HA       TRP 142  22.033   8.109  -3.851
 1024   1HB   TRP 142          HB2       TRP 142  22.697   6.453  -2.210
 1025   2HB   TRP 142          HB3       TRP 142  21.306   6.843  -1.209
 1026    HD1  TRP 142           HD1      TRP 142  22.112   5.278  -4.608
 1027    HE1  TRP 142           HE1      TRP 142  20.239   3.624  -5.249
 1028    HE3  TRP 142           HE3      TRP 142  19.084   5.963  -0.558
 1029    HZ2  TRP 142           HZ2      TRP 142  17.809   2.606  -4.043
 1030    HZ3  TRP 142           HZ3      TRP 142  16.994   4.602  -0.324
 1031    HH2  TRP 142           HH2      TRP 142  16.367   2.939  -2.048
 1032    H    VAL 143           H        VAL 143  19.981   9.009  -1.042
 1033    HA   VAL 143           HA       VAL 143  17.470   9.041  -2.317
 1034    HB   VAL 143           HB       VAL 143  18.714  10.408   0.072
 1035   1HG1  VAL 143          HG11      VAL 143  16.558  11.336   0.747
 1036   2HG1  VAL 143          HG12      VAL 143  17.165  12.116  -0.704
 1037   3HG1  VAL 143          HG13      VAL 143  15.870  10.892  -0.841
 1038   1HG2  VAL 143          HG21      VAL 143  17.133   9.014   1.303
 1039   2HG2  VAL 143          HG22      VAL 143  16.377   8.467  -0.212
 1040   3HG2  VAL 143          HG23      VAL 143  18.042   8.004   0.172
 1041    H    ASN 144           H        ASN 144  19.731  11.885  -1.831
 1042    HA   ASN 144           HA       ASN 144  18.005  13.485  -3.431
 1043   1HB   ASN 144          HB2       ASN 144  19.174  15.225  -2.781
 1044   2HB   ASN 144          HB3       ASN 144  19.962  14.122  -1.667
 1045   1HD2  ASN 144          HD22      ASN 144  21.866  12.818  -3.027
 1046   2HD2  ASN 144          HD21      ASN 144  22.976  13.937  -3.792
 1047    H    LEU 145           H        LEU 145  20.380  11.183  -4.389
 1048    HA   LEU 145           HA       LEU 145  20.800  12.232  -7.061
 1049   1HB   LEU 145          HB2       LEU 145  21.634   9.834  -5.505
 1050   2HB   LEU 145          HB3       LEU 145  21.295   9.501  -7.192
 1051    HG   LEU 145           HG       LEU 145  22.868  11.233  -7.921
 1052   1HD1  LEU 145          HD11      LEU 145  24.436  12.278  -6.329
 1053   2HD1  LEU 145          HD12      LEU 145  22.776  12.778  -5.990
 1054   3HD1  LEU 145          HD13      LEU 145  23.554  11.553  -4.968
 1055   1HD2  LEU 145          HD21      LEU 145  24.055   9.245  -5.933
 1056   2HD2  LEU 145          HD22      LEU 145  23.619   8.900  -7.620
 1057   3HD2  LEU 145          HD23      LEU 145  24.926  10.038  -7.266
 1058    H    LEU 146           H        LEU 146  18.748   9.554  -5.654
 1059    HA   LEU 146           HA       LEU 146  17.588   8.996  -8.201
 1060   1HB   LEU 146          HB2       LEU 146  16.319   7.400  -7.076
 1061   2HB   LEU 146          HB3       LEU 146  17.962   7.327  -6.484
 1062    HG   LEU 146           HG       LEU 146  16.920   8.763  -4.484
 1063   1HD1  LEU 146          HD11      LEU 146  14.628   7.978  -3.910
 1064   2HD1  LEU 146          HD12      LEU 146  14.613   9.003  -5.338
 1065   3HD1  LEU 146          HD13      LEU 146  14.483   7.246  -5.517
 1066   1HD2  LEU 146          HD21      LEU 146  16.535   6.674  -3.257
 1067   2HD2  LEU 146          HD22      LEU 146  16.476   5.774  -4.787
 1068   3HD2  LEU 146          HD23      LEU 146  17.974   6.569  -4.271
 1069    H    LYS 147           H        LYS 147  16.684  11.135  -5.585
 1070    HA   LYS 147           HA       LYS 147  13.998  11.708  -6.228
 1071   1HB   LYS 147          HB2       LYS 147  16.284  13.260  -4.989
 1072   2HB   LYS 147          HB3       LYS 147  14.805  14.106  -5.436
 1073   1HG   LYS 147          HG2       LYS 147  13.454  12.545  -4.068
 1074   2HG   LYS 147          HG3       LYS 147  14.935  11.715  -3.560
 1075   1HD   LYS 147          HD2       LYS 147  15.774  13.834  -2.570
 1076   2HD   LYS 147          HD3       LYS 147  14.285  14.660  -3.037
 1077   1HE   LYS 147          HE2       LYS 147  14.419  12.234  -1.185
 1078   2HE   LYS 147          HE3       LYS 147  14.422  13.902  -0.619
 1079   1HZ   LYS 147          HZ1       LYS 147  12.211  12.677  -2.165
 1080   2HZ   LYS 147          HZ2       LYS 147  12.250  12.873  -0.542
 1081   3HZ   LYS 147          HZ3       LYS 147  12.225  14.187  -1.524
  Start of MODEL   11
    1   1H    MET   1          H1        MET   1   1.492  -0.666   1.294
    2   2H    MET   1          H2        MET   1   1.249   0.683   2.184
    3   3H    MET   1          H3        MET   1   0.152   0.244   1.043
    4    HA   MET   1           HA       MET   1   1.761   0.591  -0.706
    5   1HB   MET   1          HB2       MET   1   0.252   2.455  -0.119
    6   2HB   MET   1          HB3       MET   1   1.382   3.013   1.115
    7   1HG   MET   1          HG2       MET   1   1.542   4.342  -0.943
    8   2HG   MET   1          HG3       MET   1   3.054   3.543  -0.559
    9   1HE   MET   1          HE1       MET   1  -0.262   2.240  -2.457
   10   2HE   MET   1          HE2       MET   1   0.067   3.894  -3.023
   11   3HE   MET   1          HE3       MET   1   0.269   2.519  -4.127
   12    H    ALA   2           H        ALA   2   3.900   0.573  -1.282
   13    HA   ALA   2           HA       ALA   2   5.898   1.762   0.459
   14   1HB   ALA   2          HB1       ALA   2   7.416  -0.203   0.298
   15   2HB   ALA   2          HB2       ALA   2   5.976  -0.559   1.270
   16   3HB   ALA   2          HB3       ALA   2   6.098  -1.161  -0.402
   17    H    ASP   3           H        ASP   3   7.646   2.470  -0.745
   18    HA   ASP   3           HA       ASP   3   7.428   2.384  -3.694
   19   1HB   ASP   3          HB2       ASP   3   7.601   4.596  -2.382
   20   2HB   ASP   3          HB3       ASP   3   9.195   4.090  -1.893
   21    H    ILE   4           H        ILE   4   9.307   1.269  -0.951
   22    HA   ILE   4           HA       ILE   4  11.355   0.097  -2.755
   23    HB   ILE   4           HB       ILE   4  11.944   1.304  -0.033
   24   1HG1  ILE   4          HG12      ILE   4  12.357   2.665  -2.716
   25   2HG1  ILE   4          HG13      ILE   4  11.213   3.171  -1.467
   26   1HG2  ILE   4          HG21      ILE   4  13.507  -0.430  -0.944
   27   2HG2  ILE   4          HG22      ILE   4  13.756   0.569  -2.376
   28   3HG2  ILE   4          HG23      ILE   4  14.275   1.133  -0.770
   29   1HD1  ILE   4          HD11      ILE   4  13.097   3.621   0.082
   30   2HD1  ILE   4          HD12      ILE   4  14.223   3.292  -1.262
   31   3HD1  ILE   4          HD13      ILE   4  13.082   4.635  -1.374
   32    H    THR   5           H        THR   5  11.735  -2.037  -2.364
   33    HA   THR   5           HA       THR   5  10.604  -3.333   0.039
   34    HB   THR   5           HB       THR   5  10.210  -4.472  -2.097
   35    HG1  THR   5           HG1      THR   5  11.165  -6.438  -1.591
   36   1HG2  THR   5          HG21      THR   5  11.999  -3.602  -3.510
   37   2HG2  THR   5          HG22      THR   5  13.201  -4.538  -2.589
   38   3HG2  THR   5          HG23      THR   5  11.948  -5.361  -3.534
   39    H    LEU   6           H        LEU   6  11.938  -3.814   1.778
   40    HA   LEU   6           HA       LEU   6  14.875  -3.207   1.554
   41   1HB   LEU   6          HB2       LEU   6  12.871  -2.979   3.797
   42   2HB   LEU   6          HB3       LEU   6  14.551  -3.226   4.169
   43    HG   LEU   6           HG       LEU   6  13.704  -0.866   4.284
   44   1HD1  LEU   6          HD11      LEU   6  16.098  -1.346   2.478
   45   2HD1  LEU   6          HD12      LEU   6  15.742   0.147   3.366
   46   3HD1  LEU   6          HD13      LEU   6  16.089  -1.339   4.256
   47   1HD2  LEU   6          HD21      LEU   6  13.917  -0.866   1.263
   48   2HD2  LEU   6          HD22      LEU   6  12.383  -0.867   2.159
   49   3HD2  LEU   6          HD23      LEU   6  13.506   0.501   2.314
   50    H    ILE   7           H        ILE   7  15.516  -5.137   0.846
   51    HA   ILE   7           HA       ILE   7  14.312  -7.626   1.775
   52    HB   ILE   7           HB       ILE   7  16.468  -7.053  -0.304
   53   1HG1  ILE   7          HG12      ILE   7  13.477  -7.567  -0.643
   54   2HG1  ILE   7          HG13      ILE   7  14.278  -6.013  -0.864
   55   1HG2  ILE   7          HG21      ILE   7  16.542  -9.401   0.559
   56   2HG2  ILE   7          HG22      ILE   7  14.829  -9.579   0.123
   57   3HG2  ILE   7          HG23      ILE   7  16.075  -9.315  -1.119
   58   1HD1  ILE   7          HD11      ILE   7  15.613  -6.974  -2.743
   59   2HD1  ILE   7          HD12      ILE   7  14.645  -8.467  -2.615
   60   3HD1  ILE   7          HD13      ILE   7  13.865  -6.941  -3.027
   61    H    SER   8           H        SER   8  14.979  -8.044   3.897
   62    HA   SER   8           HA       SER   8  17.864  -8.155   4.529
   63   1HB   SER   8          HB2       SER   8  15.598  -9.040   6.335
   64   2HB   SER   8          HB3       SER   8  17.197  -8.414   6.768
   65    HG   SER   8           HG       SER   8  14.908  -7.113   5.779
   66    H    GLY   9           H        GLY   9  17.561  -9.734   2.439
   67   1HA   GLY   9          HA2       GLY   9  16.319 -12.302   3.019
   68   2HA   GLY   9          HA3       GLY   9  17.109 -11.799   1.519
   69    H    SER  10           H        SER  10  19.203 -11.364   4.234
   70    HA   SER  10           HA       SER  10  21.286 -12.644   3.191
   71   1HB   SER  10          HB2       SER  10  20.990 -12.740   6.172
   72   2HB   SER  10          HB3       SER  10  22.391 -12.337   5.157
   73    HG   SER  10           HG       SER  10  21.346 -10.429   4.567
   74    H    THR  11           H        THR  11  19.027 -14.326   5.432
   75    HA   THR  11           HA       THR  11  19.508 -16.771   3.911
   76    HB   THR  11           HB       THR  11  21.253 -16.833   5.609
   77    HG1  THR  11           HG1      THR  11  20.526 -18.731   4.946
   78   1HG2  THR  11          HG21      THR  11  19.121 -16.914   7.773
   79   2HG2  THR  11          HG22      THR  11  20.870 -17.122   7.968
   80   3HG2  THR  11          HG23      THR  11  20.223 -15.561   7.453
   81    H    LEU  12           H        LEU  12  17.495 -15.262   3.494
   82    HA   LEU  12           HA       LEU  12  15.325 -14.771   3.599
   83   1HB   LEU  12          HB2       LEU  12  15.276 -17.381   3.394
   84   2HB   LEU  12          HB3       LEU  12  14.698 -17.345   5.048
   85    HG   LEU  12           HG       LEU  12  12.855 -15.716   4.204
   86   1HD1  LEU  12          HD11      LEU  12  12.340 -15.935   1.753
   87   2HD1  LEU  12          HD12      LEU  12  13.837 -15.058   2.049
   88   3HD1  LEU  12          HD13      LEU  12  13.893 -16.752   1.519
   89   1HD2  LEU  12          HD21      LEU  12  12.922 -18.560   3.104
   90   2HD2  LEU  12          HD22      LEU  12  12.419 -18.084   4.739
   91   3HD2  LEU  12          HD23      LEU  12  11.468 -17.563   3.342
   92    H    GLY  13           H        GLY  13  16.896 -13.694   5.448
   93   1HA   GLY  13          HA2       GLY  13  15.527 -12.375   7.385
   94   2HA   GLY  13          HA3       GLY  13  16.048 -13.875   8.197
   95    H    GLY  14           H        GLY  14  17.047 -11.133   8.685
   96   1HA   GLY  14          HA2       GLY  14  19.943 -11.489   8.343
   97   2HA   GLY  14          HA3       GLY  14  19.185 -10.263   7.318
   98    H    ALA  15           H        ALA  15  20.293  -8.580   8.375
   99    HA   ALA  15           HA       ALA  15  20.156  -8.119  11.229
  100   1HB   ALA  15          HB1       ALA  15  22.110  -7.444   9.906
  101   2HB   ALA  15          HB2       ALA  15  21.100  -6.355   8.926
  102   3HB   ALA  15          HB3       ALA  15  21.348  -6.029  10.655
  103    H    GLU  16           H        GLU  16  17.658  -8.394  11.054
  104    HA   GLU  16           HA       GLU  16  15.972  -6.643   9.778
  105   1HB   GLU  16          HB2       GLU  16  15.439  -7.662  12.592
  106   2HB   GLU  16          HB3       GLU  16  14.259  -7.154  11.386
  107   1HG   GLU  16          HG2       GLU  16  16.026  -9.633  11.352
  108   2HG   GLU  16          HG3       GLU  16  14.285  -9.574  11.574
  109    H    TYR  17           H        TYR  17  17.581  -6.014  12.934
  110    HA   TYR  17           HA       TYR  17  16.087  -3.714  13.639
  111   1HB   TYR  17          HB2       TYR  17  17.665  -4.926  15.143
  112   2HB   TYR  17          HB3       TYR  17  19.025  -4.308  14.215
  113    HD1  TYR  17           HD1      TYR  17  16.489  -3.550  16.755
  114    HD2  TYR  17           HD2      TYR  17  19.552  -1.827  14.248
  115    HE1  TYR  17           HE1      TYR  17  16.444  -1.485  18.120
  116    HE2  TYR  17           HE2      TYR  17  19.496   0.248  15.589
  117    HH   TYR  17           HH       TYR  17  18.471   1.382  17.359
  118    H    VAL  18           H        VAL  18  18.999  -4.068  11.543
  119    HA   VAL  18           HA       VAL  18  19.204  -1.175  11.289
  120    HB   VAL  18           HB       VAL  18  21.053  -3.162  11.209
  121   1HG1  VAL  18          HG11      VAL  18  20.392  -3.984   8.960
  122   2HG1  VAL  18          HG12      VAL  18  20.791  -2.390   8.281
  123   3HG1  VAL  18          HG13      VAL  18  22.051  -3.389   9.034
  124   1HG2  VAL  18          HG21      VAL  18  21.410  -0.756  11.607
  125   2HG2  VAL  18          HG22      VAL  18  22.628  -1.460  10.543
  126   3HG2  VAL  18          HG23      VAL  18  21.314  -0.459   9.859
  127    H    ALA  19           H        ALA  19  17.815  -3.887   9.454
  128    HA   ALA  19           HA       ALA  19  17.213  -2.398   7.080
  129   1HB   ALA  19          HB1       ALA  19  15.614  -4.172   6.625
  130   2HB   ALA  19          HB2       ALA  19  17.131  -4.864   7.227
  131   3HB   ALA  19          HB3       ALA  19  15.715  -4.749   8.299
  132    H    GLU  20           H        GLU  20  15.330  -2.945  10.127
  133    HA   GLU  20           HA       GLU  20  13.117  -1.333   9.357
  134   1HB   GLU  20          HB2       GLU  20  13.203  -3.014  11.218
  135   2HB   GLU  20          HB3       GLU  20  14.170  -1.872  12.165
  136   1HG   GLU  20          HG2       GLU  20  12.308  -0.222  12.032
  137   2HG   GLU  20          HG3       GLU  20  11.372  -1.352  11.054
  138    H    HIS  21           H        HIS  21  16.203  -0.476  11.053
  139    HA   HIS  21           HA       HIS  21  15.530   2.248  11.526
  140   1HB   HIS  21          HB2       HIS  21  17.432   1.125  12.596
  141   2HB   HIS  21          HB3       HIS  21  18.238   0.944  11.036
  142    HD1  HIS  21           HD1      HIS  21  19.791   2.948  10.335
  143    HD2  HIS  21           HD2      HIS  21  17.036   3.823  13.399
  144    HE1  HIS  21           HE1      HIS  21  20.341   5.298  11.144
  145    H    LEU  22           H        LEU  22  17.186   0.697   8.740
  146    HA   LEU  22           HA       LEU  22  17.622   2.974   7.129
  147   1HB   LEU  22          HB2       LEU  22  17.093   0.037   6.592
  148   2HB   LEU  22          HB3       LEU  22  17.195   1.144   5.251
  149    HG   LEU  22           HG       LEU  22  19.413   0.964   7.336
  150   1HD1  LEU  22          HD11      LEU  22  19.157  -0.656   4.764
  151   2HD1  LEU  22          HD12      LEU  22  20.542  -0.654   5.889
  152   3HD1  LEU  22          HD13      LEU  22  19.002  -1.289   6.415
  153   1HD2  LEU  22          HD21      LEU  22  20.804   1.832   5.459
  154   2HD2  LEU  22          HD22      LEU  22  19.357   1.914   4.433
  155   3HD2  LEU  22          HD23      LEU  22  19.495   2.944   5.872
  156    H    ALA  23           H        ALA  23  14.857   0.697   7.115
  157    HA   ALA  23           HA       ALA  23  13.180   1.970   5.302
  158   1HB   ALA  23          HB1       ALA  23  12.675  -0.224   6.227
  159   2HB   ALA  23          HB2       ALA  23  12.494   0.445   7.855
  160   3HB   ALA  23          HB3       ALA  23  11.329   0.863   6.610
  161    H    GLU  24           H        GLU  24  13.305   2.564   8.878
  162    HA   GLU  24           HA       GLU  24  11.327   4.530   8.993
  163   1HB   GLU  24          HB2       GLU  24  12.622   3.376  10.885
  164   2HB   GLU  24          HB3       GLU  24  13.881   4.568  10.671
  165   1HG   GLU  24          HG2       GLU  24  12.273   6.371  11.113
  166   2HG   GLU  24          HG3       GLU  24  10.960   5.202  11.269
  167    H    LYS  25           H        LYS  25  14.875   5.062   8.730
  168    HA   LYS  25           HA       LYS  25  14.757   7.854   8.386
  169   1HB   LYS  25          HB2       LYS  25  16.735   5.747   7.400
  170   2HB   LYS  25          HB3       LYS  25  17.035   7.465   7.288
  171   1HG   LYS  25          HG2       LYS  25  16.563   5.851   9.851
  172   2HG   LYS  25          HG3       LYS  25  18.087   6.451   9.294
  173   1HD   LYS  25          HD2       LYS  25  15.732   7.947  10.424
  174   2HD   LYS  25          HD3       LYS  25  17.332   7.824  11.115
  175   1HE   LYS  25          HE2       LYS  25  16.662   9.329   8.536
  176   2HE   LYS  25          HE3       LYS  25  16.734  10.053  10.137
  177   1HZ   LYS  25          HZ1       LYS  25  19.072   9.450  10.271
  178   2HZ   LYS  25          HZ2       LYS  25  19.038   8.758   8.789
  179   3HZ   LYS  25          HZ3       LYS  25  18.810  10.364   8.953
  180    H    LEU  26           H        LEU  26  14.593   5.335   5.874
  181    HA   LEU  26           HA       LEU  26  14.547   7.198   3.675
  182   1HB   LEU  26          HB2       LEU  26  13.930   4.283   4.065
  183   2HB   LEU  26          HB3       LEU  26  13.332   5.060   2.614
  184    HG   LEU  26           HG       LEU  26  15.427   5.542   1.774
  185   1HD1  LEU  26          HD11      LEU  26  16.648   6.507   3.670
  186   2HD1  LEU  26          HD12      LEU  26  16.760   4.910   4.438
  187   3HD1  LEU  26          HD13      LEU  26  17.602   5.237   2.918
  188   1HD2  LEU  26          HD21      LEU  26  14.865   3.152   1.676
  189   2HD2  LEU  26          HD22      LEU  26  16.620   3.385   1.797
  190   3HD2  LEU  26          HD23      LEU  26  15.697   2.876   3.222
  191    H    GLU  27           H        GLU  27  11.850   5.905   5.745
  192    HA   GLU  27           HA       GLU  27   9.878   7.165   4.082
  193   1HB   GLU  27          HB2       GLU  27   9.813   6.158   6.958
  194   2HB   GLU  27          HB3       GLU  27   8.437   6.814   6.070
  195   1HG   GLU  27          HG2       GLU  27   9.028   5.077   4.234
  196   2HG   GLU  27          HG3       GLU  27   9.995   4.301   5.461
  197    H    GLU  28           H        GLU  28  11.793   8.221   6.959
  198    HA   GLU  28           HA       GLU  28  10.610  10.804   7.165
  199   1HB   GLU  28          HB2       GLU  28  13.348   9.669   7.866
  200   2HB   GLU  28          HB3       GLU  28  12.898  11.320   8.201
  201   1HG   GLU  28          HG2       GLU  28  11.412   8.897   9.290
  202   2HG   GLU  28          HG3       GLU  28  12.685   9.768  10.138
  203    H    ALA  29           H        ALA  29  13.041   9.466   4.920
  204    HA   ALA  29           HA       ALA  29  13.890  12.013   3.877
  205   1HB   ALA  29          HB1       ALA  29  15.246   9.932   3.652
  206   2HB   ALA  29          HB2       ALA  29  14.022   9.278   2.536
  207   3HB   ALA  29          HB3       ALA  29  14.932  10.723   2.098
  208    H    GLY  30           H        GLY  30  11.037  10.053   3.397
  209   1HA   GLY  30          HA2       GLY  30   9.224  11.556   2.653
  210   2HA   GLY  30          HA3       GLY  30  10.162  11.872   1.190
  211    H    PHE  31           H        PHE  31  10.668   8.577   1.808
  212    HA   PHE  31           HA       PHE  31   8.671   7.982  -0.317
  213   1HB   PHE  31          HB2       PHE  31  10.742   6.005   0.555
  214   2HB   PHE  31          HB3       PHE  31  10.034   6.275  -1.015
  215    HD1  PHE  31           HD1      PHE  31  10.582   8.753  -2.052
  216    HD2  PHE  31           HD2      PHE  31  13.002   6.611   0.804
  217    HE1  PHE  31           HE1      PHE  31  12.567  10.080  -2.729
  218    HE2  PHE  31           HE2      PHE  31  14.982   7.921   0.114
  219    HZ   PHE  31           HZ       PHE  31  14.773   9.663  -1.656
  220    H    THR  32           H        THR  32   8.386   5.227   0.070
  221    HA   THR  32           HA       THR  32   7.494   4.804   2.835
  222    HB   THR  32           HB       THR  32   5.595   3.408   1.887
  223    HG1  THR  32           HG1      THR  32   5.878   5.243  -0.268
  224   1HG2  THR  32          HG21      THR  32   5.366   6.436   1.790
  225   2HG2  THR  32          HG22      THR  32   4.021   5.277   1.951
  226   3HG2  THR  32          HG23      THR  32   5.249   5.394   3.227
  227    H    THR  33           H        THR  33   7.816   2.599   3.447
  228    HA   THR  33           HA       THR  33   9.367   0.972   1.481
  229    HB   THR  33           HB       THR  33  11.117   0.736   3.152
  230    HG1  THR  33           HG1      THR  33   9.816   1.102   5.022
  231   1HG2  THR  33          HG21      THR  33  10.563   3.723   2.882
  232   2HG2  THR  33          HG22      THR  33  12.131   2.920   3.109
  233   3HG2  THR  33          HG23      THR  33  11.250   2.735   1.582
  234    H    GLU  34           H        GLU  34   9.572  -1.343   2.064
  235    HA   GLU  34           HA       GLU  34   7.727  -2.236   4.206
  236   1HB   GLU  34          HB2       GLU  34   7.627  -2.573   1.433
  237   2HB   GLU  34          HB3       GLU  34   8.182  -4.079   2.099
  238   1HG   GLU  34          HG2       GLU  34   5.871  -2.466   3.232
  239   2HG   GLU  34          HG3       GLU  34   5.684  -3.627   1.992
  240    H    THR  35           H        THR  35   9.131  -2.822   5.897
  241    HA   THR  35           HA       THR  35  11.829  -3.814   5.404
  242    HB   THR  35           HB       THR  35  10.296  -3.996   8.020
  243    HG1  THR  35           HG1      THR  35  10.238  -1.849   7.535
  244   1HG2  THR  35          HG21      THR  35  12.476  -5.232   7.770
  245   2HG2  THR  35          HG22      THR  35  13.261  -3.700   7.347
  246   3HG2  THR  35          HG23      THR  35  12.561  -3.928   8.969
  247    H    LEU  36           H        LEU  36  12.248  -5.850   4.781
  248    HA   LEU  36           HA       LEU  36  10.270  -8.022   5.361
  249   1HB   LEU  36          HB2       LEU  36  11.580  -7.128   2.756
  250   2HB   LEU  36          HB3       LEU  36  10.787  -8.683   2.921
  251    HG   LEU  36           HG       LEU  36   9.300  -6.112   3.537
  252   1HD1  LEU  36          HD11      LEU  36   9.700  -7.471   0.858
  253   2HD1  LEU  36          HD12      LEU  36   8.448  -6.241   1.201
  254   3HD1  LEU  36          HD13      LEU  36  10.160  -5.824   1.324
  255   1HD2  LEU  36          HD21      LEU  36   7.329  -7.496   2.988
  256   2HD2  LEU  36          HD22      LEU  36   8.369  -8.883   2.636
  257   3HD2  LEU  36          HD23      LEU  36   8.254  -8.243   4.293
  258    H    HIS  37           H        HIS  37  11.099 -10.137   5.227
  259    HA   HIS  37           HA       HIS  37  14.024 -10.420   5.506
  260   1HB   HIS  37          HB2       HIS  37  12.003 -12.681   5.674
  261   2HB   HIS  37          HB3       HIS  37  13.527 -12.530   6.520
  262    HD1  HIS  37           HD1      HIS  37  13.010  -9.851   8.227
  263    HD2  HIS  37           HD2      HIS  37  10.217 -12.930   7.468
  264    HE1  HIS  37           HE1      HIS  37  11.255  -9.693  10.038
  265    H    GLY  38           H        GLY  38  12.697  -9.773   2.975
  266   1HA   GLY  38          HA2       GLY  38  12.423 -10.396   0.773
  267   2HA   GLY  38          HA3       GLY  38  13.834 -11.439   1.037
  268    HA   PRO  39           HA       PRO  39  10.620 -14.567   2.372
  269   1HB   PRO  39          HB2       PRO  39   7.947 -14.073   2.707
  270   2HB   PRO  39          HB3       PRO  39   9.180 -13.710   3.955
  271   1HG   PRO  39          HG2       PRO  39   7.994 -11.811   1.901
  272   2HG   PRO  39          HG3       PRO  39   8.160 -11.563   3.669
  273   1HD   PRO  39          HD2       PRO  39   9.994 -10.576   1.921
  274   2HD   PRO  39          HD3       PRO  39  10.478 -11.256   3.509
  275    H    LEU  40           H        LEU  40   9.529 -12.428  -0.219
  276    HA   LEU  40           HA       LEU  40   8.414 -14.712  -1.751
  277   1HB   LEU  40          HB2       LEU  40   7.927 -11.691  -1.747
  278   2HB   LEU  40          HB3       LEU  40   7.280 -12.780  -2.945
  279    HG   LEU  40           HG       LEU  40   6.625 -12.887   0.024
  280   1HD1  LEU  40          HD11      LEU  40   5.701 -10.905  -1.108
  281   2HD1  LEU  40          HD12      LEU  40   4.965 -11.941  -2.351
  282   3HD1  LEU  40          HD13      LEU  40   4.420 -12.041  -0.661
  283   1HD2  LEU  40          HD21      LEU  40   6.414 -15.131  -0.927
  284   2HD2  LEU  40          HD22      LEU  40   4.809 -14.453  -0.668
  285   3HD2  LEU  40          HD23      LEU  40   5.490 -14.495  -2.309
  286    H    LEU  41           H        LEU  41  11.297 -13.537  -1.349
  287    HA   LEU  41           HA       LEU  41  13.143 -13.072  -2.438
  288   1HB   LEU  41          HB2       LEU  41  12.275 -14.979  -3.971
  289   2HB   LEU  41          HB3       LEU  41  11.868 -13.693  -5.099
  290    HG   LEU  41           HG       LEU  41  14.379 -12.960  -4.847
  291   1HD1  LEU  41          HD11      LEU  41  14.577 -15.865  -3.919
  292   2HD1  LEU  41          HD12      LEU  41  15.923 -14.757  -4.276
  293   3HD1  LEU  41          HD13      LEU  41  14.871 -14.456  -2.888
  294   1HD2  LEU  41          HD21      LEU  41  13.445 -13.918  -6.891
  295   2HD2  LEU  41          HD22      LEU  41  15.065 -14.567  -6.585
  296   3HD2  LEU  41          HD23      LEU  41  13.629 -15.561  -6.240
  297    H    GLU  42           H        GLU  42  10.223 -11.527  -3.558
  298    HA   GLU  42           HA       GLU  42  11.393  -8.888  -3.934
  299   1HB   GLU  42          HB2       GLU  42  10.749  -8.822  -6.370
  300   2HB   GLU  42          HB3       GLU  42  12.196  -9.724  -5.985
  301   1HG   GLU  42          HG2       GLU  42  10.980 -11.862  -6.244
  302   2HG   GLU  42          HG3       GLU  42   9.504 -10.994  -6.639
  303    H    ASP  43           H        ASP  43   9.836  -8.434  -2.306
  304    HA   ASP  43           HA       ASP  43   7.038  -9.044  -2.620
  305   1HB   ASP  43          HB2       ASP  43   7.949  -8.416  -0.454
  306   2HB   ASP  43          HB3       ASP  43   8.429  -6.830  -1.096
  307    H    LEU  44           H        LEU  44   9.101  -6.226  -3.570
  308    HA   LEU  44           HA       LEU  44   6.790  -5.177  -5.138
  309   1HB   LEU  44          HB2       LEU  44   9.554  -3.983  -4.851
  310   2HB   LEU  44          HB3       LEU  44   8.250  -3.280  -5.727
  311    HG   LEU  44           HG       LEU  44   8.291  -3.685  -2.716
  312   1HD1  LEU  44          HD11      LEU  44   8.245  -1.139  -4.400
  313   2HD1  LEU  44          HD12      LEU  44   8.372  -1.256  -2.633
  314   3HD1  LEU  44          HD13      LEU  44   9.701  -1.827  -3.666
  315   1HD2  LEU  44          HD21      LEU  44   5.980  -3.949  -3.448
  316   2HD2  LEU  44          HD22      LEU  44   6.171  -2.355  -2.721
  317   3HD2  LEU  44          HD23      LEU  44   6.102  -2.510  -4.489
  318    HA   PRO  45           HA       PRO  45   8.126  -7.376  -8.646
  319   1HB   PRO  45          HB2       PRO  45   7.371  -5.693 -10.752
  320   2HB   PRO  45          HB3       PRO  45   6.297  -6.713  -9.789
  321   1HG   PRO  45          HG2       PRO  45   6.927  -3.763  -9.503
  322   2HG   PRO  45          HG3       PRO  45   5.335  -4.561  -9.360
  323   1HD   PRO  45          HD2       PRO  45   6.879  -3.820  -7.183
  324   2HD   PRO  45          HD3       PRO  45   5.769  -5.230  -7.162
  325    H    ALA  46           H        ALA  46   9.125  -7.033 -10.863
  326    HA   ALA  46           HA       ALA  46  11.860  -6.114 -10.619
  327   1HB   ALA  46          HB1       ALA  46  11.251  -8.174 -11.861
  328   2HB   ALA  46          HB2       ALA  46  10.260  -7.214 -12.989
  329   3HB   ALA  46          HB3       ALA  46  12.016  -7.009 -12.953
  330    H    SER  47           H        SER  47   9.981  -3.970 -10.310
  331    HA   SER  47           HA       SER  47  10.959  -1.999 -12.117
  332   1HB   SER  47          HB2       SER  47   8.591  -1.328 -12.908
  333   2HB   SER  47          HB3       SER  47   9.408  -2.652 -13.740
  334    HG   SER  47           HG       SER  47   7.410  -2.894 -11.740
  335    H    GLY  48           H        GLY  48  11.428  -0.564 -10.488
  336   1HA   GLY  48          HA2       GLY  48   9.837   0.851  -8.805
  337   2HA   GLY  48          HA3       GLY  48   9.958  -0.717  -7.981
  338    H    ILE  49           H        ILE  49  11.235   0.094  -6.261
  339    HA   ILE  49           HA       ILE  49  14.080   0.645  -6.922
  340    HB   ILE  49           HB       ILE  49  12.410   1.714  -4.625
  341   1HG1  ILE  49          HG12      ILE  49  11.559   2.837  -6.605
  342   2HG1  ILE  49          HG13      ILE  49  12.393   3.940  -5.540
  343   1HG2  ILE  49          HG21      ILE  49  15.167   2.651  -5.491
  344   2HG2  ILE  49          HG22      ILE  49  14.246   3.216  -4.103
  345   3HG2  ILE  49          HG23      ILE  49  14.845   1.556  -4.128
  346   1HD1  ILE  49          HD11      ILE  49  13.681   2.789  -8.049
  347   2HD1  ILE  49          HD12      ILE  49  12.817   4.334  -7.972
  348   3HD1  ILE  49          HD13      ILE  49  14.289   4.111  -7.024
  349    H    TRP  50           H        TRP  50  15.421  -0.926  -5.870
  350    HA   TRP  50           HA       TRP  50  14.162  -2.619  -3.751
  351   1HB   TRP  50          HB2       TRP  50  16.078  -3.230  -6.037
  352   2HB   TRP  50          HB3       TRP  50  15.990  -4.235  -4.622
  353    HD1  TRP  50           HD1      TRP  50  12.643  -3.068  -6.088
  354    HE1  TRP  50           HE1      TRP  50  11.502  -4.985  -7.322
  355    HE3  TRP  50           HE3      TRP  50  16.444  -6.486  -5.880
  356    HZ2  TRP  50           HZ2      TRP  50  12.153  -7.689  -8.103
  357    HZ3  TRP  50           HZ3      TRP  50  16.155  -8.729  -6.894
  358    HH2  TRP  50           HH2      TRP  50  14.018  -9.341  -8.006
  359    H    LEU  51           H        LEU  51  15.566  -3.128  -1.994
  360    HA   LEU  51           HA       LEU  51  18.343  -2.138  -2.053
  361   1HB   LEU  51          HB2       LEU  51  16.303  -1.512   0.124
  362   2HB   LEU  51          HB3       LEU  51  18.045  -1.355   0.334
  363    HG   LEU  51           HG       LEU  51  16.340   0.270  -1.614
  364   1HD1  LEU  51          HD11      LEU  51  17.724   1.075   0.978
  365   2HD1  LEU  51          HD12      LEU  51  16.771   2.114  -0.104
  366   3HD1  LEU  51          HD13      LEU  51  15.986   0.796   0.782
  367   1HD2  LEU  51          HD21      LEU  51  18.663   0.017  -2.475
  368   2HD2  LEU  51          HD22      LEU  51  18.360   1.668  -1.909
  369   3HD2  LEU  51          HD23      LEU  51  19.309   0.545  -0.919
  370    H    VAL  52           H        VAL  52  19.665  -3.594  -0.987
  371    HA   VAL  52           HA       VAL  52  18.352  -5.950   0.289
  372    HB   VAL  52           HB       VAL  52  20.846  -5.940  -1.464
  373   1HG1  VAL  52          HG11      VAL  52  19.103  -8.215  -0.402
  374   2HG1  VAL  52          HG12      VAL  52  20.491  -8.397  -1.499
  375   3HG1  VAL  52          HG13      VAL  52  20.746  -7.810   0.145
  376   1HG2  VAL  52          HG21      VAL  52  17.997  -6.712  -2.237
  377   2HG2  VAL  52          HG22      VAL  52  18.968  -5.394  -2.935
  378   3HG2  VAL  52          HG23      VAL  52  19.449  -7.069  -3.197
  379    H    ILE  53           H        ILE  53  19.248  -6.624   2.204
  380    HA   ILE  53           HA       ILE  53  21.528  -5.044   3.287
  381    HB   ILE  53           HB       ILE  53  19.088  -5.953   4.872
  382   1HG1  ILE  53          HG12      ILE  53  18.701  -3.345   5.005
  383   2HG1  ILE  53          HG13      ILE  53  19.521  -3.306   3.450
  384   1HG2  ILE  53          HG21      ILE  53  21.314  -3.959   5.494
  385   2HG2  ILE  53          HG22      ILE  53  19.979  -4.426   6.572
  386   3HG2  ILE  53          HG23      ILE  53  21.203  -5.615   6.130
  387   1HD1  ILE  53          HD11      ILE  53  17.017  -4.936   4.125
  388   2HD1  ILE  53          HD12      ILE  53  17.033  -3.368   3.304
  389   3HD1  ILE  53          HD13      ILE  53  17.733  -4.767   2.506
  390    H    SER  54           H        SER  54  23.155  -6.373   3.927
  391    HA   SER  54           HA       SER  54  22.785  -8.896   5.245
  392   1HB   SER  54          HB2       SER  54  23.712  -8.856   2.337
  393   2HB   SER  54          HB3       SER  54  24.133 -10.169   3.445
  394    HG   SER  54           HG       SER  54  21.476  -9.306   2.987
  395    H    SER  55           H        SER  55  25.344  -9.892   5.185
  396    HA   SER  55           HA       SER  55  27.331  -7.728   5.160
  397   1HB   SER  55          HB2       SER  55  26.694  -9.280   7.704
  398   2HB   SER  55          HB3       SER  55  28.058  -8.168   7.476
  399    HG   SER  55           HG       SER  55  25.759  -6.991   6.725
  400    H    THR  56           H        THR  56  27.741  -9.152   3.269
  401    HA   THR  56           HA       THR  56  28.027 -11.867   3.259
  402    HB   THR  56           HB       THR  56  29.451 -11.325   1.172
  403    HG1  THR  56           HG1      THR  56  29.817  -9.276   0.729
  404   1HG2  THR  56          HG21      THR  56  26.750  -9.921   1.509
  405   2HG2  THR  56          HG22      THR  56  27.525 -10.333  -0.029
  406   3HG2  THR  56          HG23      THR  56  26.990 -11.623   1.058
  407    H    HIS  57           H        HIS  57  30.499  -9.620   4.403
  408    HA   HIS  57           HA       HIS  57  32.319 -11.951   4.813
  409   1HB   HIS  57          HB2       HIS  57  33.087  -9.113   4.053
  410   2HB   HIS  57          HB3       HIS  57  34.197 -10.454   4.318
  411    HD1  HIS  57           HD1      HIS  57  33.187  -8.719   1.478
  412    HD2  HIS  57           HD2      HIS  57  32.933 -12.767   2.592
  413    HE1  HIS  57           HE1      HIS  57  32.795 -10.047  -0.664
  414    H    GLY  58           H        GLY  58  30.288 -10.697   6.618
  415   1HA   GLY  58          HA2       GLY  58  32.125 -10.372   8.959
  416   2HA   GLY  58          HA3       GLY  58  30.778  -9.254   8.703
  417    H    ALA  59           H        ALA  59  28.916 -11.268   7.658
  418    HA   ALA  59           HA       ALA  59  28.636 -13.281   9.808
  419   1HB   ALA  59          HB1       ALA  59  26.417 -11.410   8.847
  420   2HB   ALA  59          HB2       ALA  59  26.247 -12.730  10.024
  421   3HB   ALA  59          HB3       ALA  59  27.232 -11.314  10.427
  422    H    GLY  60           H        GLY  60  29.739 -13.523   7.188
  423   1HA   GLY  60          HA2       GLY  60  27.743 -14.269   5.246
  424   2HA   GLY  60          HA3       GLY  60  29.492 -14.416   5.087
  425    H    ASP  61           H        ASP  61  28.549 -16.455   3.965
  426    HA   ASP  61           HA       ASP  61  29.228 -18.637   5.739
  427   1HB   ASP  61          HB2       ASP  61  26.719 -18.607   5.869
  428   2HB   ASP  61          HB3       ASP  61  26.659 -18.784   4.111
  429    H    ILE  62           H        ILE  62  29.940 -20.463   4.463
  430    HA   ILE  62           HA       ILE  62  31.725 -19.556   2.581
  431    HB   ILE  62           HB       ILE  62  32.438 -21.831   2.282
  432   1HG1  ILE  62          HG12      ILE  62  29.857 -22.636   3.691
  433   2HG1  ILE  62          HG13      ILE  62  30.335 -23.009   2.027
  434   1HG2  ILE  62          HG21      ILE  62  31.638 -21.413   5.194
  435   2HG2  ILE  62          HG22      ILE  62  33.072 -22.240   4.556
  436   3HG2  ILE  62          HG23      ILE  62  32.922 -20.493   4.380
  437   1HD1  ILE  62          HD11      ILE  62  31.606 -24.091   4.559
  438   2HD1  ILE  62          HD12      ILE  62  30.635 -24.965   3.365
  439   3HD1  ILE  62          HD13      ILE  62  32.243 -24.354   2.913
  440    HA   PRO  63           HA       PRO  63  29.507 -21.303  -1.184
  441   1HB   PRO  63          HB2       PRO  63  26.791 -21.207  -1.453
  442   2HB   PRO  63          HB3       PRO  63  27.656 -22.600  -0.732
  443   1HG   PRO  63          HG2       PRO  63  26.299 -20.302   0.708
  444   2HG   PRO  63          HG3       PRO  63  26.157 -22.058   1.038
  445   1HD   PRO  63          HD2       PRO  63  27.826 -20.445   2.433
  446   2HD   PRO  63          HD3       PRO  63  28.264 -22.134   2.059
  447    H    ASP  64           H        ASP  64  28.176 -18.573   0.616
  448    HA   ASP  64           HA       ASP  64  28.922 -16.554  -1.162
  449   1HB   ASP  64          HB2       ASP  64  27.131 -17.254  -2.697
  450   2HB   ASP  64          HB3       ASP  64  25.963 -17.311  -1.381
  451    H    ASN  65           H        ASN  65  26.096 -17.434   0.758
  452    HA   ASN  65           HA       ASN  65  26.151 -16.791   3.222
  453   1HB   ASN  65          HB2       ASN  65  27.318 -14.659   3.088
  454   2HB   ASN  65          HB3       ASN  65  26.123 -14.057   1.940
  455   1HD2  ASN  65          HD22      ASN  65  25.137 -12.385   3.149
  456   2HD2  ASN  65          HD21      ASN  65  24.429 -12.646   4.730
  457    H    LEU  66           H        LEU  66  24.669 -15.156   0.406
  458    HA   LEU  66           HA       LEU  66  21.931 -15.213   1.352
  459   1HB   LEU  66          HB2       LEU  66  23.303 -14.525  -1.255
  460   2HB   LEU  66          HB3       LEU  66  21.581 -14.675  -1.183
  461    HG   LEU  66           HG       LEU  66  22.419 -12.343  -1.015
  462   1HD1  LEU  66          HD11      LEU  66  20.972 -11.671   0.956
  463   2HD1  LEU  66          HD12      LEU  66  20.211 -12.602  -0.325
  464   3HD1  LEU  66          HD13      LEU  66  20.667 -13.409   1.184
  465   1HD2  LEU  66          HD21      LEU  66  24.403 -12.769   0.425
  466   2HD2  LEU  66          HD22      LEU  66  23.371 -11.442   0.984
  467   3HD2  LEU  66          HD23      LEU  66  23.289 -13.016   1.802
  468    H    SER  67           H        SER  67  21.454 -17.374   1.927
  469    HA   SER  67           HA       SER  67  22.507 -19.562   0.411
  470   1HB   SER  67          HB2       SER  67  20.449 -20.423   2.204
  471   2HB   SER  67          HB3       SER  67  22.195 -20.573   2.361
  472    HG   SER  67           HG       SER  67  22.266 -18.581   3.391
  473    HA   PRO  68           HA       PRO  68  18.119 -20.082  -1.318
  474   1HB   PRO  68          HB2       PRO  68  16.093 -18.351  -0.703
  475   2HB   PRO  68          HB3       PRO  68  16.558 -19.699   0.374
  476   1HG   PRO  68          HG2       PRO  68  17.302 -16.782   0.642
  477   2HG   PRO  68          HG3       PRO  68  16.830 -17.921   1.931
  478   1HD   PRO  68          HD2       PRO  68  19.381 -17.299   1.423
  479   2HD   PRO  68          HD3       PRO  68  18.852 -18.861   2.104
  480    H    PHE  69           H        PHE  69  18.901 -16.651  -0.803
  481    HA   PHE  69           HA       PHE  69  17.701 -15.708  -3.170
  482   1HB   PHE  69          HB2       PHE  69  19.400 -14.632  -1.020
  483   2HB   PHE  69          HB3       PHE  69  19.657 -13.825  -2.561
  484    HD1  PHE  69           HD1      PHE  69  17.980 -12.398  -3.548
  485    HD2  PHE  69           HD2      PHE  69  17.146 -14.600   0.069
  486    HE1  PHE  69           HE1      PHE  69  15.916 -11.066  -3.203
  487    HE2  PHE  69           HE2      PHE  69  15.064 -13.301   0.382
  488    HZ   PHE  69           HZ       PHE  69  14.452 -11.520  -1.255
  489    H    TYR  70           H        TYR  70  21.237 -16.410  -2.595
  490    HA   TYR  70           HA       TYR  70  22.002 -15.438  -5.146
  491   1HB   TYR  70          HB2       TYR  70  23.589 -15.772  -3.312
  492   2HB   TYR  70          HB3       TYR  70  23.334 -17.512  -3.415
  493    HD1  TYR  70           HD1      TYR  70  24.878 -18.784  -4.631
  494    HD2  TYR  70           HD2      TYR  70  24.315 -14.625  -5.641
  495    HE1  TYR  70           HE1      TYR  70  26.670 -18.959  -6.324
  496    HE2  TYR  70           HE2      TYR  70  26.108 -14.793  -7.342
  497    HH   TYR  70           HH       TYR  70  27.879 -17.859  -7.975
  498    H    GLU  71           H        GLU  71  21.172 -18.788  -4.059
  499    HA   GLU  71           HA       GLU  71  21.585 -19.963  -6.619
  500   1HB   GLU  71          HB2       GLU  71  19.736 -20.867  -4.367
  501   2HB   GLU  71          HB3       GLU  71  20.261 -21.835  -5.756
  502   1HG   GLU  71          HG2       GLU  71  22.667 -21.255  -4.948
  503   2HG   GLU  71          HG3       GLU  71  21.923 -20.808  -3.430
  504    H    ALA  72           H        ALA  72  18.559 -18.677  -5.061
  505    HA   ALA  72           HA       ALA  72  16.851 -19.258  -7.228
  506   1HB   ALA  72          HB1       ALA  72  16.714 -16.932  -5.263
  507   2HB   ALA  72          HB2       ALA  72  15.387 -17.491  -6.300
  508   3HB   ALA  72          HB3       ALA  72  16.016 -18.553  -5.022
  509    H    LEU  73           H        LEU  73  19.056 -16.414  -6.828
  510    HA   LEU  73           HA       LEU  73  18.036 -14.925  -9.018
  511   1HB   LEU  73          HB2       LEU  73  20.793 -15.177  -7.745
  512   2HB   LEU  73          HB3       LEU  73  20.520 -14.183  -9.140
  513    HG   LEU  73           HG       LEU  73  19.212 -13.837  -6.411
  514   1HD1  LEU  73          HD11      LEU  73  20.586 -11.831  -6.249
  515   2HD1  LEU  73          HD12      LEU  73  21.614 -13.241  -6.530
  516   3HD1  LEU  73          HD13      LEU  73  21.265 -12.123  -7.866
  517   1HD2  LEU  73          HD21      LEU  73  18.342 -11.684  -7.287
  518   2HD2  LEU  73          HD22      LEU  73  18.892 -12.135  -8.920
  519   3HD2  LEU  73          HD23      LEU  73  17.615 -13.059  -8.093
  520    H    GLN  74           H        GLN  74  20.841 -17.184  -8.963
  521    HA   GLN  74           HA       GLN  74  21.021 -17.055 -11.804
  522   1HB   GLN  74          HB2       GLN  74  22.411 -19.420 -10.865
  523   2HB   GLN  74          HB3       GLN  74  22.965 -17.976 -11.656
  524   1HG   GLN  74          HG2       GLN  74  22.979 -16.862  -9.337
  525   2HG   GLN  74          HG3       GLN  74  22.647 -18.492  -8.689
  526   1HE2  GLN  74          HE22      GLN  74  24.838 -16.718 -10.893
  527   2HE2  GLN  74          HE21      GLN  74  26.265 -17.685 -10.537
  528    H    GLU  75           H        GLU  75  18.912 -18.947  -9.876
  529    HA   GLU  75           HA       GLU  75  18.608 -21.137 -11.669
  530   1HB   GLU  75          HB2       GLU  75  17.955 -21.148  -9.283
  531   2HB   GLU  75          HB3       GLU  75  16.658 -20.006  -9.650
  532   1HG   GLU  75          HG2       GLU  75  15.547 -21.672 -11.069
  533   2HG   GLU  75          HG3       GLU  75  16.906 -22.783 -10.873
  534    H    GLN  76           H        GLN  76  17.171 -17.920 -11.524
  535    HA   GLN  76           HA       GLN  76  15.499 -18.569 -13.925
  536   1HB   GLN  76          HB2       GLN  76  13.968 -16.723 -13.002
  537   2HB   GLN  76          HB3       GLN  76  13.906 -18.325 -12.275
  538   1HG   GLN  76          HG2       GLN  76  14.913 -17.668 -10.311
  539   2HG   GLN  76          HG3       GLN  76  15.740 -16.285 -11.040
  540   1HE2  GLN  76          HE22      GLN  76  15.049 -14.973  -9.258
  541   2HE2  GLN  76          HE21      GLN  76  13.424 -14.339  -9.217
  542    H    LYS  77           H        LYS  77  17.717 -16.203 -12.555
  543    HA   LYS  77           HA       LYS  77  18.143 -14.028 -13.125
  544   1HB   LYS  77          HB2       LYS  77  18.967 -15.555 -15.590
  545   2HB   LYS  77          HB3       LYS  77  19.507 -13.918 -15.174
  546   1HG   LYS  77          HG2       LYS  77  20.370 -14.817 -13.015
  547   2HG   LYS  77          HG3       LYS  77  19.964 -16.452 -13.557
  548   1HD   LYS  77          HD2       LYS  77  21.878 -14.611 -15.036
  549   2HD   LYS  77          HD3       LYS  77  22.388 -15.784 -13.805
  550   1HE   LYS  77          HE2       LYS  77  21.385 -17.594 -15.165
  551   2HE   LYS  77          HE3       LYS  77  20.898 -16.428 -16.398
  552   1HZ   LYS  77          HZ1       LYS  77  23.249 -15.938 -16.767
  553   2HZ   LYS  77          HZ2       LYS  77  23.701 -17.020 -15.624
  554   3HZ   LYS  77          HZ3       LYS  77  22.965 -17.524 -16.987
  555    HA   PRO  78           HA       PRO  78  14.300 -13.018 -15.559
  556   1HB   PRO  78          HB2       PRO  78  13.376 -11.124 -13.688
  557   2HB   PRO  78          HB3       PRO  78  12.826 -12.800 -13.856
  558   1HG   PRO  78          HG2       PRO  78  14.687 -11.623 -11.846
  559   2HG   PRO  78          HG3       PRO  78  13.612 -13.031 -11.689
  560   1HD   PRO  78          HD2       PRO  78  16.383 -13.132 -12.090
  561   2HD   PRO  78          HD3       PRO  78  15.250 -14.463 -12.446
  562    H    ASP  79           H        ASP  79  13.618 -10.674 -16.131
  563    HA   ASP  79           HA       ASP  79  16.019  -9.008 -16.685
  564   1HB   ASP  79          HB2       ASP  79  14.581  -9.248 -18.576
  565   2HB   ASP  79          HB3       ASP  79  13.129  -8.961 -17.609
  566    H    LEU  80           H        LEU  80  16.534  -7.466 -15.257
  567    HA   LEU  80           HA       LEU  80  14.425  -6.216 -13.530
  568   1HB   LEU  80          HB2       LEU  80  17.349  -6.784 -13.011
  569   2HB   LEU  80          HB3       LEU  80  16.371  -5.791 -11.976
  570    HG   LEU  80           HG       LEU  80  16.777  -7.881 -10.969
  571   1HD1  LEU  80          HD11      LEU  80  14.699  -6.819 -10.317
  572   2HD1  LEU  80          HD12      LEU  80  13.851  -7.546 -11.709
  573   3HD1  LEU  80          HD13      LEU  80  14.453  -8.568 -10.400
  574   1HD2  LEU  80          HD21      LEU  80  16.798  -9.152 -13.200
  575   2HD2  LEU  80          HD22      LEU  80  16.226  -9.970 -11.736
  576   3HD2  LEU  80          HD23      LEU  80  15.060  -9.360 -12.936
  577    H    SER  81           H        SER  81  15.718  -5.416 -16.321
  578    HA   SER  81           HA       SER  81  17.417  -3.182 -15.738
  579   1HB   SER  81          HB2       SER  81  17.268  -2.754 -18.168
  580   2HB   SER  81          HB3       SER  81  17.705  -4.423 -17.783
  581    HG   SER  81           HG       SER  81  15.648  -5.096 -18.245
  582    H    ALA  82           H        ALA  82  14.215  -3.492 -15.173
  583    HA   ALA  82           HA       ALA  82  13.519  -0.656 -15.787
  584   1HB   ALA  82          HB1       ALA  82  11.180  -1.351 -15.471
  585   2HB   ALA  82          HB2       ALA  82  11.960  -2.303 -16.746
  586   3HB   ALA  82          HB3       ALA  82  11.702  -3.014 -15.138
  587    H    VAL  83           H        VAL  83  14.955  -2.410 -13.389
  588    HA   VAL  83           HA       VAL  83  13.893  -0.558 -11.338
  589    HB   VAL  83           HB       VAL  83  12.775  -2.522 -10.810
  590   1HG1  VAL  83          HG11      VAL  83  13.783  -4.733 -10.455
  591   2HG1  VAL  83          HG12      VAL  83  13.942  -4.206 -12.130
  592   3HG1  VAL  83          HG13      VAL  83  15.340  -4.101 -11.031
  593   1HG2  VAL  83          HG21      VAL  83  13.463  -3.192  -8.671
  594   2HG2  VAL  83          HG22      VAL  83  15.162  -2.790  -8.962
  595   3HG2  VAL  83          HG23      VAL  83  13.951  -1.509  -8.802
  596    H    ARG  84           H        ARG  84  15.341  -0.148  -9.556
  597    HA   ARG  84           HA       ARG  84  18.223  -0.534 -10.235
  598   1HB   ARG  84          HB2       ARG  84  18.727   1.501  -9.040
  599   2HB   ARG  84          HB3       ARG  84  17.722   1.844 -10.435
  600   1HG   ARG  84          HG2       ARG  84  15.976   2.633  -9.217
  601   2HG   ARG  84          HG3       ARG  84  16.160   1.493  -7.917
  602   1HD   ARG  84          HD2       ARG  84  17.726   4.040  -8.342
  603   2HD   ARG  84          HD3       ARG  84  16.576   3.709  -7.058
  604    HE   ARG  84           HE       ARG  84  19.354   3.190  -7.115
  605   1HH1  ARG  84          HH21      ARG  84  16.596   1.234  -6.140
  606   2HH1  ARG  84          HH22      ARG  84  17.329   0.573  -4.724
  607   1HH2  ARG  84          HH11      ARG  84  20.345   2.406  -5.104
  608   2HH2  ARG  84          HH12      ARG  84  19.447   1.360  -4.091
  609    H    PHE  85           H        PHE  85  19.540  -1.071  -8.418
  610    HA   PHE  85           HA       PHE  85  18.036  -1.697  -5.934
  611   1HB   PHE  85          HB2       PHE  85  18.771  -3.802  -5.676
  612   2HB   PHE  85          HB3       PHE  85  18.491  -3.784  -7.402
  613    HD1  PHE  85           HD1      PHE  85  20.866  -4.459  -4.776
  614    HD2  PHE  85           HD2      PHE  85  20.604  -3.262  -8.911
  615    HE1  PHE  85           HE1      PHE  85  23.202  -5.196  -5.145
  616    HE2  PHE  85           HE2      PHE  85  22.891  -4.058  -9.292
  617    HZ   PHE  85           HZ       PHE  85  24.223  -5.026  -7.405
  618    H    GLY  86           H        GLY  86  19.465  -1.919  -4.090
  619   1HA   GLY  86          HA2       GLY  86  22.204  -0.810  -4.385
  620   2HA   GLY  86          HA3       GLY  86  21.136  -0.093  -3.162
  621    H    ALA  87           H        ALA  87  23.597  -1.551  -2.655
  622    HA   ALA  87           HA       ALA  87  22.584  -3.923  -1.145
  623   1HB   ALA  87          HB1       ALA  87  24.102  -4.686  -2.894
  624   2HB   ALA  87          HB2       ALA  87  25.271  -3.405  -2.493
  625   3HB   ALA  87          HB3       ALA  87  24.976  -4.712  -1.347
  626    H    ILE  88           H        ILE  88  22.981  -3.805   1.027
  627    HA   ILE  88           HA       ILE  88  24.526  -1.478   2.058
  628    HB   ILE  88           HB       ILE  88  21.795  -2.467   3.003
  629   1HG1  ILE  88          HG12      ILE  88  22.416  -0.051   1.251
  630   2HG1  ILE  88          HG13      ILE  88  21.500  -1.478   0.793
  631   1HG2  ILE  88          HG21      ILE  88  21.933  -0.210   4.266
  632   2HG2  ILE  88          HG22      ILE  88  22.961  -1.518   4.817
  633   3HG2  ILE  88          HG23      ILE  88  23.643  -0.204   3.842
  634   1HD1  ILE  88          HD11      ILE  88  20.616   0.628   2.779
  635   2HD1  ILE  88          HD12      ILE  88  19.954   0.266   1.195
  636   3HD1  ILE  88          HD13      ILE  88  19.772  -0.923   2.495
  637    H    GLY  89           H        GLY  89  25.829  -2.021   3.775
  638   1HA   GLY  89          HA2       GLY  89  26.641  -3.115   5.646
  639   2HA   GLY  89          HA3       GLY  89  25.304  -4.271   5.560
  640    H    ILE  90           H        ILE  90  25.827  -4.889   2.730
  641    HA   ILE  90           HA       ILE  90  27.425  -7.115   2.759
  642    HB   ILE  90           HB       ILE  90  26.561  -5.208   0.565
  643   1HG1  ILE  90          HG12      ILE  90  25.568  -7.767   1.797
  644   2HG1  ILE  90          HG13      ILE  90  24.710  -6.269   1.506
  645   1HG2  ILE  90          HG21      ILE  90  27.151  -6.799  -1.153
  646   2HG2  ILE  90          HG22      ILE  90  28.586  -6.284  -0.298
  647   3HG2  ILE  90          HG23      ILE  90  27.880  -7.888   0.041
  648   1HD1  ILE  90          HD11      ILE  90  25.401  -8.413  -0.539
  649   2HD1  ILE  90          HD12      ILE  90  23.804  -7.979   0.086
  650   3HD1  ILE  90          HD13      ILE  90  24.671  -6.847  -0.958
  651    H    GLY  91           H        GLY  91  29.528  -7.622   2.619
  652   1HA   GLY  91          HA2       GLY  91  31.467  -5.425   3.060
  653   2HA   GLY  91          HA3       GLY  91  31.653  -7.127   3.496
  654    H    SER  92           H        SER  92  30.327  -6.979   0.407
  655    HA   SER  92           HA       SER  92  32.754  -7.846  -0.892
  656   1HB   SER  92          HB2       SER  92  29.938  -7.342  -1.853
  657   2HB   SER  92          HB3       SER  92  31.182  -8.266  -2.722
  658    HG   SER  92           HG       SER  92  29.633  -9.508  -1.458
  659    H    ARG  93           H        ARG  93  31.966  -4.778  -0.135
  660    HA   ARG  93           HA       ARG  93  31.548  -3.325  -2.401
  661   1HB   ARG  93          HB2       ARG  93  31.379  -2.486  -0.086
  662   2HB   ARG  93          HB3       ARG  93  33.144  -2.483   0.047
  663   1HG   ARG  93          HG2       ARG  93  33.294  -0.810  -1.751
  664   2HG   ARG  93          HG3       ARG  93  31.546  -0.809  -1.955
  665   1HD   ARG  93          HD2       ARG  93  31.190   0.224   0.166
  666   2HD   ARG  93          HD3       ARG  93  32.821  -0.155   0.732
  667    HE   ARG  93           HE       ARG  93  32.015   2.053  -1.055
  668   1HH1  ARG  93          HH21      ARG  93  34.796   0.204   0.201
  669   2HH1  ARG  93          HH22      ARG  93  35.939   1.095  -0.751
  670   1HH2  ARG  93          HH11      ARG  93  33.453   3.373  -1.921
  671   2HH2  ARG  93          HH12      ARG  93  35.192   3.172  -1.742
  672    H    GLU  94           H        GLU  94  34.763  -4.203  -1.206
  673    HA   GLU  94           HA       GLU  94  35.873  -3.648  -3.894
  674   1HB   GLU  94          HB2       GLU  94  36.931  -2.318  -1.408
  675   2HB   GLU  94          HB3       GLU  94  37.874  -2.542  -2.885
  676   1HG   GLU  94          HG2       GLU  94  36.110  -1.268  -4.146
  677   2HG   GLU  94          HG3       GLU  94  35.367  -0.874  -2.594
  678    H    TYR  95           H        TYR  95  37.540  -4.221  -0.840
  679    HA   TYR  95           HA       TYR  95  38.380  -6.928  -1.770
  680   1HB   TYR  95          HB2       TYR  95  40.731  -6.266  -1.295
  681   2HB   TYR  95          HB3       TYR  95  40.003  -5.411  -2.630
  682    HD1  TYR  95           HD1      TYR  95  40.126  -3.061  -2.745
  683    HD2  TYR  95           HD2      TYR  95  40.785  -5.014   1.048
  684    HE1  TYR  95           HE1      TYR  95  40.729  -0.886  -1.732
  685    HE2  TYR  95           HE2      TYR  95  41.392  -2.852   2.065
  686    HH   TYR  95           HH       TYR  95  41.665  -0.561   1.727
  687    H    ASP  96           H        ASP  96  36.744  -5.642   0.637
  688    HA   ASP  96           HA       ASP  96  38.242  -6.670   2.940
  689   1HB   ASP  96          HB2       ASP  96  36.835  -4.636   3.091
  690   2HB   ASP  96          HB3       ASP  96  35.404  -5.599   2.723
  691    H    THR  97           H        THR  97  37.965  -8.622   0.970
  692    HA   THR  97           HA       THR  97  35.570 -10.160   1.141
  693    HB   THR  97           HB       THR  97  37.115 -11.780  -0.216
  694    HG1  THR  97           HG1      THR  97  39.125 -10.929   0.269
  695   1HG2  THR  97          HG21      THR  97  36.566  -8.949  -1.235
  696   2HG2  THR  97          HG22      THR  97  36.832 -10.402  -2.227
  697   3HG2  THR  97          HG23      THR  97  35.396 -10.284  -1.202
  698    H    PHE  98           H        PHE  98  35.483 -12.442   1.644
  699    HA   PHE  98           HA       PHE  98  37.308 -13.659   3.517
  700   1HB   PHE  98          HB2       PHE  98  35.929 -12.204   5.021
  701   2HB   PHE  98          HB3       PHE  98  34.466 -12.916   4.359
  702    HD1  PHE  98           HD1      PHE  98  37.688 -13.979   6.021
  703    HD2  PHE  98           HD2      PHE  98  33.443 -14.649   5.576
  704    HE1  PHE  98           HE1      PHE  98  37.787 -15.787   7.719
  705    HE2  PHE  98           HE2      PHE  98  33.553 -16.449   7.274
  706    HZ   PHE  98           HZ       PHE  98  35.723 -17.028   8.345
  707    H    CYS  99           H        CYS  99  35.852 -15.859   4.162
  708    HA   CYS  99           HA       CYS  99  35.131 -17.206   1.709
  709   1HB   CYS  99          HB2       CYS  99  34.656 -17.981   4.625
  710   2HB   CYS  99          HB3       CYS  99  34.529 -19.047   3.218
  711    HG   CYS  99           HG       CYS  99  36.724 -19.591   4.545
  712    H    GLY 100           H        GLY 100  33.576 -15.615   0.915
  713   1HA   GLY 100          HA2       GLY 100  30.799 -16.032   1.771
  714   2HA   GLY 100          HA3       GLY 100  31.480 -14.423   2.037
  715    H    ALA 101           H        ALA 101  30.071 -13.495   0.506
  716    HA   ALA 101           HA       ALA 101  29.450 -14.531  -1.981
  717   1HB   ALA 101          HB1       ALA 101  28.525 -12.300  -2.473
  718   2HB   ALA 101          HB2       ALA 101  28.132 -12.815  -0.824
  719   3HB   ALA 101          HB3       ALA 101  29.429 -11.620  -1.108
  720    H    ILE 102           H        ILE 102  32.231 -12.520  -1.170
  721    HA   ILE 102           HA       ILE 102  33.725 -11.397  -2.442
  722    HB   ILE 102           HB       ILE 102  35.143 -12.873  -3.747
  723   1HG1  ILE 102          HG12      ILE 102  33.076 -15.080  -3.300
  724   2HG1  ILE 102          HG13      ILE 102  33.382 -14.300  -4.848
  725   1HG2  ILE 102          HG21      ILE 102  34.151 -14.241  -1.208
  726   2HG2  ILE 102          HG22      ILE 102  35.795 -14.251  -1.871
  727   3HG2  ILE 102          HG23      ILE 102  35.120 -12.763  -1.215
  728   1HD1  ILE 102          HD11      ILE 102  35.342 -16.006  -3.271
  729   2HD1  ILE 102          HD12      ILE 102  34.548 -16.400  -4.799
  730   3HD1  ILE 102          HD13      ILE 102  35.756 -15.100  -4.749
  731    H    ASP 103           H        ASP 103  31.458 -10.432  -3.201
  732    HA   ASP 103           HA       ASP 103  30.663  -8.915  -4.657
  733   1HB   ASP 103          HB2       ASP 103  32.939  -8.552  -5.487
  734   2HB   ASP 103          HB3       ASP 103  32.722  -9.830  -6.680
  735    H    LYS 104           H        LYS 104  30.627 -12.290  -5.357
  736    HA   LYS 104           HA       LYS 104  29.326 -12.279  -7.843
  737   1HB   LYS 104          HB2       LYS 104  29.132 -14.338  -5.618
  738   2HB   LYS 104          HB3       LYS 104  28.609 -14.577  -7.283
  739   1HG   LYS 104          HG2       LYS 104  30.871 -14.252  -8.083
  740   2HG   LYS 104          HG3       LYS 104  31.470 -13.931  -6.450
  741   1HD   LYS 104          HD2       LYS 104  30.809 -16.210  -5.747
  742   2HD   LYS 104          HD3       LYS 104  30.205 -16.541  -7.387
  743   1HE   LYS 104          HE2       LYS 104  32.484 -16.125  -8.300
  744   2HE   LYS 104          HE3       LYS 104  33.084 -15.828  -6.664
  745   1HZ   LYS 104          HZ1       LYS 104  31.956 -18.394  -7.636
  746   2HZ   LYS 104          HZ2       LYS 104  33.533 -18.092  -7.376
  747   3HZ   LYS 104          HZ3       LYS 104  32.498 -18.133  -6.116
  748    H    LEU 105           H        LEU 105  27.814 -11.986  -4.590
  749    HA   LEU 105           HA       LEU 105  25.168 -12.412  -5.443
  750   1HB   LEU 105          HB2       LEU 105  25.904 -12.345  -3.092
  751   2HB   LEU 105          HB3       LEU 105  26.217 -10.625  -3.195
  752    HG   LEU 105           HG       LEU 105  24.145 -11.322  -2.003
  753   1HD1  LEU 105          HD11      LEU 105  24.411  -9.017  -2.992
  754   2HD1  LEU 105          HD12      LEU 105  23.405  -9.554  -4.358
  755   3HD1  LEU 105          HD13      LEU 105  22.745  -9.551  -2.721
  756   1HD2  LEU 105          HD21      LEU 105  23.036 -11.990  -4.774
  757   2HD2  LEU 105          HD22      LEU 105  23.437 -13.170  -3.502
  758   3HD2  LEU 105          HD23      LEU 105  22.134 -11.991  -3.258
  759    H    GLU 106           H        GLU 106  26.946  -9.298  -5.067
  760    HA   GLU 106           HA       GLU 106  24.859  -7.657  -6.130
  761   1HB   GLU 106          HB2       GLU 106  27.888  -7.215  -6.098
  762   2HB   GLU 106          HB3       GLU 106  26.678  -5.972  -6.416
  763   1HG   GLU 106          HG2       GLU 106  25.768  -6.210  -4.168
  764   2HG   GLU 106          HG3       GLU 106  26.890  -7.513  -3.793
  765    H    ALA 107           H        ALA 107  27.612  -9.381  -7.594
  766    HA   ALA 107           HA       ALA 107  27.477  -8.232 -10.167
  767   1HB   ALA 107          HB1       ALA 107  29.381  -9.614  -9.349
  768   2HB   ALA 107          HB2       ALA 107  28.352 -11.063  -9.459
  769   3HB   ALA 107          HB3       ALA 107  28.766 -10.156 -10.921
  770    H    GLU 108           H        GLU 108  25.821 -11.227  -8.877
  771    HA   GLU 108           HA       GLU 108  24.597 -11.836 -11.378
  772   1HB   GLU 108          HB2       GLU 108  24.041 -12.605  -8.516
  773   2HB   GLU 108          HB3       GLU 108  22.981 -13.100  -9.823
  774   1HG   GLU 108          HG2       GLU 108  25.935 -13.801  -9.594
  775   2HG   GLU 108          HG3       GLU 108  24.558 -14.864  -9.323
  776    H    LEU 109           H        LEU 109  23.578  -9.619  -8.754
  777    HA   LEU 109           HA       LEU 109  20.919  -9.233  -9.844
  778   1HB   LEU 109          HB2       LEU 109  22.683  -7.529  -8.036
  779   2HB   LEU 109          HB3       LEU 109  21.053  -7.053  -8.498
  780    HG   LEU 109           HG       LEU 109  21.692  -9.668  -7.065
  781   1HD1  LEU 109          HD11      LEU 109  22.282  -7.717  -5.660
  782   2HD1  LEU 109          HD12      LEU 109  20.642  -7.071  -5.883
  783   3HD1  LEU 109          HD13      LEU 109  20.892  -8.605  -5.020
  784   1HD2  LEU 109          HD21      LEU 109  19.540  -9.750  -8.254
  785   2HD2  LEU 109          HD22      LEU 109  19.254  -9.615  -6.519
  786   3HD2  LEU 109          HD23      LEU 109  19.065  -8.187  -7.555
  787    H    LYS 110           H        LYS 110  24.047  -7.525 -10.312
  788    HA   LYS 110           HA       LYS 110  23.039  -5.522 -12.072
  789   1HB   LYS 110          HB2       LYS 110  25.828  -6.719 -11.709
  790   2HB   LYS 110          HB3       LYS 110  25.485  -5.243 -12.625
  791   1HG   LYS 110          HG2       LYS 110  24.717  -4.081 -10.677
  792   2HG   LYS 110          HG3       LYS 110  24.593  -5.531  -9.737
  793   1HD   LYS 110          HD2       LYS 110  26.415  -4.650  -8.795
  794   2HD   LYS 110          HD3       LYS 110  27.166  -5.750  -9.948
  795   1HE   LYS 110          HE2       LYS 110  27.728  -3.924 -11.440
  796   2HE   LYS 110          HE3       LYS 110  26.654  -2.812 -10.579
  797   1HZ   LYS 110          HZ1       LYS 110  28.110  -2.987  -8.639
  798   2HZ   LYS 110          HZ2       LYS 110  29.143  -3.963  -9.463
  799   3HZ   LYS 110          HZ3       LYS 110  28.932  -2.419  -9.942
  800    H    ASN 111           H        ASN 111  24.294  -8.791 -12.585
  801    HA   ASN 111           HA       ASN 111  24.262  -8.796 -15.450
  802   1HB   ASN 111          HB2       ASN 111  25.518 -10.527 -14.750
  803   2HB   ASN 111          HB3       ASN 111  24.741 -10.650 -13.214
  804   1HD2  ASN 111          HD21      ASN 111  22.801 -11.872 -12.899
  805   2HD2  ASN 111          HD22      ASN 111  22.596 -13.283 -13.890
  806    H    SER 112           H        SER 112  21.785  -9.488 -12.964
  807    HA   SER 112           HA       SER 112  19.905 -10.564 -14.853
  808   1HB   SER 112          HB2       SER 112  19.351  -9.468 -12.097
  809   2HB   SER 112          HB3       SER 112  18.330 -10.550 -13.067
  810    HG   SER 112           HG       SER 112  20.858 -11.135 -11.936
  811    H    GLY 113           H        GLY 113  20.748  -7.291 -13.774
  812   1HA   GLY 113          HA2       GLY 113  20.347  -5.872 -15.856
  813   2HA   GLY 113          HA3       GLY 113  18.633  -6.169 -15.570
  814    H    ALA 114           H        ALA 114  19.326  -5.965 -12.460
  815    HA   ALA 114           HA       ALA 114  18.321  -3.293 -12.404
  816   1HB   ALA 114          HB1       ALA 114  19.428  -4.977 -10.115
  817   2HB   ALA 114          HB2       ALA 114  18.542  -3.431  -9.966
  818   3HB   ALA 114          HB3       ALA 114  17.719  -4.855 -10.596
  819    H    LYS 115           H        LYS 115  19.399  -1.328 -11.923
  820    HA   LYS 115           HA       LYS 115  22.319  -1.483 -12.390
  821   1HB   LYS 115          HB2       LYS 115  22.289   0.934 -12.530
  822   2HB   LYS 115          HB3       LYS 115  21.195   0.193 -13.692
  823   1HG   LYS 115          HG2       LYS 115  19.240   0.867 -12.381
  824   2HG   LYS 115          HG3       LYS 115  20.277   1.435 -11.067
  825   1HD   LYS 115          HD2       LYS 115  21.288   3.100 -12.725
  826   2HD   LYS 115          HD3       LYS 115  20.110   2.519 -13.906
  827   1HE   LYS 115          HE2       LYS 115  18.950   4.297 -13.132
  828   2HE   LYS 115          HE3       LYS 115  18.337   3.085 -12.025
  829   1HZ   LYS 115          HZ1       LYS 115  19.992   3.910 -10.369
  830   2HZ   LYS 115          HZ2       LYS 115  20.511   5.030 -11.441
  831   3HZ   LYS 115          HZ3       LYS 115  18.994   5.108 -10.862
  832    H    GLN 116           H        GLN 116  23.799  -1.230 -10.771
  833    HA   GLN 116           HA       GLN 116  22.818  -0.978  -8.010
  834   1HB   GLN 116          HB2       GLN 116  24.664  -2.531  -8.468
  835   2HB   GLN 116          HB3       GLN 116  25.653  -1.188  -9.053
  836   1HG   GLN 116          HG2       GLN 116  25.702  -0.152  -6.871
  837   2HG   GLN 116          HG3       GLN 116  24.369  -1.158  -6.303
  838   1HE2  GLN 116          HE22      GLN 116  25.381  -2.034  -4.539
  839   2HE2  GLN 116          HE21      GLN 116  26.713  -3.156  -4.621
  840    H    THR 117           H        THR 117  22.055   1.068  -7.674
  841    HA   THR 117           HA       THR 117  23.341   3.418  -8.925
  842    HB   THR 117           HB       THR 117  21.216   3.217  -6.769
  843    HG1  THR 117           HG1      THR 117  20.848   2.274  -8.959
  844   1HG2  THR 117          HG21      THR 117  22.189   5.456  -6.821
  845   2HG2  THR 117          HG22      THR 117  22.001   5.528  -8.588
  846   3HG2  THR 117          HG23      THR 117  20.567   5.495  -7.536
  847    H    GLY 118           H        GLY 118  24.528   5.017  -7.688
  848   1HA   GLY 118          HA2       GLY 118  25.901   5.809  -6.028
  849   2HA   GLY 118          HA3       GLY 118  25.006   4.805  -4.886
  850    H    GLU 119           H        GLU 119  26.202   3.353  -3.899
  851    HA   GLU 119           HA       GLU 119  27.790   1.409  -5.249
  852   1HB   GLU 119          HB2       GLU 119  29.929   1.781  -4.157
  853   2HB   GLU 119          HB3       GLU 119  29.507   3.219  -5.078
  854   1HG   GLU 119          HG2       GLU 119  28.680   4.294  -2.956
  855   2HG   GLU 119          HG3       GLU 119  29.270   2.861  -2.103
  856    H    THR 120           H        THR 120  28.715  -0.149  -3.382
  857    HA   THR 120           HA       THR 120  26.650  -0.962  -1.720
  858    HB   THR 120           HB       THR 120  29.562  -1.380  -1.071
  859    HG1  THR 120           HG1      THR 120  28.375  -3.034  -2.994
  860   1HG2  THR 120          HG21      THR 120  28.839  -3.685  -0.577
  861   2HG2  THR 120          HG22      THR 120  27.963  -2.492   0.399
  862   3HG2  THR 120          HG23      THR 120  27.167  -3.250  -0.996
  863    H    LEU 121           H        LEU 121  25.917  -0.329   0.199
  864    HA   LEU 121           HA       LEU 121  27.027   2.126   1.409
  865   1HB   LEU 121          HB2       LEU 121  24.633   1.659   0.452
  866   2HB   LEU 121          HB3       LEU 121  24.350   0.784   1.923
  867    HG   LEU 121           HG       LEU 121  25.453   3.516   2.349
  868   1HD1  LEU 121          HD11      LEU 121  24.021   3.954   0.371
  869   2HD1  LEU 121          HD12      LEU 121  22.650   3.178   1.186
  870   3HD1  LEU 121          HD13      LEU 121  23.343   4.680   1.837
  871   1HD2  LEU 121          HD21      LEU 121  23.772   3.638   4.082
  872   2HD2  LEU 121          HD22      LEU 121  22.915   2.220   3.437
  873   3HD2  LEU 121          HD23      LEU 121  24.517   2.040   4.168
  874    H    LYS 122           H        LYS 122  27.026   2.273   3.864
  875    HA   LYS 122           HA       LYS 122  27.505  -0.379   5.168
  876   1HB   LYS 122          HB2       LYS 122  29.090   2.199   5.539
  877   2HB   LYS 122          HB3       LYS 122  29.156   0.822   6.609
  878   1HG   LYS 122          HG2       LYS 122  31.084   0.747   5.282
  879   2HG   LYS 122          HG3       LYS 122  30.060  -0.604   4.832
  880   1HD   LYS 122          HD2       LYS 122  31.248   0.464   2.926
  881   2HD   LYS 122          HD3       LYS 122  29.518   0.386   2.721
  882   1HE   LYS 122          HE2       LYS 122  30.325   2.505   1.903
  883   2HE   LYS 122          HE3       LYS 122  29.309   2.793   3.312
  884   1HZ   LYS 122          HZ1       LYS 122  31.248   3.233   4.634
  885   2HZ   LYS 122          HZ2       LYS 122  32.271   2.738   3.436
  886   3HZ   LYS 122          HZ3       LYS 122  31.381   4.100   3.270
  887    H    ILE 123           H        ILE 123  26.725  -0.481   7.336
  888    HA   ILE 123           HA       ILE 123  25.209   1.823   8.411
  889    HB   ILE 123           HB       ILE 123  23.454   0.000   8.958
  890   1HG1  ILE 123          HG12      ILE 123  23.114  -1.731   7.267
  891   2HG1  ILE 123          HG13      ILE 123  24.614  -1.349   6.471
  892   1HG2  ILE 123          HG21      ILE 123  23.096   1.937   7.475
  893   2HG2  ILE 123          HG22      ILE 123  23.663   0.975   6.098
  894   3HG2  ILE 123          HG23      ILE 123  22.192   0.505   6.975
  895   1HD1  ILE 123          HD11      ILE 123  24.467  -2.370   9.340
  896   2HD1  ILE 123          HD12      ILE 123  24.606  -3.420   7.917
  897   3HD1  ILE 123          HD13      ILE 123  25.901  -2.280   8.284
  898    H    ASN 124           H        ASN 124  24.523   1.354  10.687
  899    HA   ASN 124           HA       ASN 124  25.869  -0.838  11.984
  900   1HB   ASN 124          HB2       ASN 124  27.204   1.716  12.024
  901   2HB   ASN 124          HB3       ASN 124  26.508   1.482  13.624
  902   1HD2  ASN 124          HD22      ASN 124  27.863  -0.904  11.264
  903   2HD2  ASN 124          HD21      ASN 124  28.986  -1.599  12.422
  904    H    ILE 125           H        ILE 125  24.861  -1.453  13.883
  905    HA   ILE 125           HA       ILE 125  22.199  -0.314  14.323
  906    HB   ILE 125           HB       ILE 125  21.840  -2.134  15.840
  907   1HG1  ILE 125          HG12      ILE 125  24.766  -2.919  15.525
  908   2HG1  ILE 125          HG13      ILE 125  24.027  -2.239  16.970
  909   1HG2  ILE 125          HG21      ILE 125  21.939  -3.951  14.278
  910   2HG2  ILE 125          HG22      ILE 125  21.697  -2.466  13.362
  911   3HG2  ILE 125          HG23      ILE 125  23.304  -3.222  13.408
  912   1HD1  ILE 125          HD11      ILE 125  24.236  -4.597  17.285
  913   2HD1  ILE 125          HD12      ILE 125  22.510  -4.220  17.110
  914   3HD1  ILE 125          HD13      ILE 125  23.414  -4.950  15.759
  915    H    LEU 126           H        LEU 126  21.774  -0.463  17.013
  916    HA   LEU 126           HA       LEU 126  22.742   2.005  17.992
  917   1HB   LEU 126          HB2       LEU 126  21.400   1.641  19.853
  918   2HB   LEU 126          HB3       LEU 126  20.545   0.893  18.522
  919    HG   LEU 126           HG       LEU 126  22.125  -0.538  20.720
  920   1HD1  LEU 126          HD11      LEU 126  19.140  -0.430  20.135
  921   2HD1  LEU 126          HD12      LEU 126  19.926  -1.327  21.454
  922   3HD1  LEU 126          HD13      LEU 126  19.979   0.441  21.438
  923   1HD2  LEU 126          HD21      LEU 126  22.303  -1.927  18.725
  924   2HD2  LEU 126          HD22      LEU 126  21.133  -2.643  19.822
  925   3HD2  LEU 126          HD23      LEU 126  20.554  -1.752  18.402
  926    H    ASP 127           H        ASP 127  24.688  -0.574  17.693
  927    HA   ASP 127           HA       ASP 127  26.544   0.244  19.744
  928   1HB   ASP 127          HB2       ASP 127  25.274  -1.495  20.973
  929   2HB   ASP 127          HB3       ASP 127  25.491  -2.618  19.626
  930    H    HIS 128           H        HIS 128  28.677  -0.793  19.168
  931    HA   HIS 128           HA       HIS 128  29.200  -0.453  16.420
  932   1HB   HIS 128          HB2       HIS 128  31.439  -1.092  16.895
  933   2HB   HIS 128          HB3       HIS 128  30.852  -0.089  18.210
  934    HD1  HIS 128           HD1      HIS 128  29.810  -1.987  20.378
  935    HD2  HIS 128           HD2      HIS 128  32.916  -3.010  17.704
  936    HE1  HIS 128           HE1      HIS 128  31.127  -3.854  21.482
  937    H    ASP 129           H        ASP 129  29.431  -1.836  14.695
  938    HA   ASP 129           HA       ASP 129  29.642  -4.686  15.044
  939   1HB   ASP 129          HB2       ASP 129  27.745  -5.402  13.879
  940   2HB   ASP 129          HB3       ASP 129  27.142  -4.264  15.072
  941    H    ILE 130           H        ILE 130  29.772  -5.714  12.804
  942    HA   ILE 130           HA       ILE 130  31.961  -5.721  11.759
  943    HB   ILE 130           HB       ILE 130  29.521  -5.579  10.004
  944   1HG1  ILE 130          HG12      ILE 130  29.183  -7.196  11.708
  945   2HG1  ILE 130          HG13      ILE 130  29.469  -8.006  10.191
  946   1HG2  ILE 130          HG21      ILE 130  32.227  -6.840   9.364
  947   2HG2  ILE 130          HG22      ILE 130  30.738  -7.021   8.405
  948   3HG2  ILE 130          HG23      ILE 130  31.501  -5.448   8.542
  949   1HD1  ILE 130          HD11      ILE 130  31.828  -8.508  10.927
  950   2HD1  ILE 130          HD12      ILE 130  31.458  -7.749  12.493
  951   3HD1  ILE 130          HD13      ILE 130  30.586  -9.197  11.984
  952    HA   PRO 131           HA       PRO 131  32.853  -2.354   8.710
  953   1HB   PRO 131          HB2       PRO 131  31.156  -0.400   7.884
  954   2HB   PRO 131          HB3       PRO 131  31.012  -2.080   7.274
  955   1HG   PRO 131          HG2       PRO 131  29.490  -0.835   9.593
  956   2HG   PRO 131          HG3       PRO 131  28.807  -1.651   8.190
  957   1HD   PRO 131          HD2       PRO 131  29.199  -3.038  10.445
  958   2HD   PRO 131          HD3       PRO 131  29.594  -3.768   8.856
  959    H    GLU 132           H        GLU 132  30.705  -1.199  11.178
  960    HA   GLU 132           HA       GLU 132  30.776   0.304  12.843
  961   1HB   GLU 132          HB2       GLU 132  33.034  -0.863  13.207
  962   2HB   GLU 132          HB3       GLU 132  33.771   0.607  12.560
  963   1HG   GLU 132          HG2       GLU 132  32.523   1.912  14.348
  964   2HG   GLU 132          HG3       GLU 132  31.912   0.386  14.974
  965    H    ASP 133           H        ASP 133  29.995   1.134  10.363
  966    HA   ASP 133           HA       ASP 133  30.704   4.008  10.277
  967   1HB   ASP 133          HB2       ASP 133  32.291   3.082   8.748
  968   2HB   ASP 133          HB3       ASP 133  31.073   2.043   8.003
  969    HA   PRO 134           HA       PRO 134  26.162   3.469   9.836
  970   1HB   PRO 134          HB2       PRO 134  26.381   6.424  10.392
  971   2HB   PRO 134          HB3       PRO 134  25.201   5.241  11.035
  972   1HG   PRO 134          HG2       PRO 134  27.277   6.077  12.567
  973   2HG   PRO 134          HG3       PRO 134  26.820   4.341  12.545
  974   1HD   PRO 134          HD2       PRO 134  29.051   5.716  11.021
  975   2HD   PRO 134          HD3       PRO 134  29.086   4.178  11.937
  976    H    ALA 135           H        ALA 135  28.455   5.339   8.028
  977    HA   ALA 135           HA       ALA 135  28.393   6.724   6.282
  978   1HB   ALA 135          HB1       ALA 135  28.021   5.534   4.264
  979   2HB   ALA 135          HB2       ALA 135  28.595   4.377   5.468
  980   3HB   ALA 135          HB3       ALA 135  26.866   4.435   5.030
  981    H    GLU 136           H        GLU 136  26.511   7.922   7.795
  982    HA   GLU 136           HA       GLU 136  23.999   8.299   6.534
  983   1HB   GLU 136          HB2       GLU 136  23.837  10.359   7.791
  984   2HB   GLU 136          HB3       GLU 136  24.483   9.067   8.801
  985   1HG   GLU 136          HG2       GLU 136  26.788   9.991   8.478
  986   2HG   GLU 136          HG3       GLU 136  26.114  11.302   7.509
  987    H    GLU 137           H        GLU 137  27.200   9.530   5.703
  988    HA   GLU 137           HA       GLU 137  26.375  11.559   3.867
  989   1HB   GLU 137          HB2       GLU 137  28.928   9.896   4.019
  990   2HB   GLU 137          HB3       GLU 137  28.693  11.294   2.960
  991   1HG   GLU 137          HG2       GLU 137  28.248  12.720   4.962
  992   2HG   GLU 137          HG3       GLU 137  28.580  11.338   6.008
  993    H    TRP 138           H        TRP 138  26.806   8.001   3.474
  994    HA   TRP 138           HA       TRP 138  26.591   8.016   0.596
  995   1HB   TRP 138          HB2       TRP 138  26.259   5.913   2.750
  996   2HB   TRP 138          HB3       TRP 138  25.579   5.647   1.178
  997    HD1  TRP 138           HD1      TRP 138  26.840   4.098  -0.159
  998    HE1  TRP 138           HE1      TRP 138  29.240   3.442  -0.562
  999    HE3  TRP 138           HE3      TRP 138  29.108   7.497   2.954
 1000    HZ2  TRP 138           HZ2      TRP 138  31.887   4.331   0.303
 1001    HZ3  TRP 138           HZ3      TRP 138  31.573   7.555   3.141
 1002    HH2  TRP 138           HH2      TRP 138  32.976   5.990   1.811
 1003    H    LEU 139           H        LEU 139  24.303   7.676   3.350
 1004    HA   LEU 139           HA       LEU 139  21.999   7.168   1.781
 1005   1HB   LEU 139          HB2       LEU 139  22.588   7.324   4.498
 1006   2HB   LEU 139          HB3       LEU 139  21.633   8.764   4.287
 1007    HG   LEU 139           HG       LEU 139  19.809   7.370   3.216
 1008   1HD1  LEU 139          HD11      LEU 139  21.051   5.369   2.514
 1009   2HD1  LEU 139          HD12      LEU 139  21.560   5.057   4.188
 1010   3HD1  LEU 139          HD13      LEU 139  19.857   4.901   3.720
 1011   1HD2  LEU 139          HD21      LEU 139  20.656   6.626   6.051
 1012   2HD2  LEU 139          HD22      LEU 139  19.728   8.067   5.578
 1013   3HD2  LEU 139          HD23      LEU 139  19.017   6.458   5.377
 1014    H    GLY 140           H        GLY 140  23.201  10.219   3.199
 1015   1HA   GLY 140          HA2       GLY 140  21.260  11.956   2.131
 1016   2HA   GLY 140          HA3       GLY 140  22.913  12.420   2.571
 1017    H    SER 141           H        SER 141  24.435  10.909   0.602
 1018    HA   SER 141           HA       SER 141  24.317  12.467  -1.694
 1019   1HB   SER 141          HB2       SER 141  25.448   9.749  -0.893
 1020   2HB   SER 141          HB3       SER 141  25.745  10.516  -2.413
 1021    HG   SER 141           HG       SER 141  26.515  11.243   0.168
 1022    H    TRP 142           H        TRP 142  23.408   9.004  -1.232
 1023    HA   TRP 142           HA       TRP 142  22.314   8.593  -3.753
 1024   1HB   TRP 142          HB2       TRP 142  22.908   6.807  -2.291
 1025   2HB   TRP 142          HB3       TRP 142  21.764   7.338  -1.068
 1026    HD1  TRP 142           HD1      TRP 142  21.586   6.048  -4.712
 1027    HE1  TRP 142           HE1      TRP 142  19.370   4.786  -5.022
 1028    HE3  TRP 142           HE3      TRP 142  19.655   6.662  -0.027
 1029    HZ2  TRP 142           HZ2      TRP 142  17.129   3.946  -3.357
 1030    HZ3  TRP 142           HZ3      TRP 142  17.469   5.668   0.577
 1031    HH2  TRP 142           HH2      TRP 142  16.207   4.310  -1.070
 1032    H    VAL 143           H        VAL 143  20.537   9.650  -0.788
 1033    HA   VAL 143           HA       VAL 143  17.957   9.655  -1.967
 1034    HB   VAL 143           HB       VAL 143  19.189  11.123   0.396
 1035   1HG1  VAL 143          HG11      VAL 143  16.254  11.173  -0.429
 1036   2HG1  VAL 143          HG12      VAL 143  16.906  11.730   1.131
 1037   3HG1  VAL 143          HG13      VAL 143  17.352  12.574  -0.348
 1038   1HG2  VAL 143          HG21      VAL 143  17.136   8.864   0.193
 1039   2HG2  VAL 143          HG22      VAL 143  18.840   8.666   0.617
 1040   3HG2  VAL 143          HG23      VAL 143  17.775   9.562   1.699
 1041    H    ASN 144           H        ASN 144  20.317  12.418  -1.606
 1042    HA   ASN 144           HA       ASN 144  18.484  14.100  -3.027
 1043   1HB   ASN 144          HB2       ASN 144  19.724  15.876  -2.571
 1044   2HB   ASN 144          HB3       ASN 144  20.303  14.819  -1.291
 1045   1HD2  ASN 144          HD22      ASN 144  22.365  13.602  -1.787
 1046   2HD2  ASN 144          HD21      ASN 144  23.512  14.327  -2.897
 1047    H    LEU 145           H        LEU 145  20.833  11.838  -4.146
 1048    HA   LEU 145           HA       LEU 145  21.068  13.036  -6.819
 1049   1HB   LEU 145          HB2       LEU 145  22.137  10.596  -5.433
 1050   2HB   LEU 145          HB3       LEU 145  21.833  10.439  -7.150
 1051    HG   LEU 145           HG       LEU 145  23.249  12.322  -7.695
 1052   1HD1  LEU 145          HD11      LEU 145  23.011  13.723  -5.657
 1053   2HD1  LEU 145          HD12      LEU 145  23.945  12.527  -4.738
 1054   3HD1  LEU 145          HD13      LEU 145  24.704  13.426  -6.064
 1055   1HD2  LEU 145          HD21      LEU 145  24.222  10.061  -7.546
 1056   2HD2  LEU 145          HD22      LEU 145  25.412  11.294  -7.106
 1057   3HD2  LEU 145          HD23      LEU 145  24.622  10.332  -5.836
 1058    H    LEU 146           H        LEU 146  19.198  10.279  -5.340
 1059    HA   LEU 146           HA       LEU 146  18.015   9.592  -7.840
 1060   1HB   LEU 146          HB2       LEU 146  16.894   7.995  -6.724
 1061   2HB   LEU 146          HB3       LEU 146  18.325   8.167  -5.753
 1062    HG   LEU 146           HG       LEU 146  16.678   9.717  -4.275
 1063   1HD1  LEU 146          HD11      LEU 146  14.758   7.766  -5.636
 1064   2HD1  LEU 146          HD12      LEU 146  14.391   8.760  -4.216
 1065   3HD1  LEU 146          HD13      LEU 146  14.682   9.531  -5.768
 1066   1HD2  LEU 146          HD21      LEU 146  16.155   7.737  -2.914
 1067   2HD2  LEU 146          HD22      LEU 146  16.601   6.681  -4.272
 1068   3HD2  LEU 146          HD23      LEU 146  17.824   7.704  -3.490
 1069    H    LYS 147           H        LYS 147  17.061  11.733  -5.216
 1070    HA   LYS 147           HA       LYS 147  14.452  12.430  -6.048
 1071   1HB   LYS 147          HB2       LYS 147  16.626  13.771  -4.409
 1072   2HB   LYS 147          HB3       LYS 147  15.173  14.672  -4.861
 1073   1HG   LYS 147          HG2       LYS 147  13.735  12.912  -3.867
 1074   2HG   LYS 147          HG3       LYS 147  15.174  12.019  -3.350
 1075   1HD   LYS 147          HD2       LYS 147  15.850  13.915  -1.920
 1076   2HD   LYS 147          HD3       LYS 147  14.464  14.866  -2.497
 1077   1HE   LYS 147          HE2       LYS 147  12.966  13.087  -1.610
 1078   2HE   LYS 147          HE3       LYS 147  14.359  12.239  -0.942
 1079   1HZ   LYS 147          HZ1       LYS 147  13.434  14.946  -0.160
 1080   2HZ   LYS 147          HZ2       LYS 147  13.306  13.575   0.728
 1081   3HZ   LYS 147          HZ3       LYS 147  14.780  14.225   0.436
  Start of MODEL   12
    1   1H    MET   1          H1        MET   1   1.629  -3.362   0.251
    2   2H    MET   1          H2        MET   1   3.173  -3.124   0.770
    3   3H    MET   1          H3        MET   1   1.965  -2.200   1.370
    4    HA   MET   1           HA       MET   1   2.877  -2.208  -1.422
    5   1HB   MET   1          HB2       MET   1   0.825  -0.438  -0.015
    6   2HB   MET   1          HB3       MET   1   1.543  -0.073  -1.583
    7   1HG   MET   1          HG2       MET   1  -0.154  -2.510  -0.938
    8   2HG   MET   1          HG3       MET   1  -0.649  -1.089  -1.847
    9   1HE   MET   1          HE1       MET   1  -1.097  -4.043  -2.884
   10   2HE   MET   1          HE2       MET   1  -1.578  -2.589  -3.790
   11   3HE   MET   1          HE3       MET   1  -0.639  -3.868  -4.593
   12    H    ALA   2           H        ALA   2   4.637  -0.957  -1.869
   13    HA   ALA   2           HA       ALA   2   5.548   1.161  -0.090
   14   1HB   ALA   2          HB1       ALA   2   7.126  -1.434  -0.482
   15   2HB   ALA   2          HB2       ALA   2   7.759   0.037   0.262
   16   3HB   ALA   2          HB3       ALA   2   6.447  -0.852   1.057
   17    H    ASP   3           H        ASP   3   7.643   2.074  -1.047
   18    HA   ASP   3           HA       ASP   3   7.664   1.927  -4.006
   19   1HB   ASP   3          HB2       ASP   3   7.604   4.167  -2.742
   20   2HB   ASP   3          HB3       ASP   3   9.202   3.775  -2.147
   21    H    ILE   4           H        ILE   4   9.439   1.000  -1.124
   22    HA   ILE   4           HA       ILE   4  11.668  -0.066  -2.790
   23    HB   ILE   4           HB       ILE   4  11.903   1.074   0.017
   24   1HG1  ILE   4          HG12      ILE   4  12.504   2.529  -2.579
   25   2HG1  ILE   4          HG13      ILE   4  11.285   2.970  -1.388
   26   1HG2  ILE   4          HG21      ILE   4  13.616  -0.578  -0.669
   27   2HG2  ILE   4          HG22      ILE   4  14.005   0.419  -2.078
   28   3HG2  ILE   4          HG23      ILE   4  14.296   1.017  -0.430
   29   1HD1  ILE   4          HD11      ILE   4  13.137   3.412   0.253
   30   2HD1  ILE   4          HD12      ILE   4  14.291   3.170  -1.080
   31   3HD1  ILE   4          HD13      ILE   4  13.106   4.475  -1.165
   32    H    THR   5           H        THR   5  12.025  -2.215  -2.500
   33    HA   THR   5           HA       THR   5  10.853  -3.557  -0.121
   34    HB   THR   5           HB       THR   5  10.398  -4.552  -2.410
   35    HG1  THR   5           HG1      THR   5  10.383  -5.972  -0.773
   36   1HG2  THR   5          HG21      THR   5  13.357  -5.152  -2.610
   37   2HG2  THR   5          HG22      THR   5  12.067  -5.713  -3.683
   38   3HG2  THR   5          HG23      THR   5  12.452  -3.993  -3.615
   39    H    LEU   6           H        LEU   6  12.259  -4.065   1.565
   40    HA   LEU   6           HA       LEU   6  15.196  -3.623   1.126
   41   1HB   LEU   6          HB2       LEU   6  13.459  -3.379   3.603
   42   2HB   LEU   6          HB3       LEU   6  15.177  -3.658   3.692
   43    HG   LEU   6           HG       LEU   6  15.480  -1.567   2.198
   44   1HD1  LEU   6          HD11      LEU   6  13.706   0.146   2.472
   45   2HD1  LEU   6          HD12      LEU   6  13.122  -1.247   1.554
   46   3HD1  LEU   6          HD13      LEU   6  12.670  -1.075   3.260
   47   1HD2  LEU   6          HD21      LEU   6  14.528  -1.363   5.077
   48   2HD2  LEU   6          HD22      LEU   6  16.185  -1.644   4.523
   49   3HD2  LEU   6          HD23      LEU   6  15.406  -0.088   4.199
   50    H    ILE   7           H        ILE   7  15.837  -5.572   0.456
   51    HA   ILE   7           HA       ILE   7  14.770  -8.037   1.611
   52    HB   ILE   7           HB       ILE   7  17.096  -7.834  -0.333
   53   1HG1  ILE   7          HG12      ILE   7  14.109  -7.873  -0.996
   54   2HG1  ILE   7          HG13      ILE   7  15.235  -6.565  -1.355
   55   1HG2  ILE   7          HG21      ILE   7  16.405 -10.135  -0.847
   56   2HG2  ILE   7          HG22      ILE   7  16.584  -9.987   0.900
   57   3HG2  ILE   7          HG23      ILE   7  14.958  -9.956   0.177
   58   1HD1  ILE   7          HD11      ILE   7  14.822  -7.765  -3.374
   59   2HD1  ILE   7          HD12      ILE   7  16.499  -8.074  -2.884
   60   3HD1  ILE   7          HD13      ILE   7  15.247  -9.313  -2.635
   61    H    SER   8           H        SER   8  15.249  -7.944   3.673
   62    HA   SER   8           HA       SER   8  17.802  -6.966   4.721
   63   1HB   SER   8          HB2       SER   8  15.225  -7.757   6.142
   64   2HB   SER   8          HB3       SER   8  16.539  -6.758   6.774
   65    HG   SER   8           HG       SER   8  14.871  -6.125   4.534
   66    H    GLY   9           H        GLY   9  18.362  -9.371   3.498
   67   1HA   GLY   9          HA2       GLY   9  19.488 -10.793   5.614
   68   2HA   GLY   9          HA3       GLY   9  18.026 -11.684   5.158
   69    H    SER  10           H        SER  10  20.307 -12.969   4.955
   70    HA   SER  10           HA       SER  10  21.047 -13.024   2.070
   71   1HB   SER  10          HB2       SER  10  23.257 -13.837   3.059
   72   2HB   SER  10          HB3       SER  10  22.860 -12.139   3.303
   73    HG   SER  10           HG       SER  10  23.575 -13.080   5.251
   74    H    THR  11           H        THR  11  20.882 -15.068   5.073
   75    HA   THR  11           HA       THR  11  20.497 -17.496   3.462
   76    HB   THR  11           HB       THR  11  20.296 -18.474   5.801
   77    HG1  THR  11           HG1      THR  11  20.925 -17.110   7.498
   78   1HG2  THR  11          HG21      THR  11  22.673 -18.314   6.268
   79   2HG2  THR  11          HG22      THR  11  22.447 -18.407   4.514
   80   3HG2  THR  11          HG23      THR  11  22.828 -16.846   5.271
   81    H    LEU  12           H        LEU  12  18.639 -16.207   6.234
   82    HA   LEU  12           HA       LEU  12  16.230 -15.809   4.649
   83   1HB   LEU  12          HB2       LEU  12  16.423 -18.325   5.260
   84   2HB   LEU  12          HB3       LEU  12  16.111 -17.838   6.917
   85    HG   LEU  12           HG       LEU  12  13.874 -16.950   6.225
   86   1HD1  LEU  12          HD11      LEU  12  14.246 -16.256   3.921
   87   2HD1  LEU  12          HD12      LEU  12  14.677 -17.916   3.447
   88   3HD1  LEU  12          HD13      LEU  12  13.015 -17.513   3.935
   89   1HD2  LEU  12          HD21      LEU  12  12.833 -19.109   5.748
   90   2HD2  LEU  12          HD22      LEU  12  14.404 -19.787   5.262
   91   3HD2  LEU  12          HD23      LEU  12  14.122 -19.294   6.945
   92    H    GLY  13           H        GLY  13  18.136 -14.310   6.418
   93   1HA   GLY  13          HA2       GLY  13  16.330 -12.723   7.938
   94   2HA   GLY  13          HA3       GLY  13  17.201 -13.834   9.006
   95    H    GLY  14           H        GLY  14  17.618 -11.198   9.384
   96   1HA   GLY  14          HA2       GLY  14  20.402 -10.737   9.054
   97   2HA   GLY  14          HA3       GLY  14  19.468  -9.758   7.902
   98    H    ALA  15           H        ALA  15  20.759  -8.277   9.689
   99    HA   ALA  15           HA       ALA  15  19.741  -8.062  12.309
  100   1HB   ALA  15          HB1       ALA  15  21.958  -7.250  11.669
  101   2HB   ALA  15          HB2       ALA  15  21.234  -6.012  10.616
  102   3HB   ALA  15          HB3       ALA  15  21.002  -5.935  12.376
  103    H    GLU  16           H        GLU  16  17.583  -7.755  12.633
  104    HA   GLU  16           HA       GLU  16  15.870  -6.262  10.991
  105   1HB   GLU  16          HB2       GLU  16  15.416  -6.639  13.980
  106   2HB   GLU  16          HB3       GLU  16  14.239  -6.426  12.691
  107   1HG   GLU  16          HG2       GLU  16  14.009  -8.663  12.944
  108   2HG   GLU  16          HG3       GLU  16  15.339  -8.712  11.796
  109    H    TYR  17           H        TYR  17  17.723  -5.262  13.874
  110    HA   TYR  17           HA       TYR  17  16.528  -2.753  14.312
  111   1HB   TYR  17          HB2       TYR  17  18.080  -3.912  15.858
  112   2HB   TYR  17          HB3       TYR  17  19.415  -3.635  14.749
  113    HD1  TYR  17           HD1      TYR  17  20.380  -1.364  14.457
  114    HD2  TYR  17           HD2      TYR  17  17.162  -2.108  17.240
  115    HE1  TYR  17           HE1      TYR  17  20.786   0.831  15.516
  116    HE2  TYR  17           HE2      TYR  17  17.582   0.077  18.321
  117    HH   TYR  17           HH       TYR  17  18.876   2.022  18.317
  118    H    VAL  18           H        VAL  18  19.129  -3.702  12.034
  119    HA   VAL  18           HA       VAL  18  19.819  -0.968  11.299
  120    HB   VAL  18           HB       VAL  18  20.406  -3.695  10.030
  121   1HG1  VAL  18          HG11      VAL  18  20.531  -1.932   8.319
  122   2HG1  VAL  18          HG12      VAL  18  21.602  -0.989   9.378
  123   3HG1  VAL  18          HG13      VAL  18  22.120  -2.567   8.710
  124   1HG2  VAL  18          HG21      VAL  18  21.474  -3.400  12.237
  125   2HG2  VAL  18          HG22      VAL  18  22.674  -3.360  10.947
  126   3HG2  VAL  18          HG23      VAL  18  22.154  -1.845  11.713
  127    H    ALA  19           H        ALA  19  17.930  -3.693   9.929
  128    HA   ALA  19           HA       ALA  19  17.309  -2.334   7.512
  129   1HB   ALA  19          HB1       ALA  19  15.752  -4.128   7.130
  130   2HB   ALA  19          HB2       ALA  19  17.246  -4.782   7.812
  131   3HB   ALA  19          HB3       ALA  19  15.798  -4.615   8.843
  132    H    GLU  20           H        GLU  20  15.434  -2.613  10.589
  133    HA   GLU  20           HA       GLU  20  13.175  -1.144   9.662
  134   1HB   GLU  20          HB2       GLU  20  13.284  -2.631  11.672
  135   2HB   GLU  20          HB3       GLU  20  14.251  -1.397  12.500
  136   1HG   GLU  20          HG2       GLU  20  12.371   0.219  12.222
  137   2HG   GLU  20          HG3       GLU  20  11.437  -1.013  11.376
  138    H    HIS  21           H        HIS  21  16.251  -0.059  11.255
  139    HA   HIS  21           HA       HIS  21  15.474   2.675  11.517
  140   1HB   HIS  21          HB2       HIS  21  17.404   1.618  12.668
  141   2HB   HIS  21          HB3       HIS  21  18.256   1.498  11.127
  142    HD1  HIS  21           HD1      HIS  21  17.560   3.947  13.918
  143    HD2  HIS  21           HD2      HIS  21  18.940   3.934   9.942
  144    HE1  HIS  21           HE1      HIS  21  18.682   6.200  13.542
  145    H    LEU  22           H        LEU  22  17.223   0.941   8.901
  146    HA   LEU  22           HA       LEU  22  17.607   3.112   7.120
  147   1HB   LEU  22          HB2       LEU  22  17.188   0.124   6.773
  148   2HB   LEU  22          HB3       LEU  22  17.367   1.154   5.378
  149    HG   LEU  22           HG       LEU  22  19.433   1.006   7.626
  150   1HD1  LEU  22          HD11      LEU  22  19.416  -0.450   4.950
  151   2HD1  LEU  22          HD12      LEU  22  20.679  -0.529   6.207
  152   3HD1  LEU  22          HD13      LEU  22  19.082  -1.199   6.524
  153   1HD2  LEU  22          HD21      LEU  22  19.609   2.090   4.774
  154   2HD2  LEU  22          HD22      LEU  22  19.654   3.050   6.268
  155   3HD2  LEU  22          HD23      LEU  22  20.972   1.935   5.901
  156    H    ALA  23           H        ALA  23  14.978   0.692   7.185
  157    HA   ALA  23           HA       ALA  23  13.342   1.684   5.197
  158   1HB   ALA  23          HB1       ALA  23  11.476   0.570   6.429
  159   2HB   ALA  23          HB2       ALA  23  12.919  -0.445   6.350
  160   3HB   ALA  23          HB3       ALA  23  12.513   0.410   7.847
  161    H    GLU  24           H        GLU  24  13.242   2.627   8.686
  162    HA   GLU  24           HA       GLU  24  11.099   4.426   8.512
  163   1HB   GLU  24          HB2       GLU  24  12.288   3.494  10.571
  164   2HB   GLU  24          HB3       GLU  24  13.523   4.710  10.359
  165   1HG   GLU  24          HG2       GLU  24  11.830   6.482  10.557
  166   2HG   GLU  24          HG3       GLU  24  10.547   5.281  10.703
  167    H    LYS  25           H        LYS  25  14.619   5.187   8.503
  168    HA   LYS  25           HA       LYS  25  14.367   7.931   7.967
  169   1HB   LYS  25          HB2       LYS  25  16.508   5.888   7.217
  170   2HB   LYS  25          HB3       LYS  25  16.718   7.608   6.998
  171   1HG   LYS  25          HG2       LYS  25  16.209   6.149   9.645
  172   2HG   LYS  25          HG3       LYS  25  17.722   6.792   9.101
  173   1HD   LYS  25          HD2       LYS  25  15.277   8.244  10.086
  174   2HD   LYS  25          HD3       LYS  25  16.910   8.268  10.749
  175   1HE   LYS  25          HE2       LYS  25  17.647   9.471   8.617
  176   2HE   LYS  25          HE3       LYS  25  15.931   9.600   8.184
  177   1HZ   LYS  25          HZ1       LYS  25  17.175  10.756  10.614
  178   2HZ   LYS  25          HZ2       LYS  25  16.704  11.589   9.299
  179   3HZ   LYS  25          HZ3       LYS  25  15.587  10.863  10.236
  180    H    LEU  26           H        LEU  26  14.465   5.258   5.616
  181    HA   LEU  26           HA       LEU  26  14.415   7.016   3.324
  182   1HB   LEU  26          HB2       LEU  26  14.001   4.084   3.798
  183   2HB   LEU  26          HB3       LEU  26  13.440   4.779   2.281
  184    HG   LEU  26           HG       LEU  26  15.531   5.365   1.541
  185   1HD1  LEU  26          HD11      LEU  26  16.561   6.486   3.470
  186   2HD1  LEU  26          HD12      LEU  26  16.763   4.921   4.291
  187   3HD1  LEU  26          HD13      LEU  26  17.646   5.280   2.795
  188   1HD2  LEU  26          HD21      LEU  26  15.934   2.790   3.122
  189   2HD2  LEU  26          HD22      LEU  26  15.128   2.927   1.547
  190   3HD2  LEU  26          HD23      LEU  26  16.857   3.294   1.694
  191    H    GLU  27           H        GLU  27  11.710   5.787   5.419
  192    HA   GLU  27           HA       GLU  27   9.755   6.774   3.550
  193   1HB   GLU  27          HB2       GLU  27   9.578   6.162   6.535
  194   2HB   GLU  27          HB3       GLU  27   8.255   6.635   5.482
  195   1HG   GLU  27          HG2       GLU  27   9.084   4.608   3.994
  196   2HG   GLU  27          HG3       GLU  27   9.800   4.068   5.506
  197    H    GLU  28           H        GLU  28  11.538   8.158   6.383
  198    HA   GLU  28           HA       GLU  28  10.288  10.700   6.320
  199   1HB   GLU  28          HB2       GLU  28  13.074   9.793   7.164
  200   2HB   GLU  28          HB3       GLU  28  12.448  11.395   7.427
  201   1HG   GLU  28          HG2       GLU  28  11.200   8.866   8.566
  202   2HG   GLU  28          HG3       GLU  28  12.341   9.902   9.409
  203    H    ALA  29           H        ALA  29  12.805   9.271   4.267
  204    HA   ALA  29           HA       ALA  29  13.636  11.725   3.017
  205   1HB   ALA  29          HB1       ALA  29  14.719  10.282   1.372
  206   2HB   ALA  29          HB2       ALA  29  15.022   9.658   3.002
  207   3HB   ALA  29          HB3       ALA  29  13.823   8.877   1.944
  208    H    GLY  30           H        GLY  30  10.662  10.023   2.784
  209   1HA   GLY  30          HA2       GLY  30   8.902  11.243   1.782
  210   2HA   GLY  30          HA3       GLY  30   9.947  11.718   0.442
  211    H    PHE  31           H        PHE  31  10.120   8.363   1.443
  212    HA   PHE  31           HA       PHE  31   8.430   7.562  -0.892
  213   1HB   PHE  31          HB2       PHE  31  10.694   5.857   0.092
  214   2HB   PHE  31          HB3       PHE  31   9.949   5.925  -1.484
  215    HD1  PHE  31           HD1      PHE  31  10.258   8.314  -2.757
  216    HD2  PHE  31           HD2      PHE  31  12.876   6.720   0.279
  217    HE1  PHE  31           HE1      PHE  31  12.103   9.751  -3.586
  218    HE2  PHE  31           HE2      PHE  31  14.713   8.159  -0.550
  219    HZ   PHE  31           HZ       PHE  31  14.335   9.680  -2.482
  220    H    THR  32           H        THR  32   8.348   4.815  -0.350
  221    HA   THR  32           HA       THR  32   7.534   4.503   2.457
  222    HB   THR  32           HB       THR  32   5.707   2.926   1.600
  223    HG1  THR  32           HG1      THR  32   5.845   4.682  -0.633
  224   1HG2  THR  32          HG21      THR  32   4.018   4.699   1.595
  225   2HG2  THR  32          HG22      THR  32   5.243   4.963   2.850
  226   3HG2  THR  32          HG23      THR  32   5.285   5.930   1.359
  227    H    THR  33           H        THR  33   7.971   2.362   3.205
  228    HA   THR  33           HA       THR  33   9.637   0.740   1.335
  229    HB   THR  33           HB       THR  33  11.367   0.687   2.957
  230    HG1  THR  33           HG1      THR  33  11.027   2.467   4.705
  231   1HG2  THR  33          HG21      THR  33  12.277   2.860   2.775
  232   2HG2  THR  33          HG22      THR  33  11.243   2.688   1.350
  233   3HG2  THR  33          HG23      THR  33  10.674   3.640   2.718
  234    H    GLU  34           H        GLU  34   9.901  -1.537   1.938
  235    HA   GLU  34           HA       GLU  34   8.209  -2.411   4.194
  236   1HB   GLU  34          HB2       GLU  34   7.811  -2.727   1.383
  237   2HB   GLU  34          HB3       GLU  34   8.463  -4.241   1.932
  238   1HG   GLU  34          HG2       GLU  34   6.746  -4.208   3.773
  239   2HG   GLU  34          HG3       GLU  34   6.122  -2.687   3.166
  240    H    THR  35           H        THR  35   9.685  -2.918   5.711
  241    HA   THR  35           HA       THR  35  12.245  -4.067   5.182
  242    HB   THR  35           HB       THR  35  10.828  -4.364   7.826
  243    HG1  THR  35           HG1      THR  35  10.961  -2.265   8.288
  244   1HG2  THR  35          HG21      THR  35  13.224  -5.057   7.352
  245   2HG2  THR  35          HG22      THR  35  13.592  -3.345   7.061
  246   3HG2  THR  35          HG23      THR  35  13.053  -3.876   8.675
  247    H    LEU  36           H        LEU  36  12.619  -6.169   4.639
  248    HA   LEU  36           HA       LEU  36  10.679  -8.317   5.444
  249   1HB   LEU  36          HB2       LEU  36  11.721  -7.564   2.672
  250   2HB   LEU  36          HB3       LEU  36  10.852  -9.047   3.010
  251    HG   LEU  36           HG       LEU  36   9.655  -6.289   3.411
  252   1HD1  LEU  36          HD11      LEU  36   8.543  -6.701   1.242
  253   2HD1  LEU  36          HD12      LEU  36  10.312  -6.604   1.113
  254   3HD1  LEU  36          HD13      LEU  36   9.521  -8.188   1.042
  255   1HD2  LEU  36          HD21      LEU  36   8.353  -9.049   3.199
  256   2HD2  LEU  36          HD22      LEU  36   8.512  -8.094   4.690
  257   3HD2  LEU  36          HD23      LEU  36   7.502  -7.500   3.367
  258    H    HIS  37           H        HIS  37  11.733 -10.315   5.819
  259    HA   HIS  37           HA       HIS  37  14.619 -10.497   5.143
  260   1HB   HIS  37          HB2       HIS  37  12.770 -12.463   6.559
  261   2HB   HIS  37          HB3       HIS  37  14.509 -12.657   6.331
  262    HD1  HIS  37           HD1      HIS  37  15.800 -10.069   7.337
  263    HD2  HIS  37           HD2      HIS  37  12.296 -11.730   9.004
  264    HE1  HIS  37           HE1      HIS  37  15.585  -9.100   9.664
  265    H    GLY  38           H        GLY  38  13.208 -10.042   2.944
  266   1HA   GLY  38          HA2       GLY  38  12.116 -10.709   1.048
  267   2HA   GLY  38          HA3       GLY  38  13.531 -11.741   0.910
  268    HA   PRO  39           HA       PRO  39  10.256 -14.726   2.857
  269   1HB   PRO  39          HB2       PRO  39   7.703 -13.172   2.555
  270   2HB   PRO  39          HB3       PRO  39   8.170 -14.330   3.837
  271   1HG   PRO  39          HG2       PRO  39   8.238 -11.656   4.297
  272   2HG   PRO  39          HG3       PRO  39   9.560 -12.713   4.895
  273   1HD   PRO  39          HD2       PRO  39   9.518 -10.991   2.403
  274   2HD   PRO  39          HD3       PRO  39  10.783 -11.172   3.653
  275    H    LEU  40           H        LEU  40   9.470 -12.681   0.070
  276    HA   LEU  40           HA       LEU  40   8.353 -14.984  -1.425
  277   1HB   LEU  40          HB2       LEU  40   7.902 -11.958  -1.518
  278   2HB   LEU  40          HB3       LEU  40   7.295 -13.070  -2.713
  279    HG   LEU  40           HG       LEU  40   6.505 -13.080   0.223
  280   1HD1  LEU  40          HD11      LEU  40   4.345 -12.229  -0.585
  281   2HD1  LEU  40          HD12      LEU  40   5.659 -11.124  -1.013
  282   3HD1  LEU  40          HD13      LEU  40   4.964 -12.192  -2.252
  283   1HD2  LEU  40          HD21      LEU  40   6.308 -15.351  -0.670
  284   2HD2  LEU  40          HD22      LEU  40   4.702 -14.646  -0.500
  285   3HD2  LEU  40          HD23      LEU  40   5.453 -14.746  -2.108
  286    H    LEU  41           H        LEU  41  11.224 -13.897  -0.914
  287    HA   LEU  41           HA       LEU  41  13.152 -13.501  -1.915
  288   1HB   LEU  41          HB2       LEU  41  12.367 -15.366  -3.469
  289   2HB   LEU  41          HB3       LEU  41  11.859 -14.105  -4.585
  290    HG   LEU  41           HG       LEU  41  14.329 -13.254  -4.452
  291   1HD1  LEU  41          HD11      LEU  41  14.731 -16.135  -3.536
  292   2HD1  LEU  41          HD12      LEU  41  15.987 -14.933  -3.923
  293   3HD1  LEU  41          HD13      LEU  41  14.952 -14.719  -2.501
  294   1HD2  LEU  41          HD21      LEU  41  13.591 -15.879  -5.794
  295   2HD2  LEU  41          HD22      LEU  41  13.358 -14.246  -6.441
  296   3HD2  LEU  41          HD23      LEU  41  15.001 -14.867  -6.207
  297    H    GLU  42           H        GLU  42  10.357 -11.878  -3.261
  298    HA   GLU  42           HA       GLU  42  11.593  -9.249  -3.545
  299   1HB   GLU  42          HB2       GLU  42  11.216  -9.205  -6.029
  300   2HB   GLU  42          HB3       GLU  42  12.589 -10.155  -5.509
  301   1HG   GLU  42          HG2       GLU  42  11.294 -12.254  -5.846
  302   2HG   GLU  42          HG3       GLU  42   9.922 -11.322  -6.422
  303    H    ASP  43           H        ASP  43   9.944  -8.553  -2.224
  304    HA   ASP  43           HA       ASP  43   7.163  -9.224  -2.735
  305   1HB   ASP  43          HB2       ASP  43   7.771  -8.418  -0.548
  306   2HB   ASP  43          HB3       ASP  43   8.414  -6.910  -1.229
  307    H    LEU  44           H        LEU  44   9.360  -6.499  -3.682
  308    HA   LEU  44           HA       LEU  44   7.194  -5.453  -5.415
  309   1HB   LEU  44          HB2       LEU  44  10.050  -4.516  -5.099
  310   2HB   LEU  44          HB3       LEU  44   8.948  -3.799  -6.199
  311    HG   LEU  44           HG       LEU  44   8.560  -3.842  -3.186
  312   1HD1  LEU  44          HD11      LEU  44  10.332  -2.303  -4.086
  313   2HD1  LEU  44          HD12      LEU  44   9.105  -1.531  -5.104
  314   3HD1  LEU  44          HD13      LEU  44   8.968  -1.452  -3.335
  315   1HD2  LEU  44          HD21      LEU  44   6.809  -2.614  -5.360
  316   2HD2  LEU  44          HD22      LEU  44   6.348  -3.891  -4.206
  317   3HD2  LEU  44          HD23      LEU  44   6.678  -2.267  -3.623
  318    HA   PRO  45           HA       PRO  45   8.401  -7.765  -8.985
  319   1HB   PRO  45          HB2       PRO  45   7.698  -6.015 -11.035
  320   2HB   PRO  45          HB3       PRO  45   6.568  -6.943 -10.057
  321   1HG   PRO  45          HG2       PRO  45   7.479  -4.066  -9.740
  322   2HG   PRO  45          HG3       PRO  45   5.815  -4.697  -9.636
  323   1HD   PRO  45          HD2       PRO  45   7.372  -4.166  -7.421
  324   2HD   PRO  45          HD3       PRO  45   6.131  -5.460  -7.453
  325    H    ALA  46           H        ALA  46   9.367  -7.107 -11.260
  326    HA   ALA  46           HA       ALA  46  12.140  -6.344 -10.874
  327   1HB   ALA  46          HB1       ALA  46  11.442  -8.179 -12.432
  328   2HB   ALA  46          HB2       ALA  46  10.543  -6.995 -13.413
  329   3HB   ALA  46          HB3       ALA  46  12.306  -6.907 -13.308
  330    H    SER  47           H        SER  47  10.262  -4.234 -10.270
  331    HA   SER  47           HA       SER  47  11.343  -2.048 -11.746
  332   1HB   SER  47          HB2       SER  47   8.965  -1.157 -12.287
  333   2HB   SER  47          HB3       SER  47   9.716  -2.320 -13.383
  334    HG   SER  47           HG       SER  47   7.548  -2.850 -12.940
  335    H    GLY  48           H        GLY  48  11.375  -0.294 -10.336
  336   1HA   GLY  48          HA2       GLY  48  10.026   0.831  -8.410
  337   2HA   GLY  48          HA3       GLY  48  10.180  -0.751  -7.644
  338    H    ILE  49           H        ILE  49  11.522  -0.214  -6.011
  339    HA   ILE  49           HA       ILE  49  14.357   0.380  -6.701
  340    HB   ILE  49           HB       ILE  49  12.939   1.152  -4.154
  341   1HG1  ILE  49          HG12      ILE  49  11.900   2.543  -5.879
  342   2HG1  ILE  49          HG13      ILE  49  12.817   3.463  -4.714
  343   1HG2  ILE  49          HG21      ILE  49  15.369   0.874  -3.927
  344   2HG2  ILE  49          HG22      ILE  49  15.645   2.041  -5.221
  345   3HG2  ILE  49          HG23      ILE  49  14.905   2.564  -3.699
  346   1HD1  ILE  49          HD11      ILE  49  14.562   3.927  -6.261
  347   2HD1  ILE  49          HD12      ILE  49  13.925   2.762  -7.454
  348   3HD1  ILE  49          HD13      ILE  49  13.032   4.249  -7.080
  349    H    TRP  50           H        TRP  50  15.709  -1.233  -5.860
  350    HA   TRP  50           HA       TRP  50  14.578  -3.187  -3.893
  351   1HB   TRP  50          HB2       TRP  50  16.351  -3.522  -6.337
  352   2HB   TRP  50          HB3       TRP  50  16.528  -4.589  -4.983
  353    HD1  TRP  50           HD1      TRP  50  13.037  -3.562  -6.275
  354    HE1  TRP  50           HE1      TRP  50  11.911  -5.531  -7.467
  355    HE3  TRP  50           HE3      TRP  50  16.846  -6.954  -5.907
  356    HZ2  TRP  50           HZ2      TRP  50  12.535  -8.301  -8.004
  357    HZ3  TRP  50           HZ3      TRP  50  16.536  -9.268  -6.737
  358    HH2  TRP  50           HH2      TRP  50  14.392  -9.951  -7.790
  359    H    LEU  51           H        LEU  51  15.790  -3.317  -2.027
  360    HA   LEU  51           HA       LEU  51  18.600  -2.298  -2.090
  361   1HB   LEU  51          HB2       LEU  51  16.516  -1.896   0.094
  362   2HB   LEU  51          HB3       LEU  51  18.238  -1.588   0.289
  363    HG   LEU  51           HG       LEU  51  16.363  -0.090  -1.606
  364   1HD1  LEU  51          HD11      LEU  51  17.760   0.838   0.940
  365   2HD1  LEU  51          HD12      LEU  51  16.656   1.763  -0.092
  366   3HD1  LEU  51          HD13      LEU  51  16.063   0.371   0.831
  367   1HD2  LEU  51          HD21      LEU  51  18.576  -0.089  -2.605
  368   2HD2  LEU  51          HD22      LEU  51  18.317   1.479  -1.852
  369   3HD2  LEU  51          HD23      LEU  51  19.345   0.277  -1.046
  370    H    VAL  52           H        VAL  52  20.027  -3.652  -1.014
  371    HA   VAL  52           HA       VAL  52  18.812  -6.037   0.334
  372    HB   VAL  52           HB       VAL  52  21.274  -6.151  -1.443
  373   1HG1  VAL  52          HG11      VAL  52  21.200  -7.890   0.291
  374   2HG1  VAL  52          HG12      VAL  52  19.541  -8.321  -0.175
  375   3HG1  VAL  52          HG13      VAL  52  20.891  -8.605  -1.292
  376   1HG2  VAL  52          HG21      VAL  52  19.811  -7.407  -3.057
  377   2HG2  VAL  52          HG22      VAL  52  18.397  -6.929  -2.098
  378   3HG2  VAL  52          HG23      VAL  52  19.373  -5.705  -2.929
  379    H    ILE  53           H        ILE  53  19.680  -6.518   2.296
  380    HA   ILE  53           HA       ILE  53  21.977  -4.868   3.227
  381    HB   ILE  53           HB       ILE  53  19.460  -5.341   4.872
  382   1HG1  ILE  53          HG12      ILE  53  19.136  -2.756   4.382
  383   2HG1  ILE  53          HG13      ILE  53  19.915  -3.148   2.854
  384   1HG2  ILE  53          HG21      ILE  53  21.706  -3.295   5.096
  385   2HG2  ILE  53          HG22      ILE  53  20.340  -3.498   6.214
  386   3HG2  ILE  53          HG23      ILE  53  21.550  -4.771   6.069
  387   1HD1  ILE  53          HD11      ILE  53  17.453  -3.177   2.725
  388   2HD1  ILE  53          HD12      ILE  53  18.085  -4.785   2.381
  389   3HD1  ILE  53          HD13      ILE  53  17.390  -4.439   3.974
  390    H    SER  54           H        SER  54  23.504  -6.384   3.546
  391    HA   SER  54           HA       SER  54  23.433  -7.960   5.892
  392   1HB   SER  54          HB2       SER  54  23.325  -9.481   3.239
  393   2HB   SER  54          HB3       SER  54  23.999 -10.176   4.724
  394    HG   SER  54           HG       SER  54  21.443  -9.021   4.737
  395    H    SER  55           H        SER  55  25.619  -7.862   6.561
  396    HA   SER  55           HA       SER  55  27.681  -7.085   4.663
  397   1HB   SER  55          HB2       SER  55  27.906  -8.028   7.549
  398   2HB   SER  55          HB3       SER  55  29.196  -7.285   6.577
  399    HG   SER  55           HG       SER  55  27.895  -5.452   6.352
  400    H    THR  56           H        THR  56  28.059  -8.516   3.073
  401    HA   THR  56           HA       THR  56  27.479 -11.163   3.089
  402    HB   THR  56           HB       THR  56  29.010 -11.137   0.991
  403    HG1  THR  56           HG1      THR  56  29.775  -9.186   0.414
  404   1HG2  THR  56          HG21      THR  56  27.429  -9.731  -0.242
  405   2HG2  THR  56          HG22      THR  56  26.524 -10.648   0.966
  406   3HG2  THR  56          HG23      THR  56  26.886  -8.942   1.256
  407    H    HIS  57           H        HIS  57  30.392  -9.910   4.570
  408    HA   HIS  57           HA       HIS  57  31.259 -12.760   4.941
  409   1HB   HIS  57          HB2       HIS  57  32.980 -11.593   3.778
  410   2HB   HIS  57          HB3       HIS  57  32.831 -10.193   4.832
  411    HD1  HIS  57           HD1      HIS  57  34.367 -10.114   6.893
  412    HD2  HIS  57           HD2      HIS  57  34.141 -13.869   4.982
  413    HE1  HIS  57           HE1      HIS  57  36.167 -11.592   7.966
  414    H    GLY  58           H        GLY  58  31.302  -9.527   6.621
  415   1HA   GLY  58          HA2       GLY  58  31.782 -10.451   9.157
  416   2HA   GLY  58          HA3       GLY  58  30.909  -8.962   8.762
  417    H    ALA  59           H        ALA  59  28.693 -10.550   7.495
  418    HA   ALA  59           HA       ALA  59  27.461 -12.013   9.747
  419   1HB   ALA  59          HB1       ALA  59  25.343 -10.794   9.407
  420   2HB   ALA  59          HB2       ALA  59  26.628  -9.665   9.871
  421   3HB   ALA  59          HB3       ALA  59  26.106  -9.770   8.173
  422    H    GLY  60           H        GLY  60  28.851 -13.038   7.526
  423   1HA   GLY  60          HA2       GLY  60  26.807 -14.399   5.897
  424   2HA   GLY  60          HA3       GLY  60  27.838 -13.236   5.082
  425    H    ASP  61           H        ASP  61  29.154 -14.438   3.989
  426    HA   ASP  61           HA       ASP  61  30.149 -16.197   3.034
  427   1HB   ASP  61          HB2       ASP  61  31.869 -14.806   3.664
  428   2HB   ASP  61          HB3       ASP  61  31.758 -15.285   5.348
  429    H    ILE  62           H        ILE  62  30.085 -17.163   6.525
  430    HA   ILE  62           HA       ILE  62  30.939 -19.781   6.129
  431    HB   ILE  62           HB       ILE  62  29.067 -18.709   8.269
  432   1HG1  ILE  62          HG12      ILE  62  31.148 -17.444   8.230
  433   2HG1  ILE  62          HG13      ILE  62  31.006 -18.425   9.669
  434   1HG2  ILE  62          HG21      ILE  62  29.934 -20.591   9.666
  435   2HG2  ILE  62          HG22      ILE  62  28.925 -21.118   8.319
  436   3HG2  ILE  62          HG23      ILE  62  30.688 -21.283   8.212
  437   1HD1  ILE  62          HD11      ILE  62  32.750 -19.108   7.261
  438   2HD1  ILE  62          HD12      ILE  62  33.298 -18.432   8.801
  439   3HD1  ILE  62          HD13      ILE  62  32.622 -20.065   8.755
  440    HA   PRO  63           HA       PRO  63  26.615 -21.496   5.302
  441   1HB   PRO  63          HB2       PRO  63  24.347 -20.039   5.143
  442   2HB   PRO  63          HB3       PRO  63  25.131 -20.342   6.715
  443   1HG   PRO  63          HG2       PRO  63  25.451 -17.878   4.956
  444   2HG   PRO  63          HG3       PRO  63  24.999 -17.938   6.692
  445   1HD   PRO  63          HD2       PRO  63  27.559 -17.559   5.872
  446   2HD   PRO  63          HD3       PRO  63  27.158 -18.482   7.351
  447    H    ASP  64           H        ASP  64  28.529 -20.531   3.475
  448    HA   ASP  64           HA       ASP  64  29.055 -19.918   1.396
  449   1HB   ASP  64          HB2       ASP  64  27.804 -22.023   0.884
  450   2HB   ASP  64          HB3       ASP  64  26.368 -21.049   0.542
  451    H    ASN  65           H        ASN  65  27.932 -18.049   3.051
  452    HA   ASN  65           HA       ASN  65  27.081 -16.037   3.364
  453   1HB   ASN  65          HB2       ASN  65  28.608 -15.323   1.620
  454   2HB   ASN  65          HB3       ASN  65  27.394 -15.663   0.395
  455   1HD2  ASN  65          HD22      ASN  65  25.742 -14.221   3.096
  456   2HD2  ASN  65          HD21      ASN  65  25.814 -12.603   2.461
  457    H    LEU  66           H        LEU  66  25.361 -17.482   0.543
  458    HA   LEU  66           HA       LEU  66  22.789 -16.750   1.838
  459   1HB   LEU  66          HB2       LEU  66  23.316 -16.518  -1.155
  460   2HB   LEU  66          HB3       LEU  66  21.825 -16.190  -0.303
  461    HG   LEU  66           HG       LEU  66  23.462 -14.374   0.934
  462   1HD1  LEU  66          HD11      LEU  66  25.374 -15.005  -0.605
  463   2HD1  LEU  66          HD12      LEU  66  24.410 -14.440  -1.970
  464   3HD1  LEU  66          HD13      LEU  66  24.905 -13.300  -0.704
  465   1HD2  LEU  66          HD21      LEU  66  21.970 -13.951  -1.688
  466   2HD2  LEU  66          HD22      LEU  66  21.297 -13.819  -0.052
  467   3HD2  LEU  66          HD23      LEU  66  22.516 -12.663  -0.587
  468    H    SER  67           H        SER  67  21.162 -18.389   1.477
  469    HA   SER  67           HA       SER  67  22.282 -20.887   0.345
  470   1HB   SER  67          HB2       SER  67  20.254 -21.672   1.958
  471   2HB   SER  67          HB3       SER  67  21.955 -21.543   2.417
  472    HG   SER  67           HG       SER  67  20.593 -20.526   3.914
  473    HA   PRO  68           HA       PRO  68  18.125 -20.751  -1.798
  474   1HB   PRO  68          HB2       PRO  68  16.019 -19.220  -1.055
  475   2HB   PRO  68          HB3       PRO  68  16.510 -20.660  -0.116
  476   1HG   PRO  68          HG2       PRO  68  17.121 -17.769   0.499
  477   2HG   PRO  68          HG3       PRO  68  16.576 -19.043   1.620
  478   1HD   PRO  68          HD2       PRO  68  19.214 -18.355   1.334
  479   2HD   PRO  68          HD3       PRO  68  18.632 -19.974   1.813
  480    H    PHE  69           H        PHE  69  18.785 -17.393  -0.738
  481    HA   PHE  69           HA       PHE  69  17.576 -16.067  -2.843
  482   1HB   PHE  69          HB2       PHE  69  19.824 -15.337  -0.957
  483   2HB   PHE  69          HB3       PHE  69  19.284 -14.218  -2.188
  484    HD1  PHE  69           HD1      PHE  69  17.068 -13.157  -2.101
  485    HD2  PHE  69           HD2      PHE  69  18.395 -15.840   1.004
  486    HE1  PHE  69           HE1      PHE  69  15.208 -12.407  -0.649
  487    HE2  PHE  69           HE2      PHE  69  16.546 -15.080   2.453
  488    HZ   PHE  69           HZ       PHE  69  14.939 -13.376   1.637
  489    H    TYR  70           H        TYR  70  21.093 -16.872  -2.592
  490    HA   TYR  70           HA       TYR  70  21.733 -15.622  -5.050
  491   1HB   TYR  70          HB2       TYR  70  23.418 -16.123  -3.369
  492   2HB   TYR  70          HB3       TYR  70  23.196 -17.847  -3.634
  493    HD1  TYR  70           HD1      TYR  70  24.581 -18.940  -5.248
  494    HD2  TYR  70           HD2      TYR  70  24.031 -14.663  -5.471
  495    HE1  TYR  70           HE1      TYR  70  26.205 -18.829  -7.114
  496    HE2  TYR  70           HE2      TYR  70  25.635 -14.547  -7.343
  497    HH   TYR  70           HH       TYR  70  27.050 -15.752  -8.767
  498    H    GLU  71           H        GLU  71  20.899 -19.072  -4.350
  499    HA   GLU  71           HA       GLU  71  21.267 -19.947  -7.037
  500   1HB   GLU  71          HB2       GLU  71  19.381 -21.073  -4.920
  501   2HB   GLU  71          HB3       GLU  71  19.927 -21.884  -6.398
  502   1HG   GLU  71          HG2       GLU  71  22.313 -21.481  -5.486
  503   2HG   GLU  71          HG3       GLU  71  21.555 -21.136  -3.943
  504    H    ALA  72           H        ALA  72  18.326 -18.782  -5.289
  505    HA   ALA  72           HA       ALA  72  16.552 -19.088  -7.473
  506   1HB   ALA  72          HB1       ALA  72  15.833 -18.761  -5.125
  507   2HB   ALA  72          HB2       ALA  72  16.441 -17.087  -5.183
  508   3HB   ALA  72          HB3       ALA  72  15.086 -17.583  -6.222
  509    H    LEU  73           H        LEU  73  18.821 -16.387  -6.746
  510    HA   LEU  73           HA       LEU  73  17.754 -14.574  -8.687
  511   1HB   LEU  73          HB2       LEU  73  20.526 -15.026  -7.505
  512   2HB   LEU  73          HB3       LEU  73  20.260 -13.893  -8.789
  513    HG   LEU  73           HG       LEU  73  19.046 -13.795  -5.999
  514   1HD1  LEU  73          HD11      LEU  73  21.047 -11.979  -7.407
  515   2HD1  LEU  73          HD12      LEU  73  20.429 -11.782  -5.752
  516   3HD1  LEU  73          HD13      LEU  73  21.429 -13.185  -6.160
  517   1HD2  LEU  73          HD21      LEU  73  18.180 -11.534  -6.653
  518   2HD2  LEU  73          HD22      LEU  73  18.595 -11.898  -8.346
  519   3HD2  LEU  73          HD23      LEU  73  17.362 -12.847  -7.482
  520    H    GLN  74           H        GLN  74  20.485 -16.905  -8.953
  521    HA   GLN  74           HA       GLN  74  20.784 -16.524 -11.747
  522   1HB   GLN  74          HB2       GLN  74  21.509 -19.109 -10.344
  523   2HB   GLN  74          HB3       GLN  74  22.205 -18.408 -11.807
  524   1HG   GLN  74          HG2       GLN  74  22.768 -16.380 -10.160
  525   2HG   GLN  74          HG3       GLN  74  22.572 -17.643  -8.940
  526   1HE2  GLN  74          HE21      GLN  74  24.500 -16.415 -11.574
  527   2HE2  GLN  74          HE22      GLN  74  25.876 -17.504 -11.384
  528    H    GLU  75           H        GLU  75  18.574 -18.538 -10.014
  529    HA   GLU  75           HA       GLU  75  18.005 -20.381 -12.049
  530   1HB   GLU  75          HB2       GLU  75  17.413 -20.624  -9.653
  531   2HB   GLU  75          HB3       GLU  75  16.146 -19.414  -9.866
  532   1HG   GLU  75          HG2       GLU  75  14.948 -20.890 -11.415
  533   2HG   GLU  75          HG3       GLU  75  16.278 -22.053 -11.377
  534    H    GLN  76           H        GLN  76  16.772 -17.141 -11.534
  535    HA   GLN  76           HA       GLN  76  15.069 -17.400 -13.983
  536   1HB   GLN  76          HB2       GLN  76  13.650 -15.582 -12.887
  537   2HB   GLN  76          HB3       GLN  76  13.477 -17.236 -12.313
  538   1HG   GLN  76          HG2       GLN  76  14.444 -16.831 -10.274
  539   2HG   GLN  76          HG3       GLN  76  15.444 -15.502 -10.856
  540   1HE2  GLN  76          HE22      GLN  76  14.663 -14.662  -8.701
  541   2HE2  GLN  76          HE21      GLN  76  13.271 -13.589  -8.769
  542    H    LYS  77           H        LYS  77  17.531 -15.483 -12.425
  543    HA   LYS  77           HA       LYS  77  18.250 -13.331 -12.736
  544   1HB   LYS  77          HB2       LYS  77  18.680 -14.627 -15.420
  545   2HB   LYS  77          HB3       LYS  77  19.430 -13.098 -14.925
  546   1HG   LYS  77          HG2       LYS  77  20.453 -14.182 -13.007
  547   2HG   LYS  77          HG3       LYS  77  19.694 -15.721 -13.416
  548   1HD   LYS  77          HD2       LYS  77  21.683 -14.307 -15.219
  549   2HD   LYS  77          HD3       LYS  77  22.124 -15.535 -14.017
  550   1HE   LYS  77          HE2       LYS  77  20.614 -17.137 -15.142
  551   2HE   LYS  77          HE3       LYS  77  20.198 -15.925 -16.359
  552   1HZ   LYS  77          HZ1       LYS  77  22.530 -15.913 -17.044
  553   2HZ   LYS  77          HZ2       LYS  77  22.910 -17.047 -15.926
  554   3HZ   LYS  77          HZ3       LYS  77  21.914 -17.414 -17.161
  555    HA   PRO  78           HA       PRO  78  14.155 -12.002 -14.446
  556   1HB   PRO  78          HB2       PRO  78  13.718  -9.974 -12.513
  557   2HB   PRO  78          HB3       PRO  78  13.069 -11.619 -12.527
  558   1HG   PRO  78          HG2       PRO  78  15.444 -10.528 -11.045
  559   2HG   PRO  78          HG3       PRO  78  14.301 -11.794 -10.522
  560   1HD   PRO  78          HD2       PRO  78  16.823 -12.322 -11.448
  561   2HD   PRO  78          HD3       PRO  78  15.453 -13.435 -11.729
  562    H    ASP  79           H        ASP  79  13.347  -9.975 -15.295
  563    HA   ASP  79           HA       ASP  79  15.526  -8.483 -16.565
  564   1HB   ASP  79          HB2       ASP  79  13.661  -9.286 -17.924
  565   2HB   ASP  79          HB3       ASP  79  12.517  -8.340 -16.966
  566    H    LEU  80           H        LEU  80  16.061  -7.795 -14.313
  567    HA   LEU  80           HA       LEU  80  14.475  -5.810 -12.950
  568   1HB   LEU  80          HB2       LEU  80  17.392  -6.567 -12.655
  569   2HB   LEU  80          HB3       LEU  80  16.496  -5.584 -11.520
  570    HG   LEU  80           HG       LEU  80  16.170  -8.536 -12.036
  571   1HD1  LEU  80          HD11      LEU  80  16.695  -6.988  -9.465
  572   2HD1  LEU  80          HD12      LEU  80  16.701  -8.750  -9.686
  573   3HD1  LEU  80          HD13      LEU  80  17.961  -7.765 -10.454
  574   1HD2  LEU  80          HD21      LEU  80  14.358  -8.515 -10.326
  575   2HD2  LEU  80          HD22      LEU  80  14.369  -6.745 -10.359
  576   3HD2  LEU  80          HD23      LEU  80  13.907  -7.680 -11.807
  577    H    SER  81           H        SER  81  15.699  -5.239 -15.841
  578    HA   SER  81           HA       SER  81  17.473  -3.125 -15.792
  579   1HB   SER  81          HB2       SER  81  15.317  -3.894 -17.809
  580   2HB   SER  81          HB3       SER  81  16.905  -3.196 -18.109
  581    HG   SER  81           HG       SER  81  16.186  -5.750 -18.004
  582    H    ALA  82           H        ALA  82  14.287  -3.182 -14.696
  583    HA   ALA  82           HA       ALA  82  13.818  -0.292 -15.279
  584   1HB   ALA  82          HB1       ALA  82  11.417  -0.781 -15.095
  585   2HB   ALA  82          HB2       ALA  82  12.160  -1.754 -16.377
  586   3HB   ALA  82          HB3       ALA  82  11.771  -2.498 -14.810
  587    H    VAL  83           H        VAL  83  15.142  -2.134 -12.957
  588    HA   VAL  83           HA       VAL  83  14.094  -0.284 -10.888
  589    HB   VAL  83           HB       VAL  83  12.988  -2.219 -10.335
  590   1HG1  VAL  83          HG11      VAL  83  15.516  -3.850 -10.592
  591   2HG1  VAL  83          HG12      VAL  83  13.957  -4.450  -9.979
  592   3HG1  VAL  83          HG13      VAL  83  14.096  -3.930 -11.661
  593   1HG2  VAL  83          HG21      VAL  83  14.381  -1.170  -8.415
  594   2HG2  VAL  83          HG22      VAL  83  13.569  -2.710  -8.201
  595   3HG2  VAL  83          HG23      VAL  83  15.321  -2.660  -8.499
  596    H    ARG  84           H        ARG  84  15.514   0.363  -9.267
  597    HA   ARG  84           HA       ARG  84  18.387   0.094 -10.000
  598   1HB   ARG  84          HB2       ARG  84  18.829   2.071  -8.934
  599   2HB   ARG  84          HB3       ARG  84  17.302   2.404  -9.739
  600   1HG   ARG  84          HG2       ARG  84  16.185   1.835  -7.468
  601   2HG   ARG  84          HG3       ARG  84  17.814   1.902  -6.776
  602   1HD   ARG  84          HD2       ARG  84  16.196   4.113  -8.042
  603   2HD   ARG  84          HD3       ARG  84  16.854   4.050  -6.400
  604    HE   ARG  84           HE       ARG  84  19.146   4.091  -7.551
  605   1HH1  ARG  84          HH11      ARG  84  16.337   5.908  -8.804
  606   2HH1  ARG  84          HH12      ARG  84  17.250   6.775  -9.978
  607   1HH2  ARG  84          HH21      ARG  84  20.279   5.083  -9.210
  608   2HH2  ARG  84          HH22      ARG  84  19.599   6.401 -10.134
  609    H    PHE  85           H        PHE  85  19.871  -0.448  -8.347
  610    HA   PHE  85           HA       PHE  85  18.751  -2.103  -6.118
  611   1HB   PHE  85          HB2       PHE  85  19.548  -3.685  -7.582
  612   2HB   PHE  85          HB3       PHE  85  20.813  -2.644  -8.227
  613    HD1  PHE  85           HD1      PHE  85  22.879  -3.610  -7.951
  614    HD2  PHE  85           HD2      PHE  85  20.003  -3.954  -4.753
  615    HE1  PHE  85           HE1      PHE  85  24.580  -4.731  -6.543
  616    HE2  PHE  85           HE2      PHE  85  21.725  -5.041  -3.341
  617    HZ   PHE  85           HZ       PHE  85  23.995  -5.459  -4.231
  618    H    GLY  86           H        GLY  86  19.830  -1.769  -4.115
  619   1HA   GLY  86          HA2       GLY  86  22.278  -0.076  -4.123
  620   2HA   GLY  86          HA3       GLY  86  20.946   0.295  -3.028
  621    H    ALA  87           H        ALA  87  23.794  -1.412  -3.339
  622    HA   ALA  87           HA       ALA  87  23.281  -3.663  -1.532
  623   1HB   ALA  87          HB1       ALA  87  25.815  -2.237  -2.517
  624   2HB   ALA  87          HB2       ALA  87  25.823  -3.651  -1.470
  625   3HB   ALA  87          HB3       ALA  87  25.176  -3.781  -3.117
  626    H    ILE  88           H        ILE  88  23.471  -3.521   0.753
  627    HA   ILE  88           HA       ILE  88  24.540  -0.985   1.889
  628    HB   ILE  88           HB       ILE  88  22.032  -2.415   2.847
  629   1HG1  ILE  88          HG12      ILE  88  22.287   0.071   1.118
  630   2HG1  ILE  88          HG13      ILE  88  21.430  -1.418   0.761
  631   1HG2  ILE  88          HG21      ILE  88  23.256  -1.339   4.649
  632   2HG2  ILE  88          HG22      ILE  88  23.413   0.156   3.712
  633   3HG2  ILE  88          HG23      ILE  88  21.837  -0.377   4.308
  634   1HD1  ILE  88          HD11      ILE  88  19.865   0.315   1.251
  635   2HD1  ILE  88          HD12      ILE  88  19.777  -0.888   2.550
  636   3HD1  ILE  88          HD13      ILE  88  20.602   0.670   2.806
  637    H    GLY  89           H        GLY  89  26.062  -1.404   3.407
  638   1HA   GLY  89          HA2       GLY  89  27.226  -2.416   5.095
  639   2HA   GLY  89          HA3       GLY  89  25.888  -3.553   5.312
  640    H    ILE  90           H        ILE  90  26.419  -4.092   2.217
  641    HA   ILE  90           HA       ILE  90  27.546  -6.575   2.359
  642    HB   ILE  90           HB       ILE  90  27.348  -4.545   0.123
  643   1HG1  ILE  90          HG12      ILE  90  25.730  -6.884   1.104
  644   2HG1  ILE  90          HG13      ILE  90  25.213  -5.249   0.757
  645   1HG2  ILE  90          HG21      ILE  90  28.231  -7.413  -0.258
  646   2HG2  ILE  90          HG22      ILE  90  27.859  -6.238  -1.532
  647   3HG2  ILE  90          HG23      ILE  90  29.232  -5.955  -0.490
  648   1HD1  ILE  90          HD11      ILE  90  24.227  -6.725  -0.844
  649   2HD1  ILE  90          HD12      ILE  90  25.484  -5.841  -1.725
  650   3HD1  ILE  90          HD13      ILE  90  25.773  -7.508  -1.199
  651    H    GLY  91           H        GLY  91  29.542  -7.490   2.433
  652   1HA   GLY  91          HA2       GLY  91  31.726  -5.779   3.315
  653   2HA   GLY  91          HA3       GLY  91  31.647  -7.546   3.328
  654    H    SER  92           H        SER  92  30.706  -7.467   0.465
  655    HA   SER  92           HA       SER  92  32.958  -8.125  -0.885
  656   1HB   SER  92          HB2       SER  92  30.430  -7.035  -2.111
  657   2HB   SER  92          HB3       SER  92  31.525  -8.251  -2.790
  658    HG   SER  92           HG       SER  92  30.331  -9.659  -1.803
  659    H    ARG  93           H        ARG  93  32.330  -4.916  -0.049
  660    HA   ARG  93           HA       ARG  93  33.482  -3.540  -2.315
  661   1HB   ARG  93          HB2       ARG  93  32.131  -2.570  -0.322
  662   2HB   ARG  93          HB3       ARG  93  33.622  -2.701   0.616
  663   1HG   ARG  93          HG2       ARG  93  34.741  -1.203  -1.116
  664   2HG   ARG  93          HG3       ARG  93  33.178  -1.076  -1.932
  665   1HD   ARG  93          HD2       ARG  93  32.227  -0.185   0.255
  666   2HD   ARG  93          HD3       ARG  93  33.871  -0.134   0.892
  667    HE   ARG  93           HE       ARG  93  32.615   1.615  -1.126
  668   1HH1  ARG  93          HH11      ARG  93  35.687   0.815   0.498
  669   2HH1  ARG  93          HH12      ARG  93  36.458   2.269  -0.016
  670   1HH2  ARG  93          HH21      ARG  93  33.635   3.429  -1.865
  671   2HH2  ARG  93          HH22      ARG  93  35.268   3.804  -1.388
  672    H    GLU  94           H        GLU  94  34.721  -5.667   0.066
  673    HA   GLU  94           HA       GLU  94  36.696  -6.834  -0.086
  674   1HB   GLU  94          HB2       GLU  94  38.100  -4.322  -0.966
  675   2HB   GLU  94          HB3       GLU  94  38.842  -5.892  -0.709
  676   1HG   GLU  94          HG2       GLU  94  37.426  -6.898  -2.493
  677   2HG   GLU  94          HG3       GLU  94  36.764  -5.309  -2.866
  678    H    TYR  95           H        TYR  95  36.133  -3.723   1.266
  679    HA   TYR  95           HA       TYR  95  37.988  -3.677   3.392
  680   1HB   TYR  95          HB2       TYR  95  35.284  -2.384   2.914
  681   2HB   TYR  95          HB3       TYR  95  36.184  -2.122   4.392
  682    HD1  TYR  95           HD1      TYR  95  36.633  -1.876   0.634
  683    HD2  TYR  95           HD2      TYR  95  37.821  -0.446   4.534
  684    HE1  TYR  95           HE1      TYR  95  38.076  -0.187  -0.430
  685    HE2  TYR  95           HE2      TYR  95  39.232   1.279   3.472
  686    HH   TYR  95           HH       TYR  95  40.002   2.187   1.464
  687    H    ASP  96           H        ASP  96  35.239  -5.788   3.011
  688    HA   ASP  96           HA       ASP  96  35.876  -6.941   5.645
  689   1HB   ASP  96          HB2       ASP  96  34.003  -5.703   6.346
  690   2HB   ASP  96          HB3       ASP  96  33.112  -6.020   4.868
  691    H    THR  97           H        THR  97  37.020  -8.450   4.383
  692    HA   THR  97           HA       THR  97  35.421 -10.728   3.823
  693    HB   THR  97           HB       THR  97  35.229  -9.666   1.586
  694    HG1  THR  97           HG1      THR  97  36.123 -11.479   0.446
  695   1HG2  THR  97          HG21      THR  97  37.097  -9.339   0.131
  696   2HG2  THR  97          HG22      THR  97  37.497  -8.503   1.632
  697   3HG2  THR  97          HG23      THR  97  38.232 -10.076   1.284
  698    H    PHE  98           H        PHE  98  36.893 -12.566   3.317
  699    HA   PHE  98           HA       PHE  98  39.756 -12.228   3.735
  700   1HB   PHE  98          HB2       PHE  98  38.666 -12.580   6.036
  701   2HB   PHE  98          HB3       PHE  98  38.197 -14.180   5.482
  702    HD1  PHE  98           HD1      PHE  98  39.689 -15.974   5.962
  703    HD2  PHE  98           HD2      PHE  98  41.224 -11.943   5.795
  704    HE1  PHE  98           HE1      PHE  98  41.910 -16.785   6.717
  705    HE2  PHE  98           HE2      PHE  98  43.444 -12.761   6.545
  706    HZ   PHE  98           HZ       PHE  98  43.792 -15.183   7.006
  707    H    CYS  99           H        CYS  99  37.433 -13.166   1.767
  708    HA   CYS  99           HA       CYS  99  38.630 -15.773   0.973
  709   1HB   CYS  99          HB2       CYS  99  35.652 -15.144   1.235
  710   2HB   CYS  99          HB3       CYS  99  36.360 -16.675   0.703
  711    HG   CYS  99           HG       CYS  99  37.677 -17.164   2.926
  712    H    GLY 100           H        GLY 100  38.857 -12.982  -0.125
  713   1HA   GLY 100          HA2       GLY 100  39.241 -12.354  -2.374
  714   2HA   GLY 100          HA3       GLY 100  38.127 -13.601  -2.936
  715    H    ALA 101           H        ALA 101  37.458 -11.569  -4.222
  716    HA   ALA 101           HA       ALA 101  36.398  -9.300  -2.996
  717   1HB   ALA 101          HB1       ALA 101  37.063  -9.418  -5.368
  718   2HB   ALA 101          HB2       ALA 101  35.674 -10.480  -5.714
  719   3HB   ALA 101          HB3       ALA 101  35.409  -8.803  -5.196
  720    H    ILE 102           H        ILE 102  34.789 -12.382  -3.509
  721    HA   ILE 102           HA       ILE 102  32.662 -13.092  -3.374
  722    HB   ILE 102           HB       ILE 102  31.661 -12.841  -1.162
  723   1HG1  ILE 102          HG12      ILE 102  33.957 -10.975  -0.426
  724   2HG1  ILE 102          HG13      ILE 102  32.328 -10.420  -0.786
  725   1HG2  ILE 102          HG21      ILE 102  33.489 -14.466  -1.659
  726   2HG2  ILE 102          HG22      ILE 102  34.668 -13.300  -1.021
  727   3HG2  ILE 102          HG23      ILE 102  33.424 -13.985   0.037
  728   1HD1  ILE 102          HD11      ILE 102  31.441 -11.822   1.074
  729   2HD1  ILE 102          HD12      ILE 102  33.119 -12.244   1.501
  730   3HD1  ILE 102          HD13      ILE 102  32.575 -10.558   1.592
  731    H    ASP 103           H        ASP 103  32.721 -10.848  -5.078
  732    HA   ASP 103           HA       ASP 103  30.454  -9.138  -4.439
  733   1HB   ASP 103          HB2       ASP 103  31.083  -7.847  -6.235
  734   2HB   ASP 103          HB3       ASP 103  32.626  -8.467  -5.669
  735    H    LYS 104           H        LYS 104  30.447 -12.248  -5.441
  736    HA   LYS 104           HA       LYS 104  29.096 -12.392  -7.847
  737   1HB   LYS 104          HB2       LYS 104  28.836 -14.242  -5.441
  738   2HB   LYS 104          HB3       LYS 104  28.281 -14.619  -7.073
  739   1HG   LYS 104          HG2       LYS 104  30.596 -14.361  -7.890
  740   2HG   LYS 104          HG3       LYS 104  31.159 -14.070  -6.234
  741   1HD   LYS 104          HD2       LYS 104  30.320 -16.310  -5.559
  742   2HD   LYS 104          HD3       LYS 104  29.769 -16.604  -7.225
  743   1HE   LYS 104          HE2       LYS 104  32.105 -16.349  -8.037
  744   2HE   LYS 104          HE3       LYS 104  32.654 -16.061  -6.380
  745   1HZ   LYS 104          HZ1       LYS 104  31.414 -18.572  -7.353
  746   2HZ   LYS 104          HZ2       LYS 104  32.997 -18.355  -7.040
  747   3HZ   LYS 104          HZ3       LYS 104  31.920 -18.309  -5.821
  748    H    LEU 105           H        LEU 105  27.607 -11.840  -4.639
  749    HA   LEU 105           HA       LEU 105  24.919 -12.243  -5.463
  750   1HB   LEU 105          HB2       LEU 105  25.686 -12.178  -3.127
  751   2HB   LEU 105          HB3       LEU 105  26.094 -10.479  -3.260
  752    HG   LEU 105           HG       LEU 105  24.005 -11.014  -2.025
  753   1HD1  LEU 105          HD11      LEU 105  24.392  -8.759  -3.085
  754   2HD1  LEU 105          HD12      LEU 105  23.356  -9.285  -4.431
  755   3HD1  LEU 105          HD13      LEU 105  22.697  -9.185  -2.799
  756   1HD2  LEU 105          HD21      LEU 105  21.962 -11.642  -3.161
  757   2HD2  LEU 105          HD22      LEU 105  22.776 -11.650  -4.735
  758   3HD2  LEU 105          HD23      LEU 105  23.201 -12.861  -3.507
  759    H    GLU 106           H        GLU 106  26.846  -9.202  -5.187
  760    HA   GLU 106           HA       GLU 106  24.848  -7.474  -6.247
  761   1HB   GLU 106          HB2       GLU 106  27.877  -7.153  -6.511
  762   2HB   GLU 106          HB3       GLU 106  26.665  -5.886  -6.586
  763   1HG   GLU 106          HG2       GLU 106  26.148  -6.236  -4.183
  764   2HG   GLU 106          HG3       GLU 106  27.367  -7.511  -4.102
  765    H    ALA 107           H        ALA 107  27.479  -9.393  -7.738
  766    HA   ALA 107           HA       ALA 107  27.352  -8.282 -10.319
  767   1HB   ALA 107          HB1       ALA 107  28.093 -11.140  -9.547
  768   2HB   ALA 107          HB2       ALA 107  28.519 -10.304 -11.048
  769   3HB   ALA 107          HB3       ALA 107  29.195  -9.744  -9.507
  770    H    GLU 108           H        GLU 108  25.608 -11.203  -8.955
  771    HA   GLU 108           HA       GLU 108  24.311 -11.698 -11.441
  772   1HB   GLU 108          HB2       GLU 108  23.861 -12.644  -8.613
  773   2HB   GLU 108          HB3       GLU 108  22.800 -13.109  -9.935
  774   1HG   GLU 108          HG2       GLU 108  25.786 -13.656  -9.765
  775   2HG   GLU 108          HG3       GLU 108  24.474 -14.828  -9.625
  776    H    LEU 109           H        LEU 109  23.402  -9.574  -8.730
  777    HA   LEU 109           HA       LEU 109  20.695  -9.139  -9.656
  778   1HB   LEU 109          HB2       LEU 109  22.643  -7.501  -7.977
  779   2HB   LEU 109          HB3       LEU 109  21.028  -6.916  -8.366
  780    HG   LEU 109           HG       LEU 109  21.577  -9.540  -6.912
  781   1HD1  LEU 109          HD11      LEU 109  22.313  -7.538  -5.620
  782   2HD1  LEU 109          HD12      LEU 109  20.678  -6.866  -5.768
  783   3HD1  LEU 109          HD13      LEU 109  20.949  -8.381  -4.874
  784   1HD2  LEU 109          HD21      LEU 109  19.376  -9.551  -7.999
  785   2HD2  LEU 109          HD22      LEU 109  19.172  -9.334  -6.260
  786   3HD2  LEU 109          HD23      LEU 109  19.013  -7.939  -7.349
  787    H    LYS 110           H        LYS 110  23.814  -7.472 -10.333
  788    HA   LYS 110           HA       LYS 110  22.653  -5.507 -12.059
  789   1HB   LYS 110          HB2       LYS 110  25.497  -6.574 -11.764
  790   2HB   LYS 110          HB3       LYS 110  25.061  -5.103 -12.647
  791   1HG   LYS 110          HG2       LYS 110  24.315  -3.993 -10.659
  792   2HG   LYS 110          HG3       LYS 110  24.256  -5.446  -9.723
  793   1HD   LYS 110          HD2       LYS 110  26.129  -4.438  -8.890
  794   2HD   LYS 110          HD3       LYS 110  26.791  -5.653  -9.975
  795   1HE   LYS 110          HE2       LYS 110  27.252  -3.975 -11.689
  796   2HE   LYS 110          HE3       LYS 110  26.356  -2.745 -10.788
  797   1HZ   LYS 110          HZ1       LYS 110  28.880  -4.005  -9.892
  798   2HZ   LYS 110          HZ2       LYS 110  28.709  -2.476 -10.430
  799   3HZ   LYS 110          HZ3       LYS 110  28.009  -2.925  -9.014
  800    H    ASN 111           H        ASN 111  24.029  -8.740 -12.605
  801    HA   ASN 111           HA       ASN 111  23.873  -8.753 -15.460
  802   1HB   ASN 111          HB2       ASN 111  25.207 -10.417 -14.850
  803   2HB   ASN 111          HB3       ASN 111  24.590 -10.536 -13.259
  804   1HD2  ASN 111          HD22      ASN 111  22.608 -11.796 -12.804
  805   2HD2  ASN 111          HD21      ASN 111  22.852 -13.367 -13.492
  806    H    SER 112           H        SER 112  21.533  -9.502 -12.887
  807    HA   SER 112           HA       SER 112  19.491 -10.524 -14.632
  808   1HB   SER 112          HB2       SER 112  19.243  -9.152 -11.950
  809   2HB   SER 112          HB3       SER 112  17.974 -10.059 -12.761
  810    HG   SER 112           HG       SER 112  20.445 -11.031 -11.768
  811    H    GLY 113           H        GLY 113  20.314  -7.254 -13.349
  812   1HA   GLY 113          HA2       GLY 113  20.266  -5.863 -15.603
  813   2HA   GLY 113          HA3       GLY 113  18.528  -5.968 -15.333
  814    H    ALA 114           H        ALA 114  19.420  -5.778 -12.189
  815    HA   ALA 114           HA       ALA 114  18.392  -3.147 -12.137
  816   1HB   ALA 114          HB1       ALA 114  19.775  -4.640  -9.873
  817   2HB   ALA 114          HB2       ALA 114  18.718  -3.205  -9.739
  818   3HB   ALA 114          HB3       ALA 114  18.041  -4.740 -10.268
  819    H    LYS 115           H        LYS 115  19.320  -1.118 -11.742
  820    HA   LYS 115           HA       LYS 115  22.196  -0.981 -12.415
  821   1HB   LYS 115          HB2       LYS 115  21.805   1.461 -12.555
  822   2HB   LYS 115          HB3       LYS 115  20.895   0.483 -13.700
  823   1HG   LYS 115          HG2       LYS 115  18.852   0.737 -12.253
  824   2HG   LYS 115          HG3       LYS 115  19.757   1.809 -11.201
  825   1HD   LYS 115          HD2       LYS 115  19.318   2.281 -14.188
  826   2HD   LYS 115          HD3       LYS 115  18.261   2.907 -12.906
  827   1HE   LYS 115          HE2       LYS 115  20.202   3.983 -11.842
  828   2HE   LYS 115          HE3       LYS 115  21.243   3.487 -13.185
  829   1HZ   LYS 115          HZ1       LYS 115  19.855   4.801 -14.681
  830   2HZ   LYS 115          HZ2       LYS 115  18.902   5.295 -13.450
  831   3HZ   LYS 115          HZ3       LYS 115  20.468   5.750 -13.513
  832    H    GLN 116           H        GLN 116  23.586  -1.216 -10.753
  833    HA   GLN 116           HA       GLN 116  22.858  -0.697  -8.011
  834   1HB   GLN 116          HB2       GLN 116  24.634  -2.291  -8.578
  835   2HB   GLN 116          HB3       GLN 116  25.612  -0.968  -9.229
  836   1HG   GLN 116          HG2       GLN 116  25.767   0.087  -7.033
  837   2HG   GLN 116          HG3       GLN 116  24.540  -1.001  -6.381
  838   1HE2  GLN 116          HE22      GLN 116  26.043  -1.522  -4.667
  839   2HE2  GLN 116          HE21      GLN 116  27.202  -2.802  -4.932
  840    H    THR 117           H        THR 117  22.410   1.324  -7.312
  841    HA   THR 117           HA       THR 117  23.501   3.674  -8.745
  842    HB   THR 117           HB       THR 117  21.621   3.467  -6.356
  843    HG1  THR 117           HG1      THR 117  21.034   2.518  -8.504
  844   1HG2  THR 117          HG21      THR 117  20.899   5.727  -7.037
  845   2HG2  THR 117          HG22      THR 117  22.623   5.755  -6.662
  846   3HG2  THR 117          HG23      THR 117  22.101   5.726  -8.355
  847    H    GLY 118           H        GLY 118  24.831   5.252  -7.687
  848   1HA   GLY 118          HA2       GLY 118  26.418   6.060  -6.252
  849   2HA   GLY 118          HA3       GLY 118  25.588   5.185  -4.970
  850    H    GLU 119           H        GLU 119  26.778   3.769  -3.966
  851    HA   GLU 119           HA       GLU 119  28.195   1.649  -5.254
  852   1HB   GLU 119          HB2       GLU 119  30.302   1.876  -4.095
  853   2HB   GLU 119          HB3       GLU 119  30.078   3.273  -5.141
  854   1HG   GLU 119          HG2       GLU 119  29.828   4.766  -3.379
  855   2HG   GLU 119          HG3       GLU 119  29.217   3.528  -2.288
  856    H    THR 120           H        THR 120  29.098   0.306  -3.195
  857    HA   THR 120           HA       THR 120  27.155  -0.635  -1.558
  858    HB   THR 120           HB       THR 120  30.083  -0.200  -0.844
  859    HG1  THR 120           HG1      THR 120  30.415  -2.105  -1.984
  860   1HG2  THR 120          HG21      THR 120  28.056  -2.305   0.024
  861   2HG2  THR 120          HG22      THR 120  29.806  -2.375   0.352
  862   3HG2  THR 120          HG23      THR 120  28.830  -1.076   1.047
  863    H    LEU 121           H        LEU 121  25.787   0.376  -0.179
  864    HA   LEU 121           HA       LEU 121  26.515   2.869   1.176
  865   1HB   LEU 121          HB2       LEU 121  24.167   2.101   0.232
  866   2HB   LEU 121          HB3       LEU 121  24.070   1.179   1.712
  867    HG   LEU 121           HG       LEU 121  24.910   3.841   2.433
  868   1HD1  LEU 121          HD11      LEU 121  22.406   3.813   0.689
  869   2HD1  LEU 121          HD12      LEU 121  23.027   5.190   1.622
  870   3HD1  LEU 121          HD13      LEU 121  23.956   4.565   0.253
  871   1HD2  LEU 121          HD21      LEU 121  22.237   2.476   2.877
  872   2HD2  LEU 121          HD22      LEU 121  23.673   2.368   3.929
  873   3HD2  LEU 121          HD23      LEU 121  22.858   3.909   3.727
  874    H    LYS 122           H        LYS 122  26.224   2.897   3.635
  875    HA   LYS 122           HA       LYS 122  27.380   0.415   4.826
  876   1HB   LYS 122          HB2       LYS 122  28.441   3.276   4.951
  877   2HB   LYS 122          HB3       LYS 122  29.024   1.969   5.976
  878   1HG   LYS 122          HG2       LYS 122  29.849   0.750   4.056
  879   2HG   LYS 122          HG3       LYS 122  29.070   1.854   2.932
  880   1HD   LYS 122          HD2       LYS 122  30.540   3.726   3.900
  881   2HD   LYS 122          HD3       LYS 122  31.464   2.447   4.689
  882   1HE   LYS 122          HE2       LYS 122  32.563   2.973   2.606
  883   2HE   LYS 122          HE3       LYS 122  31.826   1.377   2.427
  884   1HZ   LYS 122          HZ1       LYS 122  31.401   2.833   0.470
  885   2HZ   LYS 122          HZ2       LYS 122  30.005   2.431   1.174
  886   3HZ   LYS 122          HZ3       LYS 122  30.658   3.916   1.424
  887    H    ILE 123           H        ILE 123  26.910   0.207   7.006
  888    HA   ILE 123           HA       ILE 123  25.263   2.307   8.306
  889    HB   ILE 123           HB       ILE 123  23.944   0.717   9.453
  890   1HG1  ILE 123          HG12      ILE 123  25.684  -1.179   9.465
  891   2HG1  ILE 123          HG13      ILE 123  23.997  -1.566   9.423
  892   1HG2  ILE 123          HG21      ILE 123  23.125   1.584   7.334
  893   2HG2  ILE 123          HG22      ILE 123  23.838   0.228   6.449
  894   3HG2  ILE 123          HG23      ILE 123  22.523  -0.055   7.593
  895   1HD1  ILE 123          HD11      ILE 123  25.310  -3.026   7.958
  896   2HD1  ILE 123          HD12      ILE 123  24.109  -2.120   7.033
  897   3HD1  ILE 123          HD13      ILE 123  25.824  -1.631   6.993
  898    H    ASN 124           H        ASN 124  25.642   2.347  10.680
  899    HA   ASN 124           HA       ASN 124  27.980   1.003  11.717
  900   1HB   ASN 124          HB2       ASN 124  28.444   3.309  10.090
  901   2HB   ASN 124          HB3       ASN 124  28.650   3.877  11.729
  902   1HD2  ASN 124          HD22      ASN 124  29.391   0.906   9.810
  903   2HD2  ASN 124          HD21      ASN 124  31.027   0.713  10.437
  904    H    ILE 125           H        ILE 125  25.648   0.711  12.777
  905    HA   ILE 125           HA       ILE 125  25.381   2.679  14.986
  906    HB   ILE 125           HB       ILE 125  23.853   3.207  13.107
  907   1HG1  ILE 125          HG12      ILE 125  22.460   2.312  15.656
  908   2HG1  ILE 125          HG13      ILE 125  23.328   3.824  15.410
  909   1HG2  ILE 125          HG21      ILE 125  21.991   1.787  12.479
  910   2HG2  ILE 125          HG22      ILE 125  23.478   0.879  12.256
  911   3HG2  ILE 125          HG23      ILE 125  22.457   0.557  13.669
  912   1HD1  ILE 125          HD11      ILE 125  21.692   4.436  13.608
  913   2HD1  ILE 125          HD12      ILE 125  20.759   2.972  14.015
  914   3HD1  ILE 125          HD13      ILE 125  20.967   4.252  15.218
  915    H    LEU 126           H        LEU 126  24.605   1.873  16.879
  916    HA   LEU 126           HA       LEU 126  24.364   0.570  18.614
  917   1HB   LEU 126          HB2       LEU 126  22.308  -0.109  17.549
  918   2HB   LEU 126          HB3       LEU 126  23.132  -1.378  16.646
  919    HG   LEU 126           HG       LEU 126  23.660  -2.569  18.755
  920   1HD1  LEU 126          HD11      LEU 126  22.023  -0.360  20.087
  921   2HD1  LEU 126          HD12      LEU 126  22.514  -1.881  20.864
  922   3HD1  LEU 126          HD13      LEU 126  23.742  -0.717  20.371
  923   1HD2  LEU 126          HD21      LEU 126  21.364  -3.304  19.241
  924   2HD2  LEU 126          HD22      LEU 126  20.713  -1.859  18.433
  925   3HD2  LEU 126          HD23      LEU 126  21.597  -3.082  17.502
  926    H    ASP 127           H        ASP 127  25.429  -1.750  16.104
  927    HA   ASP 127           HA       ASP 127  27.947  -2.307  17.525
  928   1HB   ASP 127          HB2       ASP 127  26.256  -3.774  18.635
  929   2HB   ASP 127          HB3       ASP 127  25.831  -4.453  17.065
  930    H    HIS 128           H        HIS 128  26.189  -1.897  14.677
  931    HA   HIS 128           HA       HIS 128  27.504  -3.948  13.077
  932   1HB   HIS 128          HB2       HIS 128  25.487  -1.821  12.243
  933   2HB   HIS 128          HB3       HIS 128  25.895  -3.304  11.377
  934    HD1  HIS 128           HD1      HIS 128  23.760  -2.035  14.249
  935    HD2  HIS 128           HD2      HIS 128  24.990  -5.676  12.530
  936    HE1  HIS 128           HE1      HIS 128  22.276  -3.859  15.268
  937    H    ASP 129           H        ASP 129  29.390  -2.408  14.049
  938    HA   ASP 129           HA       ASP 129  30.013   0.015  12.676
  939   1HB   ASP 129          HB2       ASP 129  31.758  -1.914  14.170
  940   2HB   ASP 129          HB3       ASP 129  32.249  -0.270  13.683
  941    H    ILE 130           H        ILE 130  30.581  -3.253  11.944
  942    HA   ILE 130           HA       ILE 130  32.572  -3.988  10.625
  943    HB   ILE 130           HB       ILE 130  29.788  -4.024   9.487
  944   1HG1  ILE 130          HG12      ILE 130  31.493  -6.211  10.663
  945   2HG1  ILE 130          HG13      ILE 130  30.385  -5.225  11.611
  946   1HG2  ILE 130          HG21      ILE 130  31.240  -4.221   7.494
  947   2HG2  ILE 130          HG22      ILE 130  32.192  -5.483   8.308
  948   3HG2  ILE 130          HG23      ILE 130  30.494  -5.755   7.860
  949   1HD1  ILE 130          HD11      ILE 130  29.291  -7.301  11.103
  950   2HD1  ILE 130          HD12      ILE 130  28.483  -6.010  10.192
  951   3HD1  ILE 130          HD13      ILE 130  29.599  -7.127   9.372
  952    HA   PRO 131           HA       PRO 131  33.007  -1.543   6.725
  953   1HB   PRO 131          HB2       PRO 131  31.334   0.355   5.768
  954   2HB   PRO 131          HB3       PRO 131  31.058  -1.398   5.563
  955   1HG   PRO 131          HG2       PRO 131  29.843   0.436   7.645
  956   2HG   PRO 131          HG3       PRO 131  29.017  -0.777   6.620
  957   1HD   PRO 131          HD2       PRO 131  29.773  -1.334   9.189
  958   2HD   PRO 131          HD3       PRO 131  29.817  -2.553   7.886
  959    H    GLU 132           H        GLU 132  31.371   1.373   8.068
  960    HA   GLU 132           HA       GLU 132  33.637   2.636   9.162
  961   1HB   GLU 132          HB2       GLU 132  34.237   2.461   6.586
  962   2HB   GLU 132          HB3       GLU 132  33.016   3.704   6.374
  963   1HG   GLU 132          HG2       GLU 132  34.292   5.207   7.883
  964   2HG   GLU 132          HG3       GLU 132  35.416   3.905   8.252
  965    H    ASP 133           H        ASP 133  33.096   4.867   9.734
  966    HA   ASP 133           HA       ASP 133  30.532   5.150  10.707
  967   1HB   ASP 133          HB2       ASP 133  32.483   6.151  11.701
  968   2HB   ASP 133          HB3       ASP 133  32.692   7.234  10.327
  969    HA   PRO 134           HA       PRO 134  29.696   8.704   7.441
  970   1HB   PRO 134          HB2       PRO 134  30.655   7.206   4.995
  971   2HB   PRO 134          HB3       PRO 134  30.573   8.979   5.262
  972   1HG   PRO 134          HG2       PRO 134  32.915   7.709   5.566
  973   2HG   PRO 134          HG3       PRO 134  32.396   8.880   6.827
  974   1HD   PRO 134          HD2       PRO 134  32.144   5.863   6.842
  975   2HD   PRO 134          HD3       PRO 134  32.741   6.955   8.126
  976    H    ALA 135           H        ALA 135  28.175   6.104   8.045
  977    HA   ALA 135           HA       ALA 135  26.600   5.158   5.955
  978   1HB   ALA 135          HB1       ALA 135  24.977   4.624   7.779
  979   2HB   ALA 135          HB2       ALA 135  26.652   4.216   8.226
  980   3HB   ALA 135          HB3       ALA 135  25.879   5.674   8.885
  981    H    GLU 136           H        GLU 136  25.898   7.985   8.080
  982    HA   GLU 136           HA       GLU 136  23.382   8.571   6.872
  983   1HB   GLU 136          HB2       GLU 136  24.070   9.245   9.147
  984   2HB   GLU 136          HB3       GLU 136  25.269  10.358   8.471
  985   1HG   GLU 136          HG2       GLU 136  23.491  11.688   7.422
  986   2HG   GLU 136          HG3       GLU 136  22.268  10.520   7.937
  987    H    GLU 137           H        GLU 137  26.703   9.657   6.157
  988    HA   GLU 137           HA       GLU 137  25.972  11.771   4.342
  989   1HB   GLU 137          HB2       GLU 137  28.528  10.108   4.508
  990   2HB   GLU 137          HB3       GLU 137  28.328  11.576   3.564
  991   1HG   GLU 137          HG2       GLU 137  28.140  11.388   6.605
  992   2HG   GLU 137          HG3       GLU 137  29.529  11.957   5.691
  993    H    TRP 138           H        TRP 138  26.708   8.265   3.940
  994    HA   TRP 138           HA       TRP 138  26.443   8.263   1.102
  995   1HB   TRP 138          HB2       TRP 138  26.572   6.208   3.250
  996   2HB   TRP 138          HB3       TRP 138  25.572   5.786   1.886
  997    HD1  TRP 138           HD1      TRP 138  26.651   4.641  -0.011
  998    HE1  TRP 138           HE1      TRP 138  28.996   4.258  -0.866
  999    HE3  TRP 138           HE3      TRP 138  29.104   7.918   3.049
 1000    HZ2  TRP 138           HZ2      TRP 138  31.642   5.512  -0.500
 1001    HZ3  TRP 138           HZ3      TRP 138  31.533   8.345   2.739
 1002    HH2  TRP 138           HH2      TRP 138  32.804   7.143   0.973
 1003    H    LEU 139           H        LEU 139  24.024   7.766   3.725
 1004    HA   LEU 139           HA       LEU 139  21.801   7.153   2.059
 1005   1HB   LEU 139          HB2       LEU 139  22.247   7.497   4.796
 1006   2HB   LEU 139          HB3       LEU 139  21.315   8.920   4.434
 1007    HG   LEU 139           HG       LEU 139  19.556   7.425   3.346
 1008   1HD1  LEU 139          HD11      LEU 139  21.212   5.250   4.720
 1009   2HD1  LEU 139          HD12      LEU 139  19.573   5.024   4.096
 1010   3HD1  LEU 139          HD13      LEU 139  20.889   5.375   2.976
 1011   1HD2  LEU 139          HD21      LEU 139  20.216   7.010   6.296
 1012   2HD2  LEU 139          HD22      LEU 139  19.303   8.369   5.606
 1013   3HD2  LEU 139          HD23      LEU 139  18.627   6.731   5.542
 1014    H    GLY 140           H        GLY 140  22.868  10.323   3.362
 1015   1HA   GLY 140          HA2       GLY 140  20.951  11.915   2.048
 1016   2HA   GLY 140          HA3       GLY 140  22.552  12.470   2.572
 1017    H    SER 141           H        SER 141  24.261  10.912   0.841
 1018    HA   SER 141           HA       SER 141  24.299  12.325  -1.543
 1019   1HB   SER 141          HB2       SER 141  25.442   9.695  -0.497
 1020   2HB   SER 141          HB3       SER 141  25.879  10.426  -2.003
 1021    HG   SER 141           HG       SER 141  26.293  11.313   0.625
 1022    H    TRP 142           H        TRP 142  23.504   8.850  -0.989
 1023    HA   TRP 142           HA       TRP 142  22.657   8.292  -3.590
 1024   1HB   TRP 142          HB2       TRP 142  23.259   6.593  -2.023
 1025   2HB   TRP 142          HB3       TRP 142  21.975   7.065  -0.922
 1026    HD1  TRP 142           HD1      TRP 142  22.281   5.587  -4.483
 1027    HE1  TRP 142           HE1      TRP 142  20.160   4.205  -4.990
 1028    HE3  TRP 142           HE3      TRP 142  19.807   6.336  -0.071
 1029    HZ2  TRP 142           HZ2      TRP 142  17.729   3.445  -3.577
 1030    HZ3  TRP 142           HZ3      TRP 142  17.583   5.302   0.310
 1031    HH2  TRP 142           HH2      TRP 142  16.540   3.864  -1.427
 1032    H    VAL 143           H        VAL 143  20.622   9.349  -0.801
 1033    HA   VAL 143           HA       VAL 143  18.131   9.153  -2.153
 1034    HB   VAL 143           HB       VAL 143  19.101  10.774   0.228
 1035   1HG1  VAL 143          HG11      VAL 143  16.753  11.294   0.762
 1036   2HG1  VAL 143          HG12      VAL 143  17.262  12.091  -0.720
 1037   3HG1  VAL 143          HG13      VAL 143  16.244  10.628  -0.812
 1038   1HG2  VAL 143          HG21      VAL 143  17.169   8.410  -0.028
 1039   2HG2  VAL 143          HG22      VAL 143  18.849   8.301   0.510
 1040   3HG2  VAL 143          HG23      VAL 143  17.682   9.187   1.487
 1041    H    ASN 144           H        ASN 144  20.313  12.062  -1.769
 1042    HA   ASN 144           HA       ASN 144  18.499  13.568  -3.392
 1043   1HB   ASN 144          HB2       ASN 144  19.635  15.429  -3.003
 1044   2HB   ASN 144          HB3       ASN 144  20.162  14.490  -1.614
 1045   1HD2  ASN 144          HD22      ASN 144  22.297  13.361  -1.851
 1046   2HD2  ASN 144          HD21      ASN 144  23.493  14.038  -2.941
 1047    H    LEU 145           H        LEU 145  21.024  11.371  -4.245
 1048    HA   LEU 145           HA       LEU 145  21.312  12.388  -6.981
 1049   1HB   LEU 145          HB2       LEU 145  22.416  10.103  -5.384
 1050   2HB   LEU 145          HB3       LEU 145  22.174   9.794  -7.091
 1051    HG   LEU 145           HG       LEU 145  23.534  11.702  -7.737
 1052   1HD1  LEU 145          HD11      LEU 145  23.192  13.221  -5.800
 1053   2HD1  LEU 145          HD12      LEU 145  24.129  12.115  -4.777
 1054   3HD1  LEU 145          HD13      LEU 145  24.906  12.954  -6.133
 1055   1HD2  LEU 145          HD21      LEU 145  24.578   9.492  -7.419
 1056   2HD2  LEU 145          HD22      LEU 145  25.712  10.791  -7.027
 1057   3HD2  LEU 145          HD23      LEU 145  24.920   9.883  -5.720
 1058    H    LEU 146           H        LEU 146  19.449   9.705  -5.382
 1059    HA   LEU 146           HA       LEU 146  18.402   8.780  -7.869
 1060   1HB   LEU 146          HB2       LEU 146  17.313   7.229  -6.690
 1061   2HB   LEU 146          HB3       LEU 146  18.635   7.563  -5.618
 1062    HG   LEU 146           HG       LEU 146  16.779   9.120  -4.423
 1063   1HD1  LEU 146          HD11      LEU 146  14.944   8.743  -6.070
 1064   2HD1  LEU 146          HD12      LEU 146  15.097   6.993  -5.838
 1065   3HD1  LEU 146          HD13      LEU 146  14.543   8.029  -4.515
 1066   1HD2  LEU 146          HD21      LEU 146  16.225   7.233  -2.969
 1067   2HD2  LEU 146          HD22      LEU 146  16.795   6.092  -4.207
 1068   3HD2  LEU 146          HD23      LEU 146  17.937   7.192  -3.411
 1069    H    LYS 147           H        LYS 147  17.269  11.080  -5.474
 1070    HA   LYS 147           HA       LYS 147  14.682  11.670  -6.413
 1071   1HB   LYS 147          HB2       LYS 147  16.835  13.208  -4.931
 1072   2HB   LYS 147          HB3       LYS 147  15.377  14.040  -5.479
 1073   1HG   LYS 147          HG2       LYS 147  13.944  12.459  -4.258
 1074   2HG   LYS 147          HG3       LYS 147  15.369  11.564  -3.704
 1075   1HD   LYS 147          HD2       LYS 147  16.196  13.597  -2.544
 1076   2HD   LYS 147          HD3       LYS 147  14.768  14.496  -3.064
 1077   1HE   LYS 147          HE2       LYS 147  14.693  11.970  -1.348
 1078   2HE   LYS 147          HE3       LYS 147  14.717  13.604  -0.687
 1079   1HZ   LYS 147          HZ1       LYS 147  12.605  14.033  -1.734
 1080   2HZ   LYS 147          HZ2       LYS 147  12.576  12.553  -2.445
 1081   3HZ   LYS 147          HZ3       LYS 147  12.506  12.677  -0.815
  Start of MODEL   13
    1   1H    MET   1          H1        MET   1   1.834  -1.509   0.797
    2   2H    MET   1          H2        MET   1   1.352  -0.086   1.432
    3   3H    MET   1          H3        MET   1   0.408  -0.855   0.326
    4    HA   MET   1           HA       MET   1   2.081  -0.558  -1.377
    5   1HB   MET   1          HB2       MET   1   1.237   2.021   0.025
    6   2HB   MET   1          HB3       MET   1   2.026   1.960  -1.550
    7   1HG   MET   1          HG2       MET   1  -0.678   0.745  -0.880
    8   2HG   MET   1          HG3       MET   1  -0.376   2.217  -1.793
    9   1HE   MET   1          HE1       MET   1  -2.292  -0.085  -2.811
   10   2HE   MET   1          HE2       MET   1  -1.964   1.407  -3.720
   11   3HE   MET   1          HE3       MET   1  -1.826  -0.171  -4.523
   12    H    ALA   2           H        ALA   2   4.206  -0.079  -1.948
   13    HA   ALA   2           HA       ALA   2   5.947   1.365  -0.130
   14   1HB   ALA   2          HB1       ALA   2   7.691  -0.405  -0.126
   15   2HB   ALA   2          HB2       ALA   2   6.237  -0.915   0.750
   16   3HB   ALA   2          HB3       ALA   2   6.551  -1.530  -0.890
   17    H    ASP   3           H        ASP   3   7.881   1.993  -1.221
   18    HA   ASP   3           HA       ASP   3   7.822   1.890  -4.181
   19   1HB   ASP   3          HB2       ASP   3   7.632   4.124  -2.995
   20   2HB   ASP   3          HB3       ASP   3   9.211   3.829  -2.294
   21    H    ILE   4           H        ILE   4   9.619   1.096  -1.284
   22    HA   ILE   4           HA       ILE   4  11.860   0.008  -2.908
   23    HB   ILE   4           HB       ILE   4  12.201   1.267  -0.170
   24   1HG1  ILE   4          HG12      ILE   4  12.783   2.696  -2.795
   25   2HG1  ILE   4          HG13      ILE   4  11.456   3.094  -1.702
   26   1HG2  ILE   4          HG21      ILE   4  13.894  -0.404  -1.025
   27   2HG2  ILE   4          HG22      ILE   4  14.224   0.683  -2.375
   28   3HG2  ILE   4          HG23      ILE   4  14.566   1.189  -0.710
   29   1HD1  ILE   4          HD11      ILE   4  13.206   4.668  -1.347
   30   2HD1  ILE   4          HD12      ILE   4  13.097   3.627   0.082
   31   3HD1  ILE   4          HD13      ILE   4  14.408   3.396  -1.102
   32    H    THR   5           H        THR   5  12.059  -2.151  -2.543
   33    HA   THR   5           HA       THR   5  10.891  -3.361  -0.105
   34    HB   THR   5           HB       THR   5  10.453  -4.492  -2.270
   35    HG1  THR   5           HG1      THR   5  10.582  -5.864  -0.589
   36   1HG2  THR   5          HG21      THR   5  12.162  -5.626  -3.554
   37   2HG2  THR   5          HG22      THR   5  12.385  -3.874  -3.600
   38   3HG2  THR   5          HG23      THR   5  13.439  -4.880  -2.580
   39    H    LEU   6           H        LEU   6  12.218  -3.789   1.646
   40    HA   LEU   6           HA       LEU   6  15.150  -3.219   1.385
   41   1HB   LEU   6          HB2       LEU   6  13.182  -3.119   3.680
   42   2HB   LEU   6          HB3       LEU   6  14.881  -3.262   3.985
   43    HG   LEU   6           HG       LEU   6  13.933  -0.993   4.223
   44   1HD1  LEU   6          HD11      LEU   6  15.787   0.228   3.262
   45   2HD1  LEU   6          HD12      LEU   6  16.340  -1.299   3.955
   46   3HD1  LEU   6          HD13      LEU   6  16.165  -1.131   2.191
   47   1HD2  LEU   6          HD21      LEU   6  13.846  -0.879   1.200
   48   2HD2  LEU   6          HD22      LEU   6  12.423  -0.976   2.257
   49   3HD2  LEU   6          HD23      LEU   6  13.491   0.442   2.328
   50    H    ILE   7           H        ILE   7  15.855  -5.164   0.682
   51    HA   ILE   7           HA       ILE   7  14.723  -7.681   1.647
   52    HB   ILE   7           HB       ILE   7  16.996  -7.268  -0.340
   53   1HG1  ILE   7          HG12      ILE   7  13.994  -7.465  -0.903
   54   2HG1  ILE   7          HG13      ILE   7  14.986  -6.028  -1.136
   55   1HG2  ILE   7          HG21      ILE   7  16.673  -9.546   0.700
   56   2HG2  ILE   7          HG22      ILE   7  15.009  -9.549   0.065
   57   3HG2  ILE   7          HG23      ILE   7  16.406  -9.541  -1.039
   58   1HD1  ILE   7          HD11      ILE   7  16.333  -7.219  -2.852
   59   2HD1  ILE   7          HD12      ILE   7  15.217  -8.602  -2.723
   60   3HD1  ILE   7          HD13      ILE   7  14.621  -7.032  -3.271
   61    H    SER   8           H        SER   8  15.235  -7.610   3.731
   62    HA   SER   8           HA       SER   8  17.788  -6.776   4.827
   63   1HB   SER   8          HB2       SER   8  15.290  -7.810   6.221
   64   2HB   SER   8          HB3       SER   8  16.547  -6.755   6.880
   65    HG   SER   8           HG       SER   8  14.778  -6.064   4.734
   66    H    GLY   9           H        GLY   9  17.988  -9.309   3.330
   67   1HA   GLY   9          HA2       GLY   9  18.679 -11.153   5.514
   68   2HA   GLY   9          HA3       GLY   9  17.437 -11.700   4.395
   69    H    SER  10           H        SER  10  20.066 -12.775   4.962
   70    HA   SER  10           HA       SER  10  21.167 -12.835   2.220
   71   1HB   SER  10          HB2       SER  10  23.317 -13.443   3.710
   72   2HB   SER  10          HB3       SER  10  22.887 -11.777   3.304
   73    HG   SER  10           HG       SER  10  22.088 -11.437   5.270
   74    H    THR  11           H        THR  11  20.578 -14.639   5.267
   75    HA   THR  11           HA       THR  11  20.600 -17.176   3.688
   76    HB   THR  11           HB       THR  11  21.480 -18.154   5.890
   77    HG1  THR  11           HG1      THR  11  21.186 -16.467   7.300
   78   1HG2  THR  11          HG21      THR  11  22.897 -17.824   3.879
   79   2HG2  THR  11          HG22      THR  11  23.283 -16.175   4.420
   80   3HG2  THR  11          HG23      THR  11  23.796 -17.576   5.381
   81    H    LEU  12           H        LEU  12  18.305 -15.872   3.690
   82    HA   LEU  12           HA       LEU  12  16.204 -15.554   4.346
   83   1HB   LEU  12          HB2       LEU  12  16.230 -17.969   3.796
   84   2HB   LEU  12          HB3       LEU  12  16.354 -18.344   5.514
   85    HG   LEU  12           HG       LEU  12  14.126 -17.308   5.909
   86   1HD1  LEU  12          HD11      LEU  12  14.026 -15.567   4.195
   87   2HD1  LEU  12          HD12      LEU  12  14.113 -16.786   2.903
   88   3HD1  LEU  12          HD13      LEU  12  12.690 -16.687   3.962
   89   1HD2  LEU  12          HD21      LEU  12  14.297 -19.696   5.326
   90   2HD2  LEU  12          HD22      LEU  12  12.786 -18.987   4.738
   91   3HD2  LEU  12          HD23      LEU  12  14.121 -19.296   3.604
   92    H    GLY  13           H        GLY  13  17.984 -14.350   5.861
   93   1HA   GLY  13          HA2       GLY  13  16.677 -13.307   8.075
   94   2HA   GLY  13          HA3       GLY  13  17.804 -14.546   8.686
   95    H    GLY  14           H        GLY  14  18.219 -11.703   9.148
   96   1HA   GLY  14          HA2       GLY  14  20.860 -11.209   8.350
   97   2HA   GLY  14          HA3       GLY  14  19.820 -10.484   7.127
   98    H    ALA  15           H        ALA  15  20.624  -8.444   7.791
   99    HA   ALA  15           HA       ALA  15  20.560  -7.519  10.505
  100   1HB   ALA  15          HB1       ALA  15  21.144  -6.063   7.891
  101   2HB   ALA  15          HB2       ALA  15  21.541  -5.482   9.522
  102   3HB   ALA  15          HB3       ALA  15  22.335  -6.932   8.890
  103    H    GLU  16           H        GLU  16  17.915  -8.150  10.025
  104    HA   GLU  16           HA       GLU  16  16.225  -6.222   8.920
  105   1HB   GLU  16          HB2       GLU  16  15.744  -8.010  11.329
  106   2HB   GLU  16          HB3       GLU  16  14.498  -7.065  10.494
  107   1HG   GLU  16          HG2       GLU  16  14.889  -8.313   8.416
  108   2HG   GLU  16          HG3       GLU  16  16.177  -9.248   9.182
  109    H    TYR  17           H        TYR  17  17.716  -6.141  12.185
  110    HA   TYR  17           HA       TYR  17  16.101  -4.064  13.246
  111   1HB   TYR  17          HB2       TYR  17  17.637  -5.476  14.570
  112   2HB   TYR  17          HB3       TYR  17  19.025  -4.726  13.796
  113    HD1  TYR  17           HD1      TYR  17  16.306  -4.278  16.261
  114    HD2  TYR  17           HD2      TYR  17  19.701  -2.407  14.364
  115    HE1  TYR  17           HE1      TYR  17  16.311  -2.519  18.005
  116    HE2  TYR  17           HE2      TYR  17  19.720  -0.652  16.100
  117    HH   TYR  17           HH       TYR  17  18.706   0.166  18.034
  118    H    VAL  18           H        VAL  18  19.123  -3.916  11.296
  119    HA   VAL  18           HA       VAL  18  19.277  -1.010  11.453
  120    HB   VAL  18           HB       VAL  18  20.704  -2.879   9.507
  121   1HG1  VAL  18          HG11      VAL  18  21.429  -0.134  10.646
  122   2HG1  VAL  18          HG12      VAL  18  22.417  -1.096   9.530
  123   3HG1  VAL  18          HG13      VAL  18  20.863  -0.456   8.993
  124   1HG2  VAL  18          HG21      VAL  18  21.523  -2.102  12.336
  125   2HG2  VAL  18          HG22      VAL  18  21.216  -3.747  11.733
  126   3HG2  VAL  18          HG23      VAL  18  22.610  -2.849  11.143
  127    H    ALA  19           H        ALA  19  18.138  -3.505   9.140
  128    HA   ALA  19           HA       ALA  19  17.546  -1.764   6.998
  129   1HB   ALA  19          HB1       ALA  19  16.190  -3.542   6.146
  130   2HB   ALA  19          HB2       ALA  19  17.659  -4.246   6.851
  131   3HB   ALA  19          HB3       ALA  19  16.112  -4.329   7.732
  132    H    GLU  20           H        GLU  20  15.500  -2.706   9.842
  133    HA   GLU  20           HA       GLU  20  13.190  -1.322   8.986
  134   1HB   GLU  20          HB2       GLU  20  13.371  -2.990  10.865
  135   2HB   GLU  20          HB3       GLU  20  14.139  -1.738  11.851
  136   1HG   GLU  20          HG2       GLU  20  12.101  -0.325  11.605
  137   2HG   GLU  20          HG3       GLU  20  11.365  -1.563  10.586
  138    H    HIS  21           H        HIS  21  16.056  -0.119  10.826
  139    HA   HIS  21           HA       HIS  21  14.954   2.502  11.287
  140   1HB   HIS  21          HB2       HIS  21  16.847   1.626  12.582
  141   2HB   HIS  21          HB3       HIS  21  17.847   1.552  11.130
  142    HD1  HIS  21           HD1      HIS  21  19.189   3.756  10.580
  143    HD2  HIS  21           HD2      HIS  21  16.002   4.249  13.289
  144    HE1  HIS  21           HE1      HIS  21  19.307   6.163  11.393
  145    H    LEU  22           H        LEU  22  17.057   1.132   8.737
  146    HA   LEU  22           HA       LEU  22  17.424   3.440   7.141
  147   1HB   LEU  22          HB2       LEU  22  17.304   0.456   6.628
  148   2HB   LEU  22          HB3       LEU  22  17.461   1.544   5.280
  149    HG   LEU  22           HG       LEU  22  19.353   1.682   7.676
  150   1HD1  LEU  22          HD11      LEU  22  20.923   0.245   6.470
  151   2HD1  LEU  22          HD12      LEU  22  19.441  -0.620   6.848
  152   3HD1  LEU  22          HD13      LEU  22  19.705  -0.041   5.191
  153   1HD2  LEU  22          HD21      LEU  22  19.413   3.600   6.116
  154   2HD2  LEU  22          HD22      LEU  22  20.914   2.671   6.036
  155   3HD2  LEU  22          HD23      LEU  22  19.696   2.498   4.752
  156    H    ALA  23           H        ALA  23  14.955   0.884   6.862
  157    HA   ALA  23           HA       ALA  23  13.351   1.890   4.861
  158   1HB   ALA  23          HB1       ALA  23  12.328   0.540   7.401
  159   2HB   ALA  23          HB2       ALA  23  11.551   0.548   5.822
  160   3HB   ALA  23          HB3       ALA  23  13.064  -0.326   6.053
  161    H    GLU  24           H        GLU  24  13.055   2.635   8.382
  162    HA   GLU  24           HA       GLU  24  10.835   4.333   8.243
  163   1HB   GLU  24          HB2       GLU  24  12.088   3.349  10.284
  164   2HB   GLU  24          HB3       GLU  24  13.210   4.672  10.136
  165   1HG   GLU  24          HG2       GLU  24  11.665   5.326  11.791
  166   2HG   GLU  24          HG3       GLU  24  11.299   6.295  10.370
  167    H    LYS  25           H        LYS  25  14.320   5.254   8.309
  168    HA   LYS  25           HA       LYS  25  13.949   8.011   7.870
  169   1HB   LYS  25          HB2       LYS  25  16.191   6.096   7.082
  170   2HB   LYS  25          HB3       LYS  25  16.326   7.830   6.942
  171   1HG   LYS  25          HG2       LYS  25  15.852   6.224   9.511
  172   2HG   LYS  25          HG3       LYS  25  17.339   6.965   9.024
  173   1HD   LYS  25          HD2       LYS  25  14.818   8.261  10.032
  174   2HD   LYS  25          HD3       LYS  25  16.434   8.320  10.726
  175   1HE   LYS  25          HE2       LYS  25  17.158   9.650   8.666
  176   2HE   LYS  25          HE3       LYS  25  15.446   9.731   8.209
  177   1HZ   LYS  25          HZ1       LYS  25  16.119  11.694   9.430
  178   2HZ   LYS  25          HZ2       LYS  25  15.017  10.880  10.311
  179   3HZ   LYS  25          HZ3       LYS  25  16.600  10.817  10.713
  180    H    LEU  26           H        LEU  26  14.211   5.407   5.465
  181    HA   LEU  26           HA       LEU  26  14.099   7.193   3.200
  182   1HB   LEU  26          HB2       LEU  26  13.837   4.233   3.624
  183   2HB   LEU  26          HB3       LEU  26  13.253   4.924   2.114
  184    HG   LEU  26           HG       LEU  26  15.309   5.607   1.386
  185   1HD1  LEU  26          HD11      LEU  26  16.562   5.236   4.135
  186   2HD1  LEU  26          HD12      LEU  26  17.412   5.680   2.642
  187   3HD1  LEU  26          HD13      LEU  26  16.247   6.791   3.335
  188   1HD2  LEU  26          HD21      LEU  26  15.054   3.140   1.401
  189   2HD2  LEU  26          HD22      LEU  26  16.754   3.621   1.531
  190   3HD2  LEU  26          HD23      LEU  26  15.877   3.066   2.971
  191    H    GLU  27           H        GLU  27  11.431   5.861   5.272
  192    HA   GLU  27           HA       GLU  27   9.443   6.736   3.395
  193   1HB   GLU  27          HB2       GLU  27   9.256   6.304   6.413
  194   2HB   GLU  27          HB3       GLU  27   7.945   6.616   5.297
  195   1HG   GLU  27          HG2       GLU  27   8.929   4.501   4.028
  196   2HG   GLU  27          HG3       GLU  27   9.571   4.143   5.637
  197    H    GLU  28           H        GLU  28  11.104   8.199   6.262
  198    HA   GLU  28           HA       GLU  28   9.773  10.684   6.204
  199   1HB   GLU  28          HB2       GLU  28  12.582   9.882   7.082
  200   2HB   GLU  28          HB3       GLU  28  11.877  11.446   7.379
  201   1HG   GLU  28          HG2       GLU  28  10.703   8.838   8.414
  202   2HG   GLU  28          HG3       GLU  28  11.811   9.869   9.308
  203    H    ALA  29           H        ALA  29  12.340   9.404   4.132
  204    HA   ALA  29           HA       ALA  29  13.165  11.921   3.023
  205   1HB   ALA  29          HB1       ALA  29  14.267  10.584   1.312
  206   2HB   ALA  29          HB2       ALA  29  14.538   9.851   2.904
  207   3HB   ALA  29          HB3       ALA  29  13.350   9.146   1.779
  208    H    GLY  30           H        GLY  30  10.246  10.103   2.603
  209   1HA   GLY  30          HA2       GLY  30   8.534  11.590   1.676
  210   2HA   GLY  30          HA3       GLY  30   9.537  11.780   0.236
  211    H    PHE  31           H        PHE  31   9.395   8.526   1.565
  212    HA   PHE  31           HA       PHE  31   7.579   7.731  -0.673
  213   1HB   PHE  31          HB2       PHE  31  10.185   6.361  -0.021
  214   2HB   PHE  31          HB3       PHE  31   9.132   6.084  -1.395
  215    HD1  PHE  31           HD1      PHE  31   8.977   7.750  -3.257
  216    HD2  PHE  31           HD2      PHE  31  11.760   8.244   0.004
  217    HE1  PHE  31           HE1      PHE  31  10.148   9.539  -4.519
  218    HE2  PHE  31           HE2      PHE  31  12.898  10.058  -1.244
  219    HZ   PHE  31           HZ       PHE  31  12.095  10.710  -3.509
  220    H    THR  32           H        THR  32   7.804   4.956  -0.285
  221    HA   THR  32           HA       THR  32   7.186   4.472   2.548
  222    HB   THR  32           HB       THR  32   5.422   2.806   1.689
  223    HG1  THR  32           HG1      THR  32   5.372   4.691  -0.448
  224   1HG2  THR  32          HG21      THR  32   3.620   4.460   1.852
  225   2HG2  THR  32          HG22      THR  32   4.877   4.756   3.067
  226   3HG2  THR  32          HG23      THR  32   4.786   5.786   1.622
  227    H    THR  33           H        THR  33   7.774   2.363   3.203
  228    HA   THR  33           HA       THR  33   9.419   0.811   1.262
  229    HB   THR  33           HB       THR  33  11.226   0.874   2.921
  230    HG1  THR  33           HG1      THR  33  10.859   2.690   4.556
  231   1HG2  THR  33          HG21      THR  33  12.005   3.106   2.598
  232   2HG2  THR  33          HG22      THR  33  11.053   2.723   1.156
  233   3HG2  THR  33          HG23      THR  33  10.360   3.760   2.412
  234    H    GLU  34           H        GLU  34   9.891  -1.443   1.997
  235    HA   GLU  34           HA       GLU  34   8.059  -2.408   4.120
  236   1HB   GLU  34          HB2       GLU  34   7.960  -2.699   1.340
  237   2HB   GLU  34          HB3       GLU  34   8.536  -4.204   1.979
  238   1HG   GLU  34          HG2       GLU  34   6.208  -2.646   3.156
  239   2HG   GLU  34          HG3       GLU  34   6.026  -3.757   1.871
  240    H    THR  35           H        THR  35   9.457  -3.046   5.796
  241    HA   THR  35           HA       THR  35  12.170  -3.998   5.234
  242    HB   THR  35           HB       THR  35  10.785  -4.102   7.926
  243    HG1  THR  35           HG1      THR  35  10.599  -1.981   7.336
  244   1HG2  THR  35          HG21      THR  35  13.087  -3.946   8.736
  245   2HG2  THR  35          HG22      THR  35  13.005  -5.259   7.552
  246   3HG2  THR  35          HG23      THR  35  13.693  -3.698   7.079
  247    H    LEU  36           H        LEU  36  12.563  -6.034   4.654
  248    HA   LEU  36           HA       LEU  36  10.741  -8.261   5.531
  249   1HB   LEU  36          HB2       LEU  36  11.719  -7.456   2.751
  250   2HB   LEU  36          HB3       LEU  36  10.924  -8.977   3.108
  251    HG   LEU  36           HG       LEU  36   9.533  -6.333   3.666
  252   1HD1  LEU  36          HD11      LEU  36   8.537  -6.542   1.413
  253   2HD1  LEU  36          HD12      LEU  36  10.274  -6.189   1.407
  254   3HD1  LEU  36          HD13      LEU  36   9.721  -7.838   1.044
  255   1HD2  LEU  36          HD21      LEU  36   8.519  -8.401   4.610
  256   2HD2  LEU  36          HD22      LEU  36   7.510  -7.698   3.340
  257   3HD2  LEU  36          HD23      LEU  36   8.495  -9.128   2.985
  258    H    HIS  37           H        HIS  37  11.933 -10.193   5.909
  259    HA   HIS  37           HA       HIS  37  14.816 -10.191   5.236
  260   1HB   HIS  37          HB2       HIS  37  14.741 -12.479   6.359
  261   2HB   HIS  37          HB3       HIS  37  14.426 -11.077   7.356
  262    HD1  HIS  37           HD1      HIS  37  12.184 -11.008   8.656
  263    HD2  HIS  37           HD2      HIS  37  12.417 -13.986   5.676
  264    HE1  HIS  37           HE1      HIS  37  10.088 -12.461   8.910
  265    H    GLY  38           H        GLY  38  13.343  -9.845   3.009
  266   1HA   GLY  38          HA2       GLY  38  12.418 -10.647   1.067
  267   2HA   GLY  38          HA3       GLY  38  13.929 -11.544   1.012
  268    HA   PRO  39           HA       PRO  39  11.031 -14.810   2.886
  269   1HB   PRO  39          HB2       PRO  39   8.357 -14.352   3.334
  270   2HB   PRO  39          HB3       PRO  39   9.642 -13.953   4.516
  271   1HG   PRO  39          HG2       PRO  39   8.298 -12.114   2.517
  272   2HG   PRO  39          HG3       PRO  39   8.608 -11.820   4.258
  273   1HD   PRO  39          HD2       PRO  39  10.251 -10.869   2.296
  274   2HD   PRO  39          HD3       PRO  39  10.892 -11.419   3.880
  275    H    LEU  40           H        LEU  40   9.794 -12.763   0.286
  276    HA   LEU  40           HA       LEU  40   8.865 -15.128  -1.237
  277   1HB   LEU  40          HB2       LEU  40   8.083 -12.169  -1.214
  278   2HB   LEU  40          HB3       LEU  40   7.571 -13.298  -2.437
  279    HG   LEU  40           HG       LEU  40   6.869 -13.510   0.516
  280   1HD1  LEU  40          HD11      LEU  40   5.784 -11.605  -0.608
  281   2HD1  LEU  40          HD12      LEU  40   5.169 -12.687  -1.876
  282   3HD1  LEU  40          HD13      LEU  40   4.607 -12.860  -0.197
  283   1HD2  LEU  40          HD21      LEU  40   5.220 -15.228  -0.233
  284   2HD2  LEU  40          HD22      LEU  40   5.929 -15.177  -1.862
  285   3HD2  LEU  40          HD23      LEU  40   6.887 -15.749  -0.476
  286    H    LEU  41           H        LEU  41  11.607 -13.759  -0.760
  287    HA   LEU  41           HA       LEU  41  13.440 -13.069  -1.742
  288   1HB   LEU  41          HB2       LEU  41  12.796 -15.008  -3.356
  289   2HB   LEU  41          HB3       LEU  41  12.305 -13.734  -4.465
  290    HG   LEU  41           HG       LEU  41  14.735 -12.779  -4.107
  291   1HD1  LEU  41          HD11      LEU  41  16.399 -14.472  -3.553
  292   2HD1  LEU  41          HD12      LEU  41  15.290 -14.264  -2.182
  293   3HD1  LEU  41          HD13      LEU  41  15.124 -15.674  -3.232
  294   1HD2  LEU  41          HD21      LEU  41  15.624 -14.316  -5.851
  295   2HD2  LEU  41          HD22      LEU  41  14.182 -15.342  -5.636
  296   3HD2  LEU  41          HD23      LEU  41  14.014 -13.670  -6.209
  297    H    GLU  42           H        GLU  42  10.464 -11.755  -3.040
  298    HA   GLU  42           HA       GLU  42  11.524  -9.064  -3.439
  299   1HB   GLU  42          HB2       GLU  42  11.062  -9.078  -5.884
  300   2HB   GLU  42          HB3       GLU  42  12.432 -10.055  -5.422
  301   1HG   GLU  42          HG2       GLU  42  10.976 -12.121  -5.616
  302   2HG   GLU  42          HG3       GLU  42   9.704 -11.104  -6.276
  303    H    ASP  43           H        ASP  43   9.908  -8.448  -2.000
  304    HA   ASP  43           HA       ASP  43   7.120  -9.196  -2.391
  305   1HB   ASP  43          HB2       ASP  43   7.843  -8.417  -0.220
  306   2HB   ASP  43          HB3       ASP  43   8.373  -6.868  -0.916
  307    H    LEU  44           H        LEU  44   9.206  -6.407  -3.387
  308    HA   LEU  44           HA       LEU  44   6.982  -5.379  -5.064
  309   1HB   LEU  44          HB2       LEU  44   9.866  -4.468  -4.849
  310   2HB   LEU  44          HB3       LEU  44   8.726  -3.749  -5.910
  311    HG   LEU  44           HG       LEU  44   8.514  -3.726  -2.882
  312   1HD1  LEU  44          HD11      LEU  44   8.885  -1.344  -3.112
  313   2HD1  LEU  44          HD12      LEU  44  10.196  -2.190  -3.962
  314   3HD1  LEU  44          HD13      LEU  44   8.877  -1.454  -4.885
  315   1HD2  LEU  44          HD21      LEU  44   6.595  -2.607  -4.971
  316   2HD2  LEU  44          HD22      LEU  44   6.238  -3.827  -3.722
  317   3HD2  LEU  44          HD23      LEU  44   6.582  -2.168  -3.253
  318    HA   PRO  45           HA       PRO  45   8.083  -7.837  -8.563
  319   1HB   PRO  45          HB2       PRO  45   7.544  -6.109 -10.695
  320   2HB   PRO  45          HB3       PRO  45   6.343  -6.968  -9.733
  321   1HG   PRO  45          HG2       PRO  45   7.361  -4.123  -9.456
  322   2HG   PRO  45          HG3       PRO  45   5.672  -4.683  -9.380
  323   1HD   PRO  45          HD2       PRO  45   7.170  -4.147  -7.142
  324   2HD   PRO  45          HD3       PRO  45   5.910  -5.422  -7.172
  325    H    ALA  46           H        ALA  46   9.153  -7.421 -10.826
  326    HA   ALA  46           HA       ALA  46  11.940  -6.695 -10.431
  327   1HB   ALA  46          HB1       ALA  46  10.418  -7.546 -12.947
  328   2HB   ALA  46          HB2       ALA  46  12.180  -7.452 -12.795
  329   3HB   ALA  46          HB3       ALA  46  11.282  -8.640 -11.836
  330    H    SER  47           H        SER  47  10.187  -4.498  -9.982
  331    HA   SER  47           HA       SER  47  11.074  -2.464 -11.798
  332   1HB   SER  47          HB2       SER  47   8.102  -2.900 -11.431
  333   2HB   SER  47          HB3       SER  47   8.870  -1.608 -12.360
  334    HG   SER  47           HG       SER  47   8.077  -3.311 -13.679
  335    H    GLY  48           H        GLY  48  11.332  -0.610 -10.494
  336   1HA   GLY  48          HA2       GLY  48  10.139   0.760  -8.659
  337   2HA   GLY  48          HA3       GLY  48  10.224  -0.728  -7.717
  338    H    ILE  49           H        ILE  49  11.618  -0.053  -6.163
  339    HA   ILE  49           HA       ILE  49  14.465   0.261  -6.983
  340    HB   ILE  49           HB       ILE  49  13.230   1.339  -4.445
  341   1HG1  ILE  49          HG12      ILE  49  12.217   2.680  -6.215
  342   2HG1  ILE  49          HG13      ILE  49  13.302   3.607  -5.205
  343   1HG2  ILE  49          HG21      ILE  49  15.945   1.837  -5.740
  344   2HG2  ILE  49          HG22      ILE  49  15.350   2.642  -4.271
  345   3HG2  ILE  49          HG23      ILE  49  15.628   0.899  -4.278
  346   1HD1  ILE  49          HD11      ILE  49  14.025   2.575  -7.978
  347   2HD1  ILE  49          HD12      ILE  49  13.483   4.216  -7.588
  348   3HD1  ILE  49          HD13      ILE  49  15.017   3.623  -6.940
  349    H    TRP  50           H        TRP  50  15.809  -1.240  -5.914
  350    HA   TRP  50           HA       TRP  50  14.589  -3.049  -3.869
  351   1HB   TRP  50          HB2       TRP  50  16.323  -3.594  -6.306
  352   2HB   TRP  50          HB3       TRP  50  16.466  -4.595  -4.898
  353    HD1  TRP  50           HD1      TRP  50  12.932  -3.562  -6.039
  354    HE1  TRP  50           HE1      TRP  50  11.737  -5.537  -7.133
  355    HE3  TRP  50           HE3      TRP  50  16.807  -6.908  -6.045
  356    HZ2  TRP  50           HZ2      TRP  50  12.365  -8.263  -7.839
  357    HZ3  TRP  50           HZ3      TRP  50  16.473  -9.196  -6.937
  358    HH2  TRP  50           HH2      TRP  50  14.257  -9.886  -7.832
  359    H    LEU  51           H        LEU  51  15.822  -3.119  -2.001
  360    HA   LEU  51           HA       LEU  51  18.664  -2.223  -2.155
  361   1HB   LEU  51          HB2       LEU  51  16.601  -1.556  -0.022
  362   2HB   LEU  51          HB3       LEU  51  18.338  -1.404   0.222
  363    HG   LEU  51           HG       LEU  51  16.663   0.198  -1.764
  364   1HD1  LEU  51          HD11      LEU  51  17.201   2.073  -0.280
  365   2HD1  LEU  51          HD12      LEU  51  16.385   0.797   0.636
  366   3HD1  LEU  51          HD13      LEU  51  18.135   1.007   0.787
  367   1HD2  LEU  51          HD21      LEU  51  18.761   1.544  -2.070
  368   2HD2  LEU  51          HD22      LEU  51  19.662   0.299  -1.177
  369   3HD2  LEU  51          HD23      LEU  51  18.884  -0.083  -2.731
  370    H    VAL  52           H        VAL  52  20.032  -3.627  -1.108
  371    HA   VAL  52           HA       VAL  52  18.756  -5.921   0.334
  372    HB   VAL  52           HB       VAL  52  21.359  -5.909  -1.256
  373   1HG1  VAL  52          HG11      VAL  52  21.282  -7.646   0.497
  374   2HG1  VAL  52          HG12      VAL  52  19.700  -8.198  -0.094
  375   3HG1  VAL  52          HG13      VAL  52  21.152  -8.380  -1.102
  376   1HG2  VAL  52          HG21      VAL  52  18.610  -6.931  -2.096
  377   2HG2  VAL  52          HG22      VAL  52  19.517  -5.601  -2.849
  378   3HG2  VAL  52          HG23      VAL  52  20.130  -7.249  -2.957
  379    H    ILE  53           H        ILE  53  19.517  -6.381   2.394
  380    HA   ILE  53           HA       ILE  53  21.717  -4.705   3.459
  381    HB   ILE  53           HB       ILE  53  19.118  -5.029   4.979
  382   1HG1  ILE  53          HG12      ILE  53  18.820  -2.487   4.360
  383   2HG1  ILE  53          HG13      ILE  53  19.725  -2.900   2.911
  384   1HG2  ILE  53          HG21      ILE  53  19.986  -3.151   6.269
  385   2HG2  ILE  53          HG22      ILE  53  21.202  -4.427   6.199
  386   3HG2  ILE  53          HG23      ILE  53  21.375  -2.995   5.172
  387   1HD1  ILE  53          HD11      ILE  53  17.940  -4.671   2.428
  388   2HD1  ILE  53          HD12      ILE  53  17.091  -4.114   3.873
  389   3HD1  ILE  53          HD13      ILE  53  17.332  -3.031   2.483
  390    H    SER  54           H        SER  54  23.141  -6.035   4.285
  391    HA   SER  54           HA       SER  54  22.732  -7.839   6.395
  392   1HB   SER  54          HB2       SER  54  23.008  -9.126   3.648
  393   2HB   SER  54          HB3       SER  54  23.622  -9.921   5.106
  394    HG   SER  54           HG       SER  54  20.988  -8.933   4.891
  395    H    SER  55           H        SER  55  25.312  -9.338   5.836
  396    HA   SER  55           HA       SER  55  27.130  -7.305   4.821
  397   1HB   SER  55          HB2       SER  55  27.385  -8.332   7.680
  398   2HB   SER  55          HB3       SER  55  28.608  -7.377   6.815
  399    HG   SER  55           HG       SER  55  26.162  -6.225   6.687
  400    H    THR  56           H        THR  56  28.834  -8.210   3.808
  401    HA   THR  56           HA       THR  56  29.177 -11.160   3.995
  402    HB   THR  56           HB       THR  56  29.123 -11.174   1.497
  403    HG1  THR  56           HG1      THR  56  28.541  -9.429   0.424
  404   1HG2  THR  56          HG21      THR  56  27.027 -11.594   2.882
  405   2HG2  THR  56          HG22      THR  56  26.571  -9.907   2.585
  406   3HG2  THR  56          HG23      THR  56  26.757 -11.026   1.225
  407    H    HIS  57           H        HIS  57  30.815  -8.178   4.080
  408    HA   HIS  57           HA       HIS  57  33.313  -8.825   2.850
  409   1HB   HIS  57          HB2       HIS  57  32.965  -6.584   3.552
  410   2HB   HIS  57          HB3       HIS  57  32.424  -7.062   5.151
  411    HD1  HIS  57           HD1      HIS  57  35.828  -7.843   3.398
  412    HD2  HIS  57           HD2      HIS  57  34.115  -6.109   6.837
  413    HE1  HIS  57           HE1      HIS  57  37.766  -7.085   4.871
  414    H    GLY  58           H        GLY  58  35.107  -9.932   3.656
  415   1HA   GLY  58          HA2       GLY  58  36.306 -11.079   5.431
  416   2HA   GLY  58          HA3       GLY  58  34.767 -11.523   6.173
  417    H    ALA  59           H        ALA  59  35.434 -13.753   6.062
  418    HA   ALA  59           HA       ALA  59  36.283 -15.091   3.739
  419   1HB   ALA  59          HB1       ALA  59  34.744 -16.197   6.129
  420   2HB   ALA  59          HB2       ALA  59  35.674 -17.148   4.953
  421   3HB   ALA  59          HB3       ALA  59  36.513 -16.005   6.019
  422    H    GLY  60           H        GLY  60  32.978 -14.307   4.823
  423   1HA   GLY  60          HA2       GLY  60  30.885 -14.676   3.841
  424   2HA   GLY  60          HA3       GLY  60  31.759 -14.630   2.302
  425    H    ASP  61           H        ASP  61  30.730 -16.307   1.300
  426    HA   ASP  61           HA       ASP  61  31.702 -18.962   2.081
  427   1HB   ASP  61          HB2       ASP  61  29.355 -18.714   3.069
  428   2HB   ASP  61          HB3       ASP  61  28.766 -18.588   1.409
  429    H    ILE  62           H        ILE  62  31.316 -20.498   0.156
  430    HA   ILE  62           HA       ILE  62  32.498 -19.460  -2.140
  431    HB   ILE  62           HB       ILE  62  30.746 -21.933  -1.937
  432   1HG1  ILE  62          HG12      ILE  62  32.452 -22.088  -0.236
  433   2HG1  ILE  62          HG13      ILE  62  32.811 -23.194  -1.540
  434   1HG2  ILE  62          HG21      ILE  62  31.156 -21.440  -4.270
  435   2HG2  ILE  62          HG22      ILE  62  32.884 -21.182  -3.971
  436   3HG2  ILE  62          HG23      ILE  62  32.172 -22.802  -3.798
  437   1HD1  ILE  62          HD11      ILE  62  34.197 -20.518  -1.053
  438   2HD1  ILE  62          HD12      ILE  62  34.849 -22.130  -0.729
  439   3HD1  ILE  62          HD13      ILE  62  34.556 -21.627  -2.400
  440    HA   PRO  63           HA       PRO  63  28.333 -18.888  -4.391
  441   1HB   PRO  63          HB2       PRO  63  25.987 -18.549  -2.969
  442   2HB   PRO  63          HB3       PRO  63  26.590 -20.119  -3.572
  443   1HG   PRO  63          HG2       PRO  63  26.967 -18.917  -0.810
  444   2HG   PRO  63          HG3       PRO  63  26.374 -20.560  -1.231
  445   1HD   PRO  63          HD2       PRO  63  28.926 -20.158  -0.577
  446   2HD   PRO  63          HD3       PRO  63  28.538 -21.236  -1.942
  447    H    ASP  64           H        ASP  64  29.561 -17.144  -1.794
  448    HA   ASP  64           HA       ASP  64  30.080 -14.775  -2.264
  449   1HB   ASP  64          HB2       ASP  64  28.123 -14.124  -3.554
  450   2HB   ASP  64          HB3       ASP  64  27.046 -14.506  -2.203
  451    H    ASN  65           H        ASN  65  27.380 -16.055  -0.419
  452    HA   ASN  65           HA       ASN  65  28.336 -16.438   2.139
  453   1HB   ASN  65          HB2       ASN  65  28.945 -14.142   2.496
  454   2HB   ASN  65          HB3       ASN  65  27.497 -13.574   1.691
  455   1HD2  ASN  65          HD22      ASN  65  28.730 -14.856   4.758
  456   2HD2  ASN  65          HD21      ASN  65  27.285 -14.433   5.625
  457    H    LEU  66           H        LEU  66  25.805 -14.772   0.300
  458    HA   LEU  66           HA       LEU  66  23.526 -15.800   1.699
  459   1HB   LEU  66          HB2       LEU  66  23.827 -14.814  -1.190
  460   2HB   LEU  66          HB3       LEU  66  22.321 -15.158  -0.356
  461    HG   LEU  66           HG       LEU  66  23.084 -13.405   1.384
  462   1HD1  LEU  66          HD11      LEU  66  25.323 -12.915   0.853
  463   2HD1  LEU  66          HD12      LEU  66  24.966 -12.707  -0.871
  464   3HD1  LEU  66          HD13      LEU  66  24.412 -11.517   0.324
  465   1HD2  LEU  66          HD21      LEU  66  22.184 -12.680  -1.418
  466   2HD2  LEU  66          HD22      LEU  66  21.170 -13.030  -0.014
  467   3HD2  LEU  66          HD23      LEU  66  22.127 -11.553  -0.040
  468    H    SER  67           H        SER  67  22.240 -17.633   1.254
  469    HA   SER  67           HA       SER  67  23.321 -19.444  -0.881
  470   1HB   SER  67          HB2       SER  67  22.207 -20.318   1.796
  471   2HB   SER  67          HB3       SER  67  22.775 -21.357   0.479
  472    HG   SER  67           HG       SER  67  24.368 -20.993   2.090
  473    HA   PRO  68           HA       PRO  68  18.737 -20.362  -1.138
  474   1HB   PRO  68          HB2       PRO  68  16.821 -18.932   0.239
  475   2HB   PRO  68          HB3       PRO  68  17.631 -20.394   0.863
  476   1HG   PRO  68          HG2       PRO  68  18.276 -17.526   1.505
  477   2HG   PRO  68          HG3       PRO  68  18.137 -18.918   2.623
  478   1HD   PRO  68          HD2       PRO  68  20.535 -18.016   1.681
  479   2HD   PRO  68          HD3       PRO  68  20.239 -19.741   2.025
  480    H    PHE  69           H        PHE  69  19.331 -16.946  -0.386
  481    HA   PHE  69           HA       PHE  69  17.750 -15.779  -2.432
  482   1HB   PHE  69          HB2       PHE  69  20.223 -14.922  -0.909
  483   2HB   PHE  69          HB3       PHE  69  19.563 -13.920  -2.175
  484    HD1  PHE  69           HD1      PHE  69  19.040 -15.167   1.251
  485    HD2  PHE  69           HD2      PHE  69  17.387 -12.807  -1.952
  486    HE1  PHE  69           HE1      PHE  69  17.418 -14.138   2.836
  487    HE2  PHE  69           HE2      PHE  69  15.725 -11.858  -0.390
  488    HZ   PHE  69           HZ       PHE  69  15.761 -12.498   2.020
  489    H    TYR  70           H        TYR  70  21.231 -16.732  -2.403
  490    HA   TYR  70           HA       TYR  70  21.796 -15.767  -4.985
  491   1HB   TYR  70          HB2       TYR  70  23.504 -16.280  -3.309
  492   2HB   TYR  70          HB3       TYR  70  23.127 -17.993  -3.452
  493    HD1  TYR  70           HD1      TYR  70  24.134 -15.043  -5.576
  494    HD2  TYR  70           HD2      TYR  70  24.399 -19.307  -4.962
  495    HE1  TYR  70           HE1      TYR  70  25.768 -15.198  -7.417
  496    HE2  TYR  70           HE2      TYR  70  26.076 -19.466  -6.778
  497    HH   TYR  70           HH       TYR  70  27.161 -16.611  -8.667
  498    H    GLU  71           H        GLU  71  20.926 -19.169  -3.962
  499    HA   GLU  71           HA       GLU  71  20.999 -20.191  -6.595
  500   1HB   GLU  71          HB2       GLU  71  19.303 -21.093  -4.223
  501   2HB   GLU  71          HB3       GLU  71  19.571 -22.005  -5.718
  502   1HG   GLU  71          HG2       GLU  71  22.102 -21.686  -5.166
  503   2HG   GLU  71          HG3       GLU  71  21.574 -21.306  -3.549
  504    H    ALA  72           H        ALA  72  18.243 -18.733  -4.766
  505    HA   ALA  72           HA       ALA  72  16.336 -19.155  -6.863
  506   1HB   ALA  72          HB1       ALA  72  14.969 -17.517  -5.648
  507   2HB   ALA  72          HB2       ALA  72  15.708 -18.662  -4.510
  508   3HB   ALA  72          HB3       ALA  72  16.382 -17.022  -4.688
  509    H    LEU  73           H        LEU  73  18.715 -16.508  -6.374
  510    HA   LEU  73           HA       LEU  73  17.603 -14.779  -8.368
  511   1HB   LEU  73          HB2       LEU  73  20.381 -15.172  -7.186
  512   2HB   LEU  73          HB3       LEU  73  20.129 -14.114  -8.539
  513    HG   LEU  73           HG       LEU  73  18.859 -13.860  -5.783
  514   1HD1  LEU  73          HD11      LEU  73  20.937 -12.155  -7.215
  515   2HD1  LEU  73          HD12      LEU  73  20.267 -11.860  -5.593
  516   3HD1  LEU  73          HD13      LEU  73  21.251 -13.299  -5.892
  517   1HD2  LEU  73          HD21      LEU  73  17.235 -12.955  -7.360
  518   2HD2  LEU  73          HD22      LEU  73  18.045 -11.623  -6.564
  519   3HD2  LEU  73          HD23      LEU  73  18.509 -12.065  -8.225
  520    H    GLN  74           H        GLN  74  20.323 -17.130  -8.582
  521    HA   GLN  74           HA       GLN  74  20.547 -16.818 -11.400
  522   1HB   GLN  74          HB2       GLN  74  21.367 -19.358  -9.969
  523   2HB   GLN  74          HB3       GLN  74  22.001 -18.673 -11.465
  524   1HG   GLN  74          HG2       GLN  74  22.668 -16.635  -9.969
  525   2HG   GLN  74          HG3       GLN  74  22.369 -17.747  -8.630
  526   1HE2  GLN  74          HE21      GLN  74  24.519 -16.795 -11.122
  527   2HE2  GLN  74          HE22      GLN  74  25.801 -17.973 -10.810
  528    H    GLU  75           H        GLU  75  18.361 -18.750  -9.567
  529    HA   GLU  75           HA       GLU  75  17.729 -20.660 -11.546
  530   1HB   GLU  75          HB2       GLU  75  17.163 -20.888  -9.166
  531   2HB   GLU  75          HB3       GLU  75  15.975 -19.591  -9.324
  532   1HG   GLU  75          HG2       GLU  75  14.626 -20.968 -10.843
  533   2HG   GLU  75          HG3       GLU  75  15.875 -22.218 -10.860
  534    H    GLN  76           H        GLN  76  16.513 -17.393 -11.019
  535    HA   GLN  76           HA       GLN  76  14.812 -17.670 -13.471
  536   1HB   GLN  76          HB2       GLN  76  13.381 -15.867 -12.409
  537   2HB   GLN  76          HB3       GLN  76  13.251 -17.500 -11.770
  538   1HG   GLN  76          HG2       GLN  76  14.226 -16.995  -9.758
  539   2HG   GLN  76          HG3       GLN  76  15.208 -15.683 -10.405
  540   1HE2  GLN  76          HE22      GLN  76  14.425 -14.761  -8.270
  541   2HE2  GLN  76          HE21      GLN  76  13.029 -13.698  -8.392
  542    H    LYS  77           H        LYS  77  17.296 -15.720 -12.006
  543    HA   LYS  77           HA       LYS  77  17.990 -13.552 -12.373
  544   1HB   LYS  77          HB2       LYS  77  18.383 -14.909 -15.033
  545   2HB   LYS  77          HB3       LYS  77  19.146 -13.377 -14.570
  546   1HG   LYS  77          HG2       LYS  77  20.178 -14.459 -12.637
  547   2HG   LYS  77          HG3       LYS  77  19.435 -16.003 -13.064
  548   1HD   LYS  77          HD2       LYS  77  21.396 -14.536 -14.859
  549   2HD   LYS  77          HD3       LYS  77  21.863 -15.773 -13.678
  550   1HE   LYS  77          HE2       LYS  77  20.357 -17.379 -14.809
  551   2HE   LYS  77          HE3       LYS  77  19.930 -16.160 -16.014
  552   1HZ   LYS  77          HZ1       LYS  77  22.256 -16.132 -16.711
  553   2HZ   LYS  77          HZ2       LYS  77  22.653 -17.260 -15.594
  554   3HZ   LYS  77          HZ3       LYS  77  21.657 -17.640 -16.823
  555    HA   PRO  78           HA       PRO  78  13.922 -12.294 -14.158
  556   1HB   PRO  78          HB2       PRO  78  13.201 -10.398 -12.243
  557   2HB   PRO  78          HB3       PRO  78  12.822 -12.130 -12.213
  558   1HG   PRO  78          HG2       PRO  78  15.062 -10.669 -10.826
  559   2HG   PRO  78          HG3       PRO  78  14.029 -11.971 -10.173
  560   1HD   PRO  78          HD2       PRO  78  16.561 -12.418 -11.103
  561   2HD   PRO  78          HD3       PRO  78  15.257 -13.623 -11.308
  562    H    ASP  79           H        ASP  79  13.011 -10.269 -14.843
  563    HA   ASP  79           HA       ASP  79  15.023  -8.883 -16.393
  564   1HB   ASP  79          HB2       ASP  79  12.891  -9.838 -17.303
  565   2HB   ASP  79          HB3       ASP  79  11.983  -8.625 -16.402
  566    H    LEU  80           H        LEU  80  15.843  -8.032 -14.281
  567    HA   LEU  80           HA       LEU  80  14.432  -5.914 -12.960
  568   1HB   LEU  80          HB2       LEU  80  17.265  -6.933 -12.883
  569   2HB   LEU  80          HB3       LEU  80  16.843  -5.552 -11.971
  570    HG   LEU  80           HG       LEU  80  16.111  -6.597 -10.244
  571   1HD1  LEU  80          HD11      LEU  80  14.441  -8.452 -11.960
  572   2HD1  LEU  80          HD12      LEU  80  14.414  -8.362 -10.182
  573   3HD1  LEU  80          HD13      LEU  80  13.923  -6.966 -11.126
  574   1HD2  LEU  80          HD21      LEU  80  16.781  -8.899  -9.885
  575   2HD2  LEU  80          HD22      LEU  80  16.944  -9.156 -11.635
  576   3HD2  LEU  80          HD23      LEU  80  18.034  -8.029 -10.779
  577    H    SER  81           H        SER  81  15.451  -5.549 -16.002
  578    HA   SER  81           HA       SER  81  17.121  -3.226 -15.915
  579   1HB   SER  81          HB2       SER  81  16.248  -3.105 -18.362
  580   2HB   SER  81          HB3       SER  81  17.249  -4.482 -17.871
  581    HG   SER  81           HG       SER  81  15.397  -5.151 -19.026
  582    H    ALA  82           H        ALA  82  14.016  -3.638 -14.839
  583    HA   ALA  82           HA       ALA  82  13.207  -0.826 -15.442
  584   1HB   ALA  82          HB1       ALA  82  11.617  -2.489 -16.317
  585   2HB   ALA  82          HB2       ALA  82  11.457  -3.203 -14.697
  586   3HB   ALA  82          HB3       ALA  82  10.901  -1.545 -14.999
  587    H    VAL  83           H        VAL  83  14.851  -2.513 -13.118
  588    HA   VAL  83           HA       VAL  83  13.882  -0.622 -11.054
  589    HB   VAL  83           HB       VAL  83  12.878  -2.585 -10.352
  590   1HG1  VAL  83          HG11      VAL  83  13.968  -4.787 -10.090
  591   2HG1  VAL  83          HG12      VAL  83  13.935  -4.248 -11.769
  592   3HG1  VAL  83          HG13      VAL  83  15.441  -4.127 -10.838
  593   1HG2  VAL  83          HG21      VAL  83  15.445  -2.844  -8.766
  594   2HG2  VAL  83          HG22      VAL  83  14.278  -1.542  -8.494
  595   3HG2  VAL  83          HG23      VAL  83  13.778  -3.209  -8.298
  596    H    ARG  84           H        ARG  84  15.525  -0.185  -9.357
  597    HA   ARG  84           HA       ARG  84  18.288  -0.598 -10.340
  598   1HB   ARG  84          HB2       ARG  84  18.949   1.492  -9.695
  599   2HB   ARG  84          HB3       ARG  84  17.453   1.792 -10.570
  600   1HG   ARG  84          HG2       ARG  84  16.327   1.926  -8.255
  601   2HG   ARG  84          HG3       ARG  84  17.962   1.851  -7.566
  602   1HD   ARG  84          HD2       ARG  84  18.398   3.830  -9.335
  603   2HD   ARG  84          HD3       ARG  84  16.654   4.017  -9.190
  604    HE   ARG  84           HE       ARG  84  18.499   3.952  -6.829
  605   1HH1  ARG  84          HH21      ARG  84  16.132   5.764  -8.764
  606   2HH1  ARG  84          HH22      ARG  84  15.872   7.001  -7.601
  607   1HH2  ARG  84          HH11      ARG  84  18.116   5.623  -5.213
  608   2HH2  ARG  84          HH12      ARG  84  17.035   6.910  -5.555
  609    H    PHE  85           H        PHE  85  19.821  -0.834  -8.674
  610    HA   PHE  85           HA       PHE  85  18.713  -2.267  -6.288
  611   1HB   PHE  85          HB2       PHE  85  19.419  -3.938  -7.703
  612   2HB   PHE  85          HB3       PHE  85  20.630  -2.935  -8.482
  613    HD1  PHE  85           HD1      PHE  85  20.169  -4.224  -4.938
  614    HD2  PHE  85           HD2      PHE  85  22.707  -3.836  -8.409
  615    HE1  PHE  85           HE1      PHE  85  22.029  -5.307  -3.714
  616    HE2  PHE  85           HE2      PHE  85  24.545  -4.964  -7.193
  617    HZ   PHE  85           HZ       PHE  85  24.219  -5.677  -4.834
  618    H    GLY  86           H        GLY  86  19.960  -2.076  -4.359
  619   1HA   GLY  86          HA2       GLY  86  22.524  -0.652  -4.421
  620   2HA   GLY  86          HA3       GLY  86  21.256   0.033  -3.382
  621    H    ALA  87           H        ALA  87  23.800  -1.278  -2.550
  622    HA   ALA  87           HA       ALA  87  22.722  -3.598  -1.014
  623   1HB   ALA  87          HB1       ALA  87  25.470  -3.258  -2.303
  624   2HB   ALA  87          HB2       ALA  87  24.941  -4.626  -1.305
  625   3HB   ALA  87          HB3       ALA  87  24.186  -4.342  -2.863
  626    H    ILE  88           H        ILE  88  23.184  -3.504   1.179
  627    HA   ILE  88           HA       ILE  88  24.778  -1.197   2.179
  628    HB   ILE  88           HB       ILE  88  22.001  -2.155   3.013
  629   1HG1  ILE  88          HG12      ILE  88  22.840   0.283   1.414
  630   2HG1  ILE  88          HG13      ILE  88  21.792  -1.031   0.902
  631   1HG2  ILE  88          HG21      ILE  88  23.271  -1.325   4.921
  632   2HG2  ILE  88          HG22      ILE  88  23.635   0.194   4.076
  633   3HG2  ILE  88          HG23      ILE  88  21.980  -0.218   4.529
  634   1HD1  ILE  88          HD11      ILE  88  21.091   1.102   2.939
  635   2HD1  ILE  88          HD12      ILE  88  20.436   0.880   1.317
  636   3HD1  ILE  88          HD13      ILE  88  20.085  -0.326   2.574
  637    H    GLY  89           H        GLY  89  26.280  -1.888   3.590
  638   1HA   GLY  89          HA2       GLY  89  27.256  -3.023   5.374
  639   2HA   GLY  89          HA3       GLY  89  25.808  -4.010   5.558
  640    H    ILE  90           H        ILE  90  25.717  -4.792   2.736
  641    HA   ILE  90           HA       ILE  90  27.279  -7.046   2.384
  642    HB   ILE  90           HB       ILE  90  26.348  -5.038   0.307
  643   1HG1  ILE  90          HG12      ILE  90  24.401  -5.660   1.588
  644   2HG1  ILE  90          HG13      ILE  90  24.307  -6.423   0.023
  645   1HG2  ILE  90          HG21      ILE  90  27.865  -6.628  -0.752
  646   2HG2  ILE  90          HG22      ILE  90  26.923  -7.994  -0.117
  647   3HG2  ILE  90          HG23      ILE  90  26.215  -6.893  -1.304
  648   1HD1  ILE  90          HD11      ILE  90  25.005  -8.592   1.007
  649   2HD1  ILE  90          HD12      ILE  90  25.107  -7.817   2.608
  650   3HD1  ILE  90          HD13      ILE  90  23.551  -7.932   1.767
  651    H    GLY  91           H        GLY  91  29.322  -7.455   1.471
  652   1HA   GLY  91          HA2       GLY  91  31.080  -5.275   0.634
  653   2HA   GLY  91          HA3       GLY  91  31.412  -5.891   2.247
  654    H    SER  92           H        SER  92  30.172  -8.271  -0.008
  655    HA   SER  92           HA       SER  92  32.479  -9.895   0.119
  656   1HB   SER  92          HB2       SER  92  31.133 -11.011  -1.874
  657   2HB   SER  92          HB3       SER  92  30.570 -11.100  -0.208
  658    HG   SER  92           HG       SER  92  29.027 -10.522  -1.860
  659    H    ARG  93           H        ARG  93  31.835  -7.174  -1.939
  660    HA   ARG  93           HA       ARG  93  33.652  -7.796  -4.074
  661   1HB   ARG  93          HB2       ARG  93  33.683  -5.380  -4.447
  662   2HB   ARG  93          HB3       ARG  93  32.058  -6.021  -4.171
  663   1HG   ARG  93          HG2       ARG  93  32.073  -5.171  -1.847
  664   2HG   ARG  93          HG3       ARG  93  33.707  -4.547  -2.081
  665   1HD   ARG  93          HD2       ARG  93  31.985  -2.769  -2.347
  666   2HD   ARG  93          HD3       ARG  93  32.928  -3.020  -3.823
  667    HE   ARG  93           HE       ARG  93  30.347  -4.482  -3.577
  668   1HH1  ARG  93          HH11      ARG  93  32.092  -1.779  -5.134
  669   2HH1  ARG  93          HH12      ARG  93  30.912  -1.580  -6.374
  670   1HH2  ARG  93          HH21      ARG  93  28.731  -4.000  -4.959
  671   2HH2  ARG  93          HH22      ARG  93  28.879  -2.896  -6.267
  672    H    GLU  94           H        GLU  94  34.188  -6.814  -0.823
  673    HA   GLU  94           HA       GLU  94  35.957  -6.936   0.558
  674   1HB   GLU  94          HB2       GLU  94  37.094  -8.418  -1.792
  675   2HB   GLU  94          HB3       GLU  94  37.940  -8.323  -0.256
  676   1HG   GLU  94          HG2       GLU  94  35.061  -9.237  -0.217
  677   2HG   GLU  94          HG3       GLU  94  36.296 -10.376  -0.741
  678    H    TYR  95           H        TYR  95  36.415  -5.501  -2.419
  679    HA   TYR  95           HA       TYR  95  38.786  -4.158  -2.421
  680   1HB   TYR  95          HB2       TYR  95  36.989  -4.141  -4.156
  681   2HB   TYR  95          HB3       TYR  95  36.087  -2.985  -3.188
  682    HD1  TYR  95           HD1      TYR  95  36.415  -0.661  -3.578
  683    HD2  TYR  95           HD2      TYR  95  39.422  -3.479  -4.869
  684    HE1  TYR  95           HE1      TYR  95  37.625   1.166  -4.721
  685    HE2  TYR  95           HE2      TYR  95  40.646  -1.654  -6.014
  686    HH   TYR  95           HH       TYR  95  39.483   1.752  -6.003
  687    H    ASP  96           H        ASP  96  36.456  -3.713   0.060
  688    HA   ASP  96           HA       ASP  96  37.275  -1.090   0.910
  689   1HB   ASP  96          HB2       ASP  96  35.065  -2.156   1.496
  690   2HB   ASP  96          HB3       ASP  96  35.933  -3.361   2.447
  691    H    THR  97           H        THR  97  38.917  -3.703   0.663
  692    HA   THR  97           HA       THR  97  41.162  -2.823   2.223
  693    HB   THR  97           HB       THR  97  40.007  -4.128   3.941
  694    HG1  THR  97           HG1      THR  97  41.749  -5.229   4.555
  695   1HG2  THR  97          HG21      THR  97  40.175  -6.476   2.009
  696   2HG2  THR  97          HG22      THR  97  39.874  -6.629   3.752
  697   3HG2  THR  97          HG23      THR  97  38.721  -5.762   2.730
  698    H    PHE  98           H        PHE  98  42.851  -4.943   1.799
  699    HA   PHE  98           HA       PHE  98  43.348  -4.645  -1.041
  700   1HB   PHE  98          HB2       PHE  98  44.792  -6.317   1.056
  701   2HB   PHE  98          HB3       PHE  98  45.409  -5.897  -0.534
  702    HD1  PHE  98           HD1      PHE  98  45.051  -4.799   2.918
  703    HD2  PHE  98           HD2      PHE  98  45.863  -3.446  -1.101
  704    HE1  PHE  98           HE1      PHE  98  46.028  -2.705   3.817
  705    HE2  PHE  98           HE2      PHE  98  46.841  -1.353  -0.194
  706    HZ   PHE  98           HZ       PHE  98  46.926  -0.977   2.265
  707    H    CYS  99           H        CYS  99  41.655  -7.050   0.799
  708    HA   CYS  99           HA       CYS  99  42.376  -9.406  -0.558
  709   1HB   CYS  99          HB2       CYS  99  39.765  -8.694   0.848
  710   2HB   CYS  99          HB3       CYS  99  40.318 -10.331   0.465
  711    HG   CYS  99           HG       CYS  99  40.635  -9.881   3.018
  712    H    GLY 100           H        GLY 100  41.183 -10.720  -2.067
  713   1HA   GLY 100          HA2       GLY 100  40.161  -9.177  -4.333
  714   2HA   GLY 100          HA3       GLY 100  40.521 -10.903  -4.288
  715    H    ALA 101           H        ALA 101  38.174  -9.670  -5.418
  716    HA   ALA 101           HA       ALA 101  35.978  -9.635  -3.605
  717   1HB   ALA 101          HB1       ALA 101  34.634  -9.333  -5.652
  718   2HB   ALA 101          HB2       ALA 101  36.090  -8.325  -5.721
  719   3HB   ALA 101          HB3       ALA 101  36.007  -9.837  -6.654
  720    H    ILE 102           H        ILE 102  34.221 -10.928  -3.418
  721    HA   ILE 102           HA       ILE 102  33.951 -13.487  -4.843
  722    HB   ILE 102           HB       ILE 102  33.233 -14.596  -2.749
  723   1HG1  ILE 102          HG12      ILE 102  34.408 -12.203  -1.252
  724   2HG1  ILE 102          HG13      ILE 102  32.686 -12.534  -1.430
  725   1HG2  ILE 102          HG21      ILE 102  35.553 -14.833  -3.670
  726   2HG2  ILE 102          HG22      ILE 102  36.099 -13.606  -2.504
  727   3HG2  ILE 102          HG23      ILE 102  35.427 -15.149  -1.939
  728   1HD1  ILE 102          HD11      ILE 102  33.366 -13.288   0.733
  729   2HD1  ILE 102          HD12      ILE 102  32.999 -14.717  -0.253
  730   3HD1  ILE 102          HD13      ILE 102  34.690 -14.253   0.062
  731    H    ASP 103           H        ASP 103  32.844 -10.807  -5.157
  732    HA   ASP 103           HA       ASP 103  30.378 -10.365  -3.845
  733   1HB   ASP 103          HB2       ASP 103  30.278  -8.384  -5.075
  734   2HB   ASP 103          HB3       ASP 103  31.978  -8.675  -4.794
  735    H    LYS 104           H        LYS 104  30.180 -12.941  -5.168
  736    HA   LYS 104           HA       LYS 104  29.000 -12.818  -7.729
  737   1HB   LYS 104          HB2       LYS 104  28.469 -14.909  -5.604
  738   2HB   LYS 104          HB3       LYS 104  28.208 -15.074  -7.335
  739   1HG   LYS 104          HG2       LYS 104  30.637 -14.845  -7.696
  740   2HG   LYS 104          HG3       LYS 104  30.899 -14.729  -5.944
  741   1HD   LYS 104          HD2       LYS 104  29.794 -16.960  -5.672
  742   2HD   LYS 104          HD3       LYS 104  29.710 -17.122  -7.427
  743   1HE   LYS 104          HE2       LYS 104  32.273 -16.768  -5.801
  744   2HE   LYS 104          HE3       LYS 104  31.633 -18.319  -6.333
  745   1HZ   LYS 104          HZ1       LYS 104  32.531 -16.153  -8.147
  746   2HZ   LYS 104          HZ2       LYS 104  33.324 -17.540  -7.843
  747   3HZ   LYS 104          HZ3       LYS 104  31.903 -17.585  -8.633
  748    H    LEU 105           H        LEU 105  27.479 -12.197  -4.548
  749    HA   LEU 105           HA       LEU 105  24.764 -12.464  -5.472
  750   1HB   LEU 105          HB2       LEU 105  25.332 -12.478  -3.124
  751   2HB   LEU 105          HB3       LEU 105  26.040 -10.874  -3.203
  752    HG   LEU 105           HG       LEU 105  23.806 -11.067  -2.119
  753   1HD1  LEU 105          HD11      LEU 105  24.693  -8.893  -2.954
  754   2HD1  LEU 105          HD12      LEU 105  23.713  -9.119  -4.420
  755   3HD1  LEU 105          HD13      LEU 105  22.928  -8.993  -2.844
  756   1HD2  LEU 105          HD21      LEU 105  22.681 -11.317  -4.933
  757   2HD2  LEU 105          HD22      LEU 105  22.764 -12.645  -3.756
  758   3HD2  LEU 105          HD23      LEU 105  21.771 -11.214  -3.419
  759    H    GLU 106           H        GLU 106  26.870  -9.548  -4.982
  760    HA   GLU 106           HA       GLU 106  24.950  -7.762  -6.088
  761   1HB   GLU 106          HB2       GLU 106  27.975  -7.334  -6.163
  762   2HB   GLU 106          HB3       GLU 106  26.710  -6.116  -6.171
  763   1HG   GLU 106          HG2       GLU 106  26.084  -6.824  -3.825
  764   2HG   GLU 106          HG3       GLU 106  27.490  -7.896  -3.819
  765    H    ALA 107           H        ALA 107  27.559  -9.684  -7.535
  766    HA   ALA 107           HA       ALA 107  27.580  -8.503 -10.107
  767   1HB   ALA 107          HB1       ALA 107  28.218 -11.376  -9.303
  768   2HB   ALA 107          HB2       ALA 107  28.705 -10.569 -10.804
  769   3HB   ALA 107          HB3       ALA 107  29.358 -10.010  -9.250
  770    H    GLU 108           H        GLU 108  25.722 -11.439  -8.867
  771    HA   GLU 108           HA       GLU 108  24.507 -11.868 -11.417
  772   1HB   GLU 108          HB2       GLU 108  23.873 -12.769  -8.608
  773   2HB   GLU 108          HB3       GLU 108  22.872 -13.203  -9.981
  774   1HG   GLU 108          HG2       GLU 108  25.820 -13.891  -9.674
  775   2HG   GLU 108          HG3       GLU 108  24.449 -14.982  -9.474
  776    H    LEU 109           H        LEU 109  23.528  -9.851  -8.623
  777    HA   LEU 109           HA       LEU 109  20.884  -9.312  -9.592
  778   1HB   LEU 109          HB2       LEU 109  22.804  -7.767  -7.799
  779   2HB   LEU 109          HB3       LEU 109  21.212  -7.138  -8.208
  780    HG   LEU 109           HG       LEU 109  21.698  -9.799  -6.807
  781   1HD1  LEU 109          HD11      LEU 109  20.949  -8.706  -4.787
  782   2HD1  LEU 109          HD12      LEU 109  22.287  -7.761  -5.461
  783   3HD1  LEU 109          HD13      LEU 109  20.623  -7.192  -5.664
  784   1HD2  LEU 109          HD21      LEU 109  19.568  -9.867  -7.996
  785   2HD2  LEU 109          HD22      LEU 109  19.245  -9.607  -6.280
  786   3HD2  LEU 109          HD23      LEU 109  19.142  -8.242  -7.410
  787    H    LYS 110           H        LYS 110  23.978  -7.505 -10.095
  788    HA   LYS 110           HA       LYS 110  22.600  -5.639 -11.754
  789   1HB   LYS 110          HB2       LYS 110  24.592  -4.460 -12.199
  790   2HB   LYS 110          HB3       LYS 110  24.345  -4.797 -10.475
  791   1HG   LYS 110          HG2       LYS 110  25.628  -6.949 -11.110
  792   2HG   LYS 110          HG3       LYS 110  26.359  -5.976 -12.383
  793   1HD   LYS 110          HD2       LYS 110  26.467  -5.437  -9.362
  794   2HD   LYS 110          HD3       LYS 110  27.805  -5.973 -10.382
  795   1HE   LYS 110          HE2       LYS 110  27.740  -3.868 -11.654
  796   2HE   LYS 110          HE3       LYS 110  26.335  -3.320 -10.733
  797   1HZ   LYS 110          HZ1       LYS 110  27.698  -3.268  -8.741
  798   2HZ   LYS 110          HZ2       LYS 110  29.003  -3.853  -9.560
  799   3HZ   LYS 110          HZ3       LYS 110  28.415  -2.376  -9.909
  800    H    ASN 111           H        ASN 111  24.250  -8.641 -12.422
  801    HA   ASN 111           HA       ASN 111  24.262  -8.449 -15.285
  802   1HB   ASN 111          HB2       ASN 111  25.540 -10.209 -14.666
  803   2HB   ASN 111          HB3       ASN 111  24.692 -10.475 -13.178
  804   1HD2  ASN 111          HD21      ASN 111  22.796 -11.742 -13.021
  805   2HD2  ASN 111          HD22      ASN 111  22.625 -13.053 -14.149
  806    H    SER 112           H        SER 112  21.774  -9.368 -12.872
  807    HA   SER 112           HA       SER 112  20.007 -10.528 -14.792
  808   1HB   SER 112          HB2       SER 112  19.408  -9.407 -12.058
  809   2HB   SER 112          HB3       SER 112  18.306 -10.391 -13.037
  810    HG   SER 112           HG       SER 112  20.808 -11.129 -11.926
  811    H    GLY 113           H        GLY 113  20.462  -7.170 -13.658
  812   1HA   GLY 113          HA2       GLY 113  19.844  -5.987 -15.983
  813   2HA   GLY 113          HA3       GLY 113  18.225  -6.206 -15.322
  814    H    ALA 114           H        ALA 114  19.254  -5.726 -12.459
  815    HA   ALA 114           HA       ALA 114  18.451  -3.005 -12.543
  816   1HB   ALA 114          HB1       ALA 114  18.900  -3.005 -10.104
  817   2HB   ALA 114          HB2       ALA 114  17.913  -4.371 -10.574
  818   3HB   ALA 114          HB3       ALA 114  19.648  -4.614 -10.242
  819    H    LYS 115           H        LYS 115  19.612  -1.064 -12.180
  820    HA   LYS 115           HA       LYS 115  22.538  -1.220 -12.632
  821   1HB   LYS 115          HB2       LYS 115  22.454   1.232 -12.690
  822   2HB   LYS 115          HB3       LYS 115  21.437   0.485 -13.916
  823   1HG   LYS 115          HG2       LYS 115  19.431   0.922 -12.528
  824   2HG   LYS 115          HG3       LYS 115  20.425   1.705 -11.314
  825   1HD   LYS 115          HD2       LYS 115  20.204   2.618 -14.205
  826   2HD   LYS 115          HD3       LYS 115  19.155   3.231 -12.923
  827   1HE   LYS 115          HE2       LYS 115  22.131   3.232 -12.573
  828   2HE   LYS 115          HE3       LYS 115  21.402   4.493 -13.589
  829   1HZ   LYS 115          HZ1       LYS 115  20.793   4.039 -10.707
  830   2HZ   LYS 115          HZ2       LYS 115  21.638   5.280 -11.345
  831   3HZ   LYS 115          HZ3       LYS 115  20.051   5.145 -11.670
  832    H    GLN 116           H        GLN 116  23.943  -1.129 -10.895
  833    HA   GLN 116           HA       GLN 116  22.809  -0.911  -8.205
  834   1HB   GLN 116          HB2       GLN 116  24.650  -2.495  -8.662
  835   2HB   GLN 116          HB3       GLN 116  25.713  -1.125  -9.018
  836   1HG   GLN 116          HG2       GLN 116  25.472  -0.269  -6.741
  837   2HG   GLN 116          HG3       GLN 116  24.167  -1.409  -6.411
  838   1HE2  GLN 116          HE22      GLN 116  25.249  -2.181  -4.561
  839   2HE2  GLN 116          HE21      GLN 116  26.598  -3.272  -4.648
  840    H    THR 117           H        THR 117  22.080   1.179  -7.761
  841    HA   THR 117           HA       THR 117  23.355   3.481  -9.028
  842    HB   THR 117           HB       THR 117  21.154   3.176  -6.949
  843    HG1  THR 117           HG1      THR 117  20.769   2.336  -9.029
  844   1HG2  THR 117          HG21      THR 117  22.094   5.435  -6.762
  845   2HG2  THR 117          HG22      THR 117  22.035   5.636  -8.526
  846   3HG2  THR 117          HG23      THR 117  20.527   5.502  -7.596
  847    H    GLY 118           H        GLY 118  24.538   5.126  -7.954
  848   1HA   GLY 118          HA2       GLY 118  26.120   5.968  -6.534
  849   2HA   GLY 118          HA3       GLY 118  25.236   5.190  -5.210
  850    H    GLU 119           H        GLU 119  26.482   3.832  -4.105
  851    HA   GLU 119           HA       GLU 119  27.788   1.643  -5.396
  852   1HB   GLU 119          HB2       GLU 119  30.022   1.887  -4.630
  853   2HB   GLU 119          HB3       GLU 119  29.619   3.395  -5.441
  854   1HG   GLU 119          HG2       GLU 119  29.148   4.409  -3.176
  855   2HG   GLU 119          HG3       GLU 119  29.813   2.925  -2.472
  856    H    THR 120           H        THR 120  28.483   0.019  -3.694
  857    HA   THR 120           HA       THR 120  26.589  -0.491  -1.836
  858    HB   THR 120           HB       THR 120  29.520  -1.292  -1.746
  859    HG1  THR 120           HG1      THR 120  28.017  -3.062  -3.002
  860   1HG2  THR 120          HG21      THR 120  28.363  -2.096   0.230
  861   2HG2  THR 120          HG22      THR 120  27.009  -2.697  -0.737
  862   3HG2  THR 120          HG23      THR 120  28.613  -3.450  -0.889
  863    H    LEU 121           H        LEU 121  26.122  -0.004   0.150
  864    HA   LEU 121           HA       LEU 121  27.420   2.286   1.483
  865   1HB   LEU 121          HB2       LEU 121  24.802   1.535   0.880
  866   2HB   LEU 121          HB3       LEU 121  24.941   1.003   2.547
  867    HG   LEU 121           HG       LEU 121  25.436   3.783   1.491
  868   1HD1  LEU 121          HD11      LEU 121  23.081   3.103   1.335
  869   2HD1  LEU 121          HD12      LEU 121  23.072   2.733   3.076
  870   3HD1  LEU 121          HD13      LEU 121  23.322   4.402   2.504
  871   1HD2  LEU 121          HD21      LEU 121  25.371   2.758   4.365
  872   2HD2  LEU 121          HD22      LEU 121  26.721   3.584   3.527
  873   3HD2  LEU 121          HD23      LEU 121  25.263   4.468   3.929
  874    H    LYS 122           H        LYS 122  27.711   2.102   3.919
  875    HA   LYS 122           HA       LYS 122  27.873  -0.670   4.975
  876   1HB   LYS 122          HB2       LYS 122  29.985   1.484   5.266
  877   2HB   LYS 122          HB3       LYS 122  29.888   0.065   6.298
  878   1HG   LYS 122          HG2       LYS 122  30.362  -1.425   4.528
  879   2HG   LYS 122          HG3       LYS 122  30.219  -0.175   3.283
  880   1HD   LYS 122          HD2       LYS 122  32.316  -0.117   5.503
  881   2HD   LYS 122          HD3       LYS 122  32.593  -0.835   3.907
  882   1HE   LYS 122          HE2       LYS 122  32.146   1.307   2.802
  883   2HE   LYS 122          HE3       LYS 122  31.772   2.069   4.355
  884   1HZ   LYS 122          HZ1       LYS 122  34.030   1.818   5.034
  885   2HZ   LYS 122          HZ2       LYS 122  34.432   0.929   3.696
  886   3HZ   LYS 122          HZ3       LYS 122  34.035   2.511   3.560
  887    H    ILE 123           H        ILE 123  27.218  -0.807   7.060
  888    HA   ILE 123           HA       ILE 123  26.477   1.540   8.690
  889    HB   ILE 123           HB       ILE 123  24.321   0.249   9.149
  890   1HG1  ILE 123          HG12      ILE 123  23.412  -1.098   7.267
  891   2HG1  ILE 123          HG13      ILE 123  24.966  -1.164   6.502
  892   1HG2  ILE 123          HG21      ILE 123  24.587   1.361   6.328
  893   2HG2  ILE 123          HG22      ILE 123  23.119   1.271   7.318
  894   3HG2  ILE 123          HG23      ILE 123  24.442   2.338   7.804
  895   1HD1  ILE 123          HD11      ILE 123  24.497  -2.289   9.293
  896   2HD1  ILE 123          HD12      ILE 123  24.167  -3.210   7.812
  897   3HD1  ILE 123          HD13      ILE 123  25.808  -2.676   8.146
  898    H    ASN 124           H        ASN 124  26.157   0.790  10.976
  899    HA   ASN 124           HA       ASN 124  26.869  -1.939  11.545
  900   1HB   ASN 124          HB2       ASN 124  29.165  -0.747  11.230
  901   2HB   ASN 124          HB3       ASN 124  28.783   0.136  12.712
  902   1HD2  ASN 124          HD22      ASN 124  28.451  -3.314  11.583
  903   2HD2  ASN 124          HD21      ASN 124  29.154  -3.987  13.041
  904    H    ILE 125           H        ILE 125  26.643  -2.494  13.808
  905    HA   ILE 125           HA       ILE 125  25.564  -0.539  15.677
  906    HB   ILE 125           HB       ILE 125  23.690  -2.050  16.297
  907   1HG1  ILE 125          HG12      ILE 125  24.118  -3.473  13.632
  908   2HG1  ILE 125          HG13      ILE 125  24.614  -4.134  15.191
  909   1HG2  ILE 125          HG21      ILE 125  23.414  -1.053  13.438
  910   2HG2  ILE 125          HG22      ILE 125  22.125  -1.261  14.643
  911   3HG2  ILE 125          HG23      ILE 125  23.358  -0.024  14.881
  912   1HD1  ILE 125          HD11      ILE 125  22.505  -5.110  14.578
  913   2HD1  ILE 125          HD12      ILE 125  22.251  -4.051  15.979
  914   3HD1  ILE 125          HD13      ILE 125  21.760  -3.524  14.352
  915    H    LEU 126           H        LEU 126  25.414  -1.671  17.862
  916    HA   LEU 126           HA       LEU 126  26.533  -2.574  19.582
  917   1HB   LEU 126          HB2       LEU 126  27.249  -4.908  17.779
  918   2HB   LEU 126          HB3       LEU 126  27.257  -4.882  19.535
  919    HG   LEU 126           HG       LEU 126  24.776  -4.673  17.780
  920   1HD1  LEU 126          HD11      LEU 126  25.817  -6.906  17.789
  921   2HD1  LEU 126          HD12      LEU 126  25.789  -6.925  19.565
  922   3HD1  LEU 126          HD13      LEU 126  24.268  -6.911  18.644
  923   1HD2  LEU 126          HD21      LEU 126  23.515  -4.944  19.907
  924   2HD2  LEU 126          HD22      LEU 126  25.032  -4.789  20.821
  925   3HD2  LEU 126          HD23      LEU 126  24.410  -3.425  19.865
  926    H    ASP 127           H        ASP 127  28.974  -3.933  19.847
  927    HA   ASP 127           HA       ASP 127  30.826  -1.775  19.528
  928   1HB   ASP 127          HB2       ASP 127  31.036  -3.423  21.316
  929   2HB   ASP 127          HB3       ASP 127  31.257  -4.723  20.140
  930    H    HIS 128           H        HIS 128  30.194  -4.726  17.616
  931    HA   HIS 128           HA       HIS 128  31.348  -3.662  15.229
  932   1HB   HIS 128          HB2       HIS 128  33.111  -5.355  14.926
  933   2HB   HIS 128          HB3       HIS 128  33.463  -4.368  16.329
  934    HD1  HIS 128           HD1      HIS 128  33.439  -5.621  18.727
  935    HD2  HIS 128           HD2      HIS 128  32.503  -7.978  15.353
  936    HE1  HIS 128           HE1      HIS 128  33.491  -8.050  19.501
  937    H    ASP 129           H        ASP 129  31.347  -5.617  13.544
  938    HA   ASP 129           HA       ASP 129  29.743  -7.882  14.244
  939   1HB   ASP 129          HB2       ASP 129  28.213  -5.750  13.257
  940   2HB   ASP 129          HB3       ASP 129  28.466  -6.670  11.829
  941    H    ILE 130           H        ILE 130  30.228  -6.120  11.254
  942    HA   ILE 130           HA       ILE 130  32.447  -7.903  10.393
  943    HB   ILE 130           HB       ILE 130  29.796  -7.582   8.986
  944   1HG1  ILE 130          HG12      ILE 130  31.595  -9.922   9.604
  945   2HG1  ILE 130          HG13      ILE 130  30.087  -9.506  10.415
  946   1HG2  ILE 130          HG21      ILE 130  31.415  -6.899   7.256
  947   2HG2  ILE 130          HG22      ILE 130  32.411  -8.329   7.615
  948   3HG2  ILE 130          HG23      ILE 130  30.795  -8.489   6.895
  949   1HD1  ILE 130          HD11      ILE 130  29.651 -11.354   8.985
  950   2HD1  ILE 130          HD12      ILE 130  28.852  -9.941   8.282
  951   3HD1  ILE 130          HD13      ILE 130  30.371 -10.560   7.584
  952    HA   PRO 131           HA       PRO 131  32.986  -4.117   7.712
  953   1HB   PRO 131          HB2       PRO 131  31.320  -1.944   7.662
  954   2HB   PRO 131          HB3       PRO 131  31.006  -3.432   6.715
  955   1HG   PRO 131          HG2       PRO 131  29.883  -2.706   9.447
  956   2HG   PRO 131          HG3       PRO 131  28.990  -3.239   8.011
  957   1HD   PRO 131          HD2       PRO 131  29.647  -5.009   9.912
  958   2HD   PRO 131          HD3       PRO 131  29.789  -5.449   8.185
  959    H    GLU 132           H        GLU 132  31.345  -3.012  10.653
  960    HA   GLU 132           HA       GLU 132  31.954  -1.764  12.445
  961   1HB   GLU 132          HB2       GLU 132  33.792  -3.619  12.351
  962   2HB   GLU 132          HB3       GLU 132  34.871  -2.308  11.872
  963   1HG   GLU 132          HG2       GLU 132  34.048  -1.095  14.019
  964   2HG   GLU 132          HG3       GLU 132  33.294  -2.619  14.454
  965    H    ASP 133           H        ASP 133  31.805  -0.497   9.704
  966    HA   ASP 133           HA       ASP 133  33.086   2.094  10.310
  967   1HB   ASP 133          HB2       ASP 133  34.851   0.886   9.157
  968   2HB   ASP 133          HB3       ASP 133  33.743   0.409   7.868
  969    HA   PRO 134           HA       PRO 134  28.789   2.449   8.510
  970   1HB   PRO 134          HB2       PRO 134  29.052   4.879  10.283
  971   2HB   PRO 134          HB3       PRO 134  27.610   3.859   9.978
  972   1HG   PRO 134          HG2       PRO 134  29.034   3.584  12.270
  973   2HG   PRO 134          HG3       PRO 134  28.454   2.134  11.391
  974   1HD   PRO 134          HD2       PRO 134  31.216   3.374  11.354
  975   2HD   PRO 134          HD3       PRO 134  30.751   1.652  11.485
  976    H    ALA 135           H        ALA 135  28.157   3.855   6.860
  977    HA   ALA 135           HA       ALA 135  29.868   6.148   6.098
  978   1HB   ALA 135          HB1       ALA 135  29.156   3.800   4.276
  979   2HB   ALA 135          HB2       ALA 135  30.030   5.268   3.800
  980   3HB   ALA 135          HB3       ALA 135  30.772   4.139   4.944
  981    H    GLU 136           H        GLU 136  27.382   6.288   7.360
  982    HA   GLU 136           HA       GLU 136  25.117   6.050   5.682
  983   1HB   GLU 136          HB2       GLU 136  23.914   7.239   7.415
  984   2HB   GLU 136          HB3       GLU 136  24.914   5.964   8.083
  985   1HG   GLU 136          HG2       GLU 136  25.969   8.813   8.040
  986   2HG   GLU 136          HG3       GLU 136  24.744   8.353   9.207
  987    H    GLU 137           H        GLU 137  27.501   8.545   5.670
  988    HA   GLU 137           HA       GLU 137  25.997  10.735   4.628
  989   1HB   GLU 137          HB2       GLU 137  28.849   9.803   4.074
  990   2HB   GLU 137          HB3       GLU 137  28.196  11.355   3.556
  991   1HG   GLU 137          HG2       GLU 137  28.459  10.444   6.458
  992   2HG   GLU 137          HG3       GLU 137  29.573  11.509   5.614
  993    H    TRP 138           H        TRP 138  26.971   7.653   3.151
  994    HA   TRP 138           HA       TRP 138  26.519   8.259   0.407
  995   1HB   TRP 138          HB2       TRP 138  26.146   5.809   2.131
  996   2HB   TRP 138          HB3       TRP 138  25.587   5.827   0.478
  997    HD1  TRP 138           HD1      TRP 138  26.901   4.054  -0.514
  998    HE1  TRP 138           HE1      TRP 138  29.319   3.489  -0.916
  999    HE3  TRP 138           HE3      TRP 138  29.063   7.866   2.189
 1000    HZ2  TRP 138           HZ2      TRP 138  31.927   4.552  -0.173
 1001    HZ3  TRP 138           HZ3      TRP 138  31.520   8.048   2.310
 1002    HH2  TRP 138           HH2      TRP 138  32.968   6.399   1.140
 1003    H    LEU 139           H        LEU 139  24.266   7.296   3.079
 1004    HA   LEU 139           HA       LEU 139  21.953   6.925   1.438
 1005   1HB   LEU 139          HB2       LEU 139  22.570   6.360   4.015
 1006   2HB   LEU 139          HB3       LEU 139  21.839   7.893   4.316
 1007    HG   LEU 139           HG       LEU 139  19.763   7.102   3.036
 1008   1HD1  LEU 139          HD11      LEU 139  21.096   4.382   3.450
 1009   2HD1  LEU 139          HD12      LEU 139  19.425   4.638   2.937
 1010   3HD1  LEU 139          HD13      LEU 139  20.746   5.129   1.875
 1011   1HD2  LEU 139          HD21      LEU 139  20.625   5.699   5.599
 1012   2HD2  LEU 139          HD22      LEU 139  19.866   7.297   5.475
 1013   3HD2  LEU 139          HD23      LEU 139  18.942   5.854   5.027
 1014    H    GLY 140           H        GLY 140  23.071   9.541   3.517
 1015   1HA   GLY 140          HA2       GLY 140  21.096  11.486   3.041
 1016   2HA   GLY 140          HA3       GLY 140  22.793  11.858   3.408
 1017    H    SER 141           H        SER 141  24.216  11.087   1.240
 1018    HA   SER 141           HA       SER 141  23.679  13.124  -0.647
 1019   1HB   SER 141          HB2       SER 141  25.898  12.043  -0.045
 1020   2HB   SER 141          HB3       SER 141  25.423  10.646  -1.027
 1021    HG   SER 141           HG       SER 141  26.718  12.192  -2.153
 1022    H    TRP 142           H        TRP 142  23.094   9.573  -0.800
 1023    HA   TRP 142           HA       TRP 142  22.138   9.409  -3.442
 1024   1HB   TRP 142          HB2       TRP 142  22.914   7.544  -2.123
 1025   2HB   TRP 142          HB3       TRP 142  21.645   7.795  -0.943
 1026    HD1  TRP 142           HD1      TRP 142  22.131   6.488  -4.516
 1027    HE1  TRP 142           HE1      TRP 142  20.408   4.658  -4.931
 1028    HE3  TRP 142           HE3      TRP 142  19.436   6.988  -0.221
 1029    HZ2  TRP 142           HZ2      TRP 142  17.945   3.689  -3.654
 1030    HZ3  TRP 142           HZ3      TRP 142  17.374   5.644   0.141
 1031    HH2  TRP 142           HH2      TRP 142  16.621   4.010  -1.574
 1032    H    VAL 143           H        VAL 143  20.369  10.048  -0.366
 1033    HA   VAL 143           HA       VAL 143  17.772  10.289  -1.512
 1034    HB   VAL 143           HB       VAL 143  19.067  11.280   1.035
 1035   1HG1  VAL 143          HG11      VAL 143  17.444  13.011   0.574
 1036   2HG1  VAL 143          HG12      VAL 143  16.204  11.800   0.153
 1037   3HG1  VAL 143          HG13      VAL 143  16.798  11.950   1.827
 1038   1HG2  VAL 143          HG21      VAL 143  17.536   9.662   2.063
 1039   2HG2  VAL 143          HG22      VAL 143  16.798   9.309   0.485
 1040   3HG2  VAL 143          HG23      VAL 143  18.482   8.859   0.809
 1041    H    ASN 144           H        ASN 144  20.334  12.793  -0.898
 1042    HA   ASN 144           HA       ASN 144  18.839  14.942  -1.968
 1043   1HB   ASN 144          HB2       ASN 144  21.861  14.577  -1.999
 1044   2HB   ASN 144          HB3       ASN 144  21.015  16.087  -2.281
 1045   1HD2  ASN 144          HD22      ASN 144  22.981  15.287  -0.130
 1046   2HD2  ASN 144          HD21      ASN 144  22.161  15.562   1.379
 1047    H    LEU 145           H        LEU 145  20.711  12.425  -3.577
 1048    HA   LEU 145           HA       LEU 145  20.836  13.737  -6.155
 1049   1HB   LEU 145          HB2       LEU 145  21.708  11.145  -4.979
 1050   2HB   LEU 145          HB3       LEU 145  21.167  11.021  -6.642
 1051    HG   LEU 145           HG       LEU 145  22.727  12.781  -7.347
 1052   1HD1  LEU 145          HD11      LEU 145  24.522  13.575  -5.877
 1053   2HD1  LEU 145          HD12      LEU 145  22.954  14.057  -5.215
 1054   3HD1  LEU 145          HD13      LEU 145  23.830  12.687  -4.506
 1055   1HD2  LEU 145          HD21      LEU 145  24.037  10.508  -5.790
 1056   2HD2  LEU 145          HD22      LEU 145  23.382  10.404  -7.438
 1057   3HD2  LEU 145          HD23      LEU 145  24.783  11.436  -7.111
 1058    H    LEU 146           H        LEU 146  18.750  11.072  -4.792
 1059    HA   LEU 146           HA       LEU 146  17.271  10.848  -7.229
 1060   1HB   LEU 146          HB2       LEU 146  15.967   9.280  -6.068
 1061   2HB   LEU 146          HB3       LEU 146  17.656   9.019  -5.688
 1062    HG   LEU 146           HG       LEU 146  17.024  10.413  -3.517
 1063   1HD1  LEU 146          HD11      LEU 146  14.788   9.900  -2.658
 1064   2HD1  LEU 146          HD12      LEU 146  14.644  10.888  -4.103
 1065   3HD1  LEU 146          HD13      LEU 146  14.338   9.147  -4.203
 1066   1HD2  LEU 146          HD21      LEU 146  16.607   8.337  -2.308
 1067   2HD2  LEU 146          HD22      LEU 146  16.168   7.506  -3.804
 1068   3HD2  LEU 146          HD23      LEU 146  17.842   8.075  -3.535
 1069    H    LYS 147           H        LYS 147  16.858  12.785  -4.309
 1070    HA   LYS 147           HA       LYS 147  14.215  13.702  -4.693
 1071   1HB   LYS 147          HB2       LYS 147  16.707  14.781  -3.354
 1072   2HB   LYS 147          HB3       LYS 147  15.332  15.864  -3.606
 1073   1HG   LYS 147          HG2       LYS 147  13.821  14.314  -2.435
 1074   2HG   LYS 147          HG3       LYS 147  15.155  13.184  -2.156
 1075   1HD   LYS 147          HD2       LYS 147  16.325  14.873  -0.795
 1076   2HD   LYS 147          HD3       LYS 147  15.057  16.066  -1.147
 1077   1HE   LYS 147          HE2       LYS 147  13.415  14.549  -0.071
 1078   2HE   LYS 147          HE3       LYS 147  14.708  13.427   0.350
 1079   1HZ   LYS 147          HZ1       LYS 147  15.695  15.209   1.707
 1080   2HZ   LYS 147          HZ2       LYS 147  14.482  16.230   1.310
 1081   3HZ   LYS 147          HZ3       LYS 147  14.169  14.904   2.198
  Start of MODEL   14
    1   1H    MET   1          H1        MET   1   1.437   1.258   0.614
    2   2H    MET   1          H2        MET   1   1.427   2.194  -0.724
    3   3H    MET   1          H3        MET   1   0.377   0.932  -0.599
    4    HA   MET   1           HA       MET   1   2.240  -0.623  -0.577
    5   1HB   MET   1          HB2       MET   1   2.037   1.224  -3.002
    6   2HB   MET   1          HB3       MET   1   3.017  -0.238  -2.963
    7   1HG   MET   1          HG2       MET   1   1.001  -0.809  -4.029
    8   2HG   MET   1          HG3       MET   1   1.000  -1.594  -2.455
    9   1HE   MET   1          HE1       MET   1  -2.805  -1.000  -3.208
   10   2HE   MET   1          HE2       MET   1  -1.526  -1.392  -4.377
   11   3HE   MET   1          HE3       MET   1  -1.553  -2.190  -2.788
   12    H    ALA   2           H        ALA   2   4.505  -0.963  -0.582
   13    HA   ALA   2           HA       ALA   2   6.182   1.253   0.291
   14   1HB   ALA   2          HB1       ALA   2   6.569  -1.008   1.146
   15   2HB   ALA   2          HB2       ALA   2   6.865  -1.608  -0.502
   16   3HB   ALA   2          HB3       ALA   2   7.981  -0.445   0.231
   17    H    ASP   3           H        ASP   3   8.064   1.966  -0.856
   18    HA   ASP   3           HA       ASP   3   7.920   1.880  -3.820
   19   1HB   ASP   3          HB2       ASP   3   7.791   4.129  -2.556
   20   2HB   ASP   3          HB3       ASP   3   9.417   3.805  -2.004
   21    H    ILE   4           H        ILE   4   9.797   1.045  -0.978
   22    HA   ILE   4           HA       ILE   4  11.972  -0.025  -2.691
   23    HB   ILE   4           HB       ILE   4  12.421   1.206   0.041
   24   1HG1  ILE   4          HG12      ILE   4  12.844   2.644  -2.606
   25   2HG1  ILE   4          HG13      ILE   4  11.631   3.059  -1.394
   26   1HG2  ILE   4          HG21      ILE   4  14.078  -0.444  -0.826
   27   2HG2  ILE   4          HG22      ILE   4  14.309   0.552  -2.261
   28   3HG2  ILE   4          HG23      ILE   4  14.774   1.157  -0.659
   29   1HD1  ILE   4          HD11      ILE   4  13.450   3.570   0.228
   30   2HD1  ILE   4          HD12      ILE   4  14.634   3.337  -1.085
   31   3HD1  ILE   4          HD13      ILE   4  13.421   4.612  -1.207
   32    H    THR   5           H        THR   5  12.378  -2.141  -2.268
   33    HA   THR   5           HA       THR   5  11.202  -3.410   0.142
   34    HB   THR   5           HB       THR   5  10.804  -4.502  -2.078
   35    HG1  THR   5           HG1      THR   5  10.943  -5.929  -0.441
   36   1HG2  THR   5          HG21      THR   5  12.777  -3.797  -3.334
   37   2HG2  THR   5          HG22      THR   5  13.800  -4.865  -2.343
   38   3HG2  THR   5          HG23      THR   5  12.535  -5.546  -3.379
   39    H    LEU   6           H        LEU   6  12.559  -3.903   1.878
   40    HA   LEU   6           HA       LEU   6  15.503  -3.386   1.596
   41   1HB   LEU   6          HB2       LEU   6  13.554  -3.109   3.887
   42   2HB   LEU   6          HB3       LEU   6  15.239  -3.368   4.205
   43    HG   LEU   6           HG       LEU   6  14.454  -1.008   4.361
   44   1HD1  LEU   6          HD11      LEU   6  16.795  -1.443   4.264
   45   2HD1  LEU   6          HD12      LEU   6  16.763  -1.597   2.495
   46   3HD1  LEU   6          HD13      LEU   6  16.457  -0.026   3.269
   47   1HD2  LEU   6          HD21      LEU   6  14.476  -0.992   1.338
   48   2HD2  LEU   6          HD22      LEU   6  13.003  -0.967   2.334
   49   3HD2  LEU   6          HD23      LEU   6  14.158   0.376   2.420
   50    H    ILE   7           H        ILE   7  16.132  -5.372   0.951
   51    HA   ILE   7           HA       ILE   7  14.932  -7.815   2.106
   52    HB   ILE   7           HB       ILE   7  16.933  -7.393  -0.152
   53   1HG1  ILE   7          HG12      ILE   7  13.955  -8.072  -0.270
   54   2HG1  ILE   7          HG13      ILE   7  14.642  -6.488  -0.616
   55   1HG2  ILE   7          HG21      ILE   7  15.439  -9.937   0.646
   56   2HG2  ILE   7          HG22      ILE   7  16.571  -9.764  -0.712
   57   3HG2  ILE   7          HG23      ILE   7  17.166  -9.638   0.932
   58   1HD1  ILE   7          HD11      ILE   7  15.111  -9.004  -2.246
   59   2HD1  ILE   7          HD12      ILE   7  14.175  -7.574  -2.696
   60   3HD1  ILE   7          HD13      ILE   7  15.934  -7.447  -2.511
   61    H    SER   8           H        SER   8  15.783  -8.419   4.044
   62    HA   SER   8           HA       SER   8  18.603  -7.680   4.638
   63   1HB   SER   8          HB2       SER   8  16.554  -8.460   6.686
   64   2HB   SER   8          HB3       SER   8  17.917  -7.346   6.831
   65    HG   SER   8           HG       SER   8  15.427  -6.984   5.534
   66    H    GLY   9           H        GLY   9  20.081  -9.164   5.323
   67   1HA   GLY   9          HA2       GLY   9  20.201 -11.017   7.035
   68   2HA   GLY   9          HA3       GLY   9  19.204 -11.952   5.894
   69    H    SER  10           H        SER  10  21.682 -12.931   6.682
   70    HA   SER  10           HA       SER  10  23.398 -12.463   4.286
   71   1HB   SER  10          HB2       SER  10  25.190 -13.312   5.866
   72   2HB   SER  10          HB3       SER  10  24.513 -11.697   6.161
   73    HG   SER  10           HG       SER  10  24.663 -12.955   8.090
   74    H    THR  11           H        THR  11  21.341 -14.792   5.658
   75    HA   THR  11           HA       THR  11  22.174 -16.627   3.517
   76    HB   THR  11           HB       THR  11  23.422 -17.465   5.392
   77    HG1  THR  11           HG1      THR  11  22.929 -19.101   4.228
   78   1HG2  THR  11          HG21      THR  11  22.466 -18.419   7.384
   79   2HG2  THR  11          HG22      THR  11  22.013 -16.716   7.308
   80   3HG2  THR  11          HG23      THR  11  20.823 -17.980   6.896
   81    H    LEU  12           H        LEU  12  19.734 -16.297   6.234
   82    HA   LEU  12           HA       LEU  12  17.682 -15.875   4.177
   83   1HB   LEU  12          HB2       LEU  12  17.897 -18.353   4.616
   84   2HB   LEU  12          HB3       LEU  12  17.458 -18.067   6.295
   85    HG   LEU  12           HG       LEU  12  15.186 -17.468   5.667
   86   1HD1  LEU  12          HD11      LEU  12  15.518 -16.182   3.623
   87   2HD1  LEU  12          HD12      LEU  12  16.135 -17.616   2.771
   88   3HD1  LEU  12          HD13      LEU  12  14.433 -17.527   3.281
   89   1HD2  LEU  12          HD21      LEU  12  16.092 -19.884   4.061
   90   2HD2  LEU  12          HD22      LEU  12  15.745 -19.861   5.804
   91   3HD2  LEU  12          HD23      LEU  12  14.446 -19.550   4.644
   92    H    GLY  13           H        GLY  13  19.085 -14.459   6.445
   93   1HA   GLY  13          HA2       GLY  13  17.325 -12.603   7.401
   94   2HA   GLY  13          HA3       GLY  13  17.224 -13.935   8.577
   95    H    GLY  14           H        GLY  14  18.304 -11.547   9.467
   96   1HA   GLY  14          HA2       GLY  14  20.109 -11.906  11.146
   97   2HA   GLY  14          HA3       GLY  14  21.202 -12.267   9.813
   98    H    ALA  15           H        ALA  15  19.004  -9.640   9.079
   99    HA   ALA  15           HA       ALA  15  20.943  -7.607  10.054
  100   1HB   ALA  15          HB1       ALA  15  21.223  -6.607   7.863
  101   2HB   ALA  15          HB2       ALA  15  21.743  -8.298   7.792
  102   3HB   ALA  15          HB3       ALA  15  20.167  -7.818   7.119
  103    H    GLU  16           H        GLU  16  17.792  -8.543   9.823
  104    HA   GLU  16           HA       GLU  16  16.332  -6.433   8.884
  105   1HB   GLU  16          HB2       GLU  16  15.639  -8.143  11.310
  106   2HB   GLU  16          HB3       GLU  16  14.529  -7.133  10.387
  107   1HG   GLU  16          HG2       GLU  16  14.080  -9.229   9.549
  108   2HG   GLU  16          HG3       GLU  16  15.153  -8.568   8.332
  109    H    TYR  17           H        TYR  17  17.991  -6.553  12.029
  110    HA   TYR  17           HA       TYR  17  16.590  -4.539  13.387
  111   1HB   TYR  17          HB2       TYR  17  18.178  -6.014  14.482
  112   2HB   TYR  17          HB3       TYR  17  19.512  -5.375  13.531
  113    HD1  TYR  17           HD1      TYR  17  16.950  -4.421  16.104
  114    HD2  TYR  17           HD2      TYR  17  20.749  -3.472  14.283
  115    HE1  TYR  17           HE1      TYR  17  17.349  -2.696  17.837
  116    HE2  TYR  17           HE2      TYR  17  21.156  -1.750  16.009
  117    HH   TYR  17           HH       TYR  17  20.329  -0.683  17.911
  118    H    VAL  18           H        VAL  18  19.586  -4.135  11.353
  119    HA   VAL  18           HA       VAL  18  19.359  -1.236  11.656
  120    HB   VAL  18           HB       VAL  18  21.521  -2.412  11.647
  121   1HG1  VAL  18          HG11      VAL  18  21.122  -2.813   8.657
  122   2HG1  VAL  18          HG12      VAL  18  22.596  -3.126   9.587
  123   3HG1  VAL  18          HG13      VAL  18  21.157  -4.101   9.883
  124   1HG2  VAL  18          HG21      VAL  18  21.312   0.009  11.153
  125   2HG2  VAL  18          HG22      VAL  18  22.706  -0.727  10.364
  126   3HG2  VAL  18          HG23      VAL  18  21.252  -0.357   9.416
  127    H    ALA  19           H        ALA  19  18.444  -3.715   9.277
  128    HA   ALA  19           HA       ALA  19  17.900  -1.968   7.109
  129   1HB   ALA  19          HB1       ALA  19  16.477  -3.746   6.274
  130   2HB   ALA  19          HB2       ALA  19  17.951  -4.456   6.962
  131   3HB   ALA  19          HB3       ALA  19  16.420  -4.508   7.868
  132    H    GLU  20           H        GLU  20  15.882  -2.850   9.984
  133    HA   GLU  20           HA       GLU  20  13.575  -1.431   9.163
  134   1HB   GLU  20          HB2       GLU  20  13.764  -3.120  11.038
  135   2HB   GLU  20          HB3       GLU  20  14.545  -1.874  12.017
  136   1HG   GLU  20          HG2       GLU  20  12.516  -0.454  11.800
  137   2HG   GLU  20          HG3       GLU  20  11.766  -1.673  10.769
  138    H    HIS  21           H        HIS  21  16.480  -0.314  10.971
  139    HA   HIS  21           HA       HIS  21  15.468   2.315  11.534
  140   1HB   HIS  21          HB2       HIS  21  17.431   1.256  12.661
  141   2HB   HIS  21          HB3       HIS  21  18.356   1.411  11.168
  142    HD1  HIS  21           HD1      HIS  21  17.279   3.439  14.178
  143    HD2  HIS  21           HD2      HIS  21  18.895   4.011  10.334
  144    HE1  HIS  21           HE1      HIS  21  18.199   5.811  14.136
  145    H    LEU  22           H        LEU  22  17.454   0.982   8.868
  146    HA   LEU  22           HA       LEU  22  17.750   3.339   7.319
  147   1HB   LEU  22          HB2       LEU  22  17.705   0.362   6.778
  148   2HB   LEU  22          HB3       LEU  22  17.730   1.455   5.418
  149    HG   LEU  22           HG       LEU  22  19.755   1.730   7.682
  150   1HD1  LEU  22          HD11      LEU  22  21.301   0.334   6.317
  151   2HD1  LEU  22          HD12      LEU  22  19.932  -0.576   6.963
  152   3HD1  LEU  22          HD13      LEU  22  19.929  -0.091   5.255
  153   1HD2  LEU  22          HD21      LEU  22  19.880   2.458   4.715
  154   2HD2  LEU  22          HD22      LEU  22  19.602   3.602   6.044
  155   3HD2  LEU  22          HD23      LEU  22  21.148   2.754   5.924
  156    H    ALA  23           H        ALA  23  15.292   0.753   7.071
  157    HA   ALA  23           HA       ALA  23  13.658   1.786   5.099
  158   1HB   ALA  23          HB1       ALA  23  13.378  -0.457   6.175
  159   2HB   ALA  23          HB2       ALA  23  12.745   0.334   7.623
  160   3HB   ALA  23          HB3       ALA  23  11.859   0.438   6.104
  161    H    GLU  24           H        GLU  24  13.438   2.484   8.642
  162    HA   GLU  24           HA       GLU  24  11.206   4.180   8.524
  163   1HB   GLU  24          HB2       GLU  24  12.416   3.184  10.552
  164   2HB   GLU  24          HB3       GLU  24  13.562   4.497  10.447
  165   1HG   GLU  24          HG2       GLU  24  11.746   6.128  10.702
  166   2HG   GLU  24          HG3       GLU  24  10.548   4.834  10.743
  167    H    LYS  25           H        LYS  25  14.688   5.091   8.615
  168    HA   LYS  25           HA       LYS  25  14.338   7.851   8.214
  169   1HB   LYS  25          HB2       LYS  25  16.564   5.924   7.401
  170   2HB   LYS  25          HB3       LYS  25  16.717   7.660   7.266
  171   1HG   LYS  25          HG2       LYS  25  16.219   6.058   9.833
  172   2HG   LYS  25          HG3       LYS  25  17.714   6.787   9.349
  173   1HD   LYS  25          HD2       LYS  25  15.193   8.088  10.352
  174   2HD   LYS  25          HD3       LYS  25  16.815   8.177  11.033
  175   1HE   LYS  25          HE2       LYS  25  17.536   9.541   9.045
  176   2HE   LYS  25          HE3       LYS  25  15.864   9.480   8.440
  177   1HZ   LYS  25          HZ1       LYS  25  16.304  11.521   9.656
  178   2HZ   LYS  25          HZ2       LYS  25  15.129  10.640  10.384
  179   3HZ   LYS  25          HZ3       LYS  25  16.650  10.694  11.020
  180    H    LEU  26           H        LEU  26  14.560   5.305   5.754
  181    HA   LEU  26           HA       LEU  26  14.529   7.052   3.486
  182   1HB   LEU  26          HB2       LEU  26  13.704   4.183   3.943
  183   2HB   LEU  26          HB3       LEU  26  13.526   4.935   2.358
  184    HG   LEU  26           HG       LEU  26  16.197   4.910   3.813
  185   1HD1  LEU  26          HD11      LEU  26  15.151   2.796   1.881
  186   2HD1  LEU  26          HD12      LEU  26  16.796   2.899   2.557
  187   3HD1  LEU  26          HD13      LEU  26  15.427   2.568   3.621
  188   1HD2  LEU  26          HD21      LEU  26  15.946   6.451   1.869
  189   2HD2  LEU  26          HD22      LEU  26  17.101   5.153   1.541
  190   3HD2  LEU  26          HD23      LEU  26  15.466   5.079   0.858
  191    H    GLU  27           H        GLU  27  11.783   5.821   5.562
  192    HA   GLU  27           HA       GLU  27   9.838   6.903   3.760
  193   1HB   GLU  27          HB2       GLU  27   9.606   6.239   6.728
  194   2HB   GLU  27          HB3       GLU  27   8.316   6.643   5.614
  195   1HG   GLU  27          HG2       GLU  27   9.288   4.621   4.198
  196   2HG   GLU  27          HG3       GLU  27   9.939   4.144   5.767
  197    H    GLU  28           H        GLU  28  11.652   8.215   6.635
  198    HA   GLU  28           HA       GLU  28  10.291  10.683   6.698
  199   1HB   GLU  28          HB2       GLU  28  13.210  10.144   7.403
  200   2HB   GLU  28          HB3       GLU  28  12.186  11.468   7.903
  201   1HG   GLU  28          HG2       GLU  28  10.676   9.501   8.903
  202   2HG   GLU  28          HG3       GLU  28  12.236   8.656   8.884
  203    H    ALA  29           H        ALA  29  12.830   9.450   4.545
  204    HA   ALA  29           HA       ALA  29  13.589  12.006   3.446
  205   1HB   ALA  29          HB1       ALA  29  14.668  10.696   1.695
  206   2HB   ALA  29          HB2       ALA  29  15.034   9.998   3.287
  207   3HB   ALA  29          HB3       ALA  29  13.837   9.227   2.215
  208    H    GLY  30           H        GLY  30  10.829   9.916   2.962
  209   1HA   GLY  30          HA2       GLY  30   8.962  11.302   2.144
  210   2HA   GLY  30          HA3       GLY  30   9.913  11.631   0.691
  211    H    PHE  31           H        PHE  31  10.614   8.408   1.374
  212    HA   PHE  31           HA       PHE  31   8.665   7.588  -0.713
  213   1HB   PHE  31          HB2       PHE  31  10.855   5.811   0.315
  214   2HB   PHE  31          HB3       PHE  31  10.115   5.881  -1.261
  215    HD1  PHE  31           HD1      PHE  31  10.535   8.093  -2.676
  216    HD2  PHE  31           HD2      PHE  31  13.004   6.765   0.602
  217    HE1  PHE  31           HE1      PHE  31  12.409   9.487  -3.516
  218    HE2  PHE  31           HE2      PHE  31  14.864   8.160  -0.232
  219    HZ   PHE  31           HZ       PHE  31  14.580   9.526  -2.297
  220    H    THR  32           H        THR  32   8.511   4.857  -0.157
  221    HA   THR  32           HA       THR  32   7.679   4.538   2.641
  222    HB   THR  32           HB       THR  32   5.863   2.971   1.699
  223    HG1  THR  32           HG1      THR  32   5.108   3.407  -0.300
  224   1HG2  THR  32          HG21      THR  32   5.400   5.008   2.985
  225   2HG2  THR  32          HG22      THR  32   5.462   5.988   1.500
  226   3HG2  THR  32          HG23      THR  32   4.187   4.762   1.715
  227    H    THR  33           H        THR  33   8.112   2.394   3.368
  228    HA   THR  33           HA       THR  33   9.736   0.726   1.506
  229    HB   THR  33           HB       THR  33  11.507   0.705   3.185
  230    HG1  THR  33           HG1      THR  33  11.186   2.566   4.812
  231   1HG2  THR  33          HG21      THR  33  12.441   2.826   2.796
  232   2HG2  THR  33          HG22      THR  33  11.389   2.587   1.408
  233   3HG2  THR  33          HG23      THR  33  10.848   3.640   2.721
  234    H    GLU  34           H        GLU  34  10.073  -1.534   2.236
  235    HA   GLU  34           HA       GLU  34   8.363  -2.364   4.509
  236   1HB   GLU  34          HB2       GLU  34   8.099  -2.830   1.757
  237   2HB   GLU  34          HB3       GLU  34   8.728  -4.289   2.463
  238   1HG   GLU  34          HG2       GLU  34   6.452  -2.663   3.651
  239   2HG   GLU  34          HG3       GLU  34   6.223  -3.889   2.482
  240    H    THR  35           H        THR  35   9.731  -3.159   6.112
  241    HA   THR  35           HA       THR  35  12.484  -3.979   5.488
  242    HB   THR  35           HB       THR  35  11.071  -4.209   8.169
  243    HG1  THR  35           HG1      THR  35  10.939  -2.061   7.580
  244   1HG2  THR  35          HG21      THR  35  14.001  -3.847   7.380
  245   2HG2  THR  35          HG22      THR  35  13.367  -4.091   9.024
  246   3HG2  THR  35          HG23      THR  35  13.267  -5.396   7.839
  247    H    LEU  36           H        LEU  36  12.952  -6.037   4.904
  248    HA   LEU  36           HA       LEU  36  11.018  -8.233   5.565
  249   1HB   LEU  36          HB2       LEU  36  12.278  -7.384   2.921
  250   2HB   LEU  36          HB3       LEU  36  11.437  -8.899   3.128
  251    HG   LEU  36           HG       LEU  36  10.013  -6.290   3.751
  252   1HD1  LEU  36          HD11      LEU  36  10.935  -5.954   1.592
  253   2HD1  LEU  36          HD12      LEU  36  10.398  -7.563   1.035
  254   3HD1  LEU  36          HD13      LEU  36   9.203  -6.287   1.428
  255   1HD2  LEU  36          HD21      LEU  36   8.988  -8.965   2.708
  256   2HD2  LEU  36          HD22      LEU  36   8.934  -8.453   4.414
  257   3HD2  LEU  36          HD23      LEU  36   8.018  -7.567   3.189
  258    H    HIS  37           H        HIS  37  11.913 -10.346   5.442
  259    HA   HIS  37           HA       HIS  37  14.882 -10.529   5.409
  260   1HB   HIS  37          HB2       HIS  37  14.624 -12.622   6.628
  261   2HB   HIS  37          HB3       HIS  37  13.952 -11.258   7.503
  262    HD1  HIS  37           HD1      HIS  37  11.254 -11.287   7.896
  263    HD2  HIS  37           HD2      HIS  37  12.938 -14.580   5.881
  264    HE1  HIS  37           HE1      HIS  37   9.460 -13.087   7.844
  265    H    GLY  38           H        GLY  38  13.484 -10.094   3.045
  266   1HA   GLY  38          HA2       GLY  38  12.812 -10.854   1.009
  267   2HA   GLY  38          HA3       GLY  38  14.142 -11.998   1.169
  268    HA   PRO  39           HA       PRO  39  10.689 -14.685   2.943
  269   1HB   PRO  39          HB2       PRO  39   8.095 -13.833   3.284
  270   2HB   PRO  39          HB3       PRO  39   9.386 -13.582   4.498
  271   1HG   PRO  39          HG2       PRO  39   8.400 -11.640   2.390
  272   2HG   PRO  39          HG3       PRO  39   8.673 -11.335   4.136
  273   1HD   PRO  39          HD2       PRO  39  10.533 -10.688   2.250
  274   2HD   PRO  39          HD3       PRO  39  11.008 -11.317   3.863
  275    H    LEU  40           H        LEU  40   9.828 -12.574   0.242
  276    HA   LEU  40           HA       LEU  40   8.545 -14.817  -1.202
  277   1HB   LEU  40          HB2       LEU  40   8.123 -11.784  -1.181
  278   2HB   LEU  40          HB3       LEU  40   7.448 -12.844  -2.386
  279    HG   LEU  40           HG       LEU  40   6.802 -12.975   0.584
  280   1HD1  LEU  40          HD11      LEU  40   4.620 -12.051  -0.073
  281   2HD1  LEU  40          HD12      LEU  40   5.931 -10.947  -0.511
  282   3HD1  LEU  40          HD13      LEU  40   5.157 -11.941  -1.765
  283   1HD2  LEU  40          HD21      LEU  40   4.937 -14.475  -0.124
  284   2HD2  LEU  40          HD22      LEU  40   5.604 -14.505  -1.771
  285   3HD2  LEU  40          HD23      LEU  40   6.520 -15.195  -0.411
  286    H    LEU  41           H        LEU  41  11.467 -13.763  -0.843
  287    HA   LEU  41           HA       LEU  41  13.338 -13.304  -1.986
  288   1HB   LEU  41          HB2       LEU  41  12.538 -15.214  -3.400
  289   2HB   LEU  41          HB3       LEU  41  11.845 -14.025  -4.503
  290    HG   LEU  41           HG       LEU  41  14.187 -13.005  -4.681
  291   1HD1  LEU  41          HD11      LEU  41  15.264 -14.037  -2.755
  292   2HD1  LEU  41          HD12      LEU  41  14.964 -15.659  -3.422
  293   3HD1  LEU  41          HD13      LEU  41  16.072 -14.530  -4.245
  294   1HD2  LEU  41          HD21      LEU  41  13.671 -15.833  -5.678
  295   2HD2  LEU  41          HD22      LEU  41  13.162 -14.326  -6.459
  296   3HD2  LEU  41          HD23      LEU  41  14.890 -14.715  -6.346
  297    H    GLU  42           H        GLU  42  10.440 -11.709  -3.140
  298    HA   GLU  42           HA       GLU  42  11.746  -9.126  -3.562
  299   1HB   GLU  42          HB2       GLU  42  11.125  -9.105  -6.009
  300   2HB   GLU  42          HB3       GLU  42  12.518 -10.071  -5.575
  301   1HG   GLU  42          HG2       GLU  42  11.157 -12.147  -5.753
  302   2HG   GLU  42          HG3       GLU  42   9.768 -11.191  -6.255
  303    H    ASP  43           H        ASP  43  10.231  -8.519  -1.980
  304    HA   ASP  43           HA       ASP  43   7.403  -8.998  -2.234
  305   1HB   ASP  43          HB2       ASP  43   8.383  -8.315  -0.110
  306   2HB   ASP  43          HB3       ASP  43   8.914  -6.780  -0.832
  307    H    LEU  44           H        LEU  44   9.592  -6.341  -3.355
  308    HA   LEU  44           HA       LEU  44   7.324  -5.321  -5.013
  309   1HB   LEU  44          HB2       LEU  44  10.069  -4.104  -4.634
  310   2HB   LEU  44          HB3       LEU  44   8.793  -3.426  -5.578
  311    HG   LEU  44           HG       LEU  44   8.718  -3.784  -2.560
  312   1HD1  LEU  44          HD11      LEU  44   8.785  -1.365  -2.500
  313   2HD1  LEU  44          HD12      LEU  44  10.150  -1.932  -3.486
  314   3HD1  LEU  44          HD13      LEU  44   8.714  -1.261  -4.273
  315   1HD2  LEU  44          HD21      LEU  44   6.596  -2.670  -4.457
  316   2HD2  LEU  44          HD22      LEU  44   6.439  -4.079  -3.380
  317   3HD2  LEU  44          HD23      LEU  44   6.581  -2.463  -2.695
  318    HA   PRO  45           HA       PRO  45   8.798  -7.605  -8.404
  319   1HB   PRO  45          HB2       PRO  45   8.186  -5.948 -10.583
  320   2HB   PRO  45          HB3       PRO  45   7.051  -6.948  -9.670
  321   1HG   PRO  45          HG2       PRO  45   7.675  -3.995  -9.406
  322   2HG   PRO  45          HG3       PRO  45   6.075  -4.790  -9.326
  323   1HD   PRO  45          HD2       PRO  45   7.509  -4.003  -7.092
  324   2HD   PRO  45          HD3       PRO  45   6.394  -5.407  -7.093
  325    H    ALA  46           H        ALA  46   9.931  -7.319 -10.580
  326    HA   ALA  46           HA       ALA  46  12.641  -6.359 -10.194
  327   1HB   ALA  46          HB1       ALA  46  12.152  -8.458 -11.422
  328   2HB   ALA  46          HB2       ALA  46  11.218  -7.546 -12.635
  329   3HB   ALA  46          HB3       ALA  46  12.965  -7.307 -12.496
  330    H    SER  47           H        SER  47  10.772  -4.221  -9.993
  331    HA   SER  47           HA       SER  47  11.821  -2.306 -11.834
  332   1HB   SER  47          HB2       SER  47   8.845  -2.854 -11.918
  333   2HB   SER  47          HB3       SER  47   9.675  -1.524 -12.741
  334    HG   SER  47           HG       SER  47  10.807  -3.905 -13.338
  335    H    GLY  48           H        GLY  48  12.110  -0.537 -10.472
  336   1HA   GLY  48          HA2       GLY  48  10.721   0.907  -8.780
  337   2HA   GLY  48          HA3       GLY  48  10.679  -0.604  -7.865
  338    H    ILE  49           H        ILE  49  11.943   0.034  -6.173
  339    HA   ILE  49           HA       ILE  49  14.830   0.537  -6.709
  340    HB   ILE  49           HB       ILE  49  13.196   1.442  -4.330
  341   1HG1  ILE  49          HG12      ILE  49  12.226   2.690  -6.163
  342   2HG1  ILE  49          HG13      ILE  49  13.114   3.729  -5.077
  343   1HG2  ILE  49          HG21      ILE  49  15.061   2.927  -3.803
  344   2HG2  ILE  49          HG22      ILE  49  15.649   1.269  -3.961
  345   3HG2  ILE  49          HG23      ILE  49  15.912   2.435  -5.270
  346   1HD1  ILE  49          HD11      ILE  49  14.919   4.008  -6.662
  347   2HD1  ILE  49          HD12      ILE  49  14.238   2.766  -7.740
  348   3HD1  ILE  49          HD13      ILE  49  13.389   4.299  -7.490
  349    H    TRP  50           H        TRP  50  16.121  -1.093  -5.755
  350    HA   TRP  50           HA       TRP  50  14.896  -2.775  -3.609
  351   1HB   TRP  50          HB2       TRP  50  16.734  -3.477  -5.926
  352   2HB   TRP  50          HB3       TRP  50  16.709  -4.419  -4.461
  353    HD1  TRP  50           HD1      TRP  50  13.301  -3.296  -5.789
  354    HE1  TRP  50           HE1      TRP  50  12.100  -5.243  -6.918
  355    HE3  TRP  50           HE3      TRP  50  17.058  -6.776  -5.590
  356    HZ2  TRP  50           HZ2      TRP  50  12.640  -8.003  -7.535
  357    HZ3  TRP  50           HZ3      TRP  50  16.665  -9.073  -6.437
  358    HH2  TRP  50           HH2      TRP  50  14.467  -9.698  -7.411
  359    H    LEU  51           H        LEU  51  16.171  -3.065  -1.825
  360    HA   LEU  51           HA       LEU  51  18.969  -2.073  -1.819
  361   1HB   LEU  51          HB2       LEU  51  16.776  -1.438   0.203
  362   2HB   LEU  51          HB3       LEU  51  18.491  -1.231   0.525
  363    HG   LEU  51           HG       LEU  51  16.854   0.297  -1.554
  364   1HD1  LEU  51          HD11      LEU  51  17.155   2.204  -0.097
  365   2HD1  LEU  51          HD12      LEU  51  16.459   0.879   0.853
  366   3HD1  LEU  51          HD13      LEU  51  18.174   1.274   1.016
  367   1HD2  LEU  51          HD21      LEU  51  19.801   0.593  -0.793
  368   2HD2  LEU  51          HD22      LEU  51  19.165   0.056  -2.355
  369   3HD2  LEU  51          HD23      LEU  51  18.879   1.716  -1.819
  370    H    VAL  52           H        VAL  52  20.279  -3.545  -0.766
  371    HA   VAL  52           HA       VAL  52  18.900  -5.806   0.614
  372    HB   VAL  52           HB       VAL  52  21.170  -6.169  -1.352
  373   1HG1  VAL  52          HG11      VAL  52  20.882  -7.985   0.336
  374   2HG1  VAL  52          HG12      VAL  52  19.193  -8.169  -0.165
  375   3HG1  VAL  52          HG13      VAL  52  20.509  -8.537  -1.298
  376   1HG2  VAL  52          HG21      VAL  52  18.194  -6.530  -1.897
  377   2HG2  VAL  52          HG22      VAL  52  19.285  -5.381  -2.694
  378   3HG2  VAL  52          HG23      VAL  52  19.505  -7.109  -2.946
  379    H    ILE  53           H        ILE  53  19.930  -6.587   2.402
  380    HA   ILE  53           HA       ILE  53  22.424  -5.217   3.272
  381    HB   ILE  53           HB       ILE  53  20.156  -5.891   5.177
  382   1HG1  ILE  53          HG12      ILE  53  19.676  -3.367   5.216
  383   2HG1  ILE  53          HG13      ILE  53  20.328  -3.319   3.586
  384   1HG2  ILE  53          HG21      ILE  53  22.454  -5.468   6.028
  385   2HG2  ILE  53          HG22      ILE  53  22.425  -3.865   5.275
  386   3HG2  ILE  53          HG23      ILE  53  21.296  -4.258   6.589
  387   1HD1  ILE  53          HD11      ILE  53  18.028  -5.133   4.420
  388   2HD1  ILE  53          HD12      ILE  53  17.813  -3.487   3.813
  389   3HD1  ILE  53          HD13      ILE  53  18.520  -4.705   2.764
  390    H    SER  54           H        SER  54  23.818  -6.945   2.899
  391    HA   SER  54           HA       SER  54  23.334  -9.358   4.557
  392   1HB   SER  54          HB2       SER  54  23.614 -10.838   2.728
  393   2HB   SER  54          HB3       SER  54  22.384  -9.658   2.257
  394    HG   SER  54           HG       SER  54  24.425 -10.345   0.917
  395    H    SER  55           H        SER  55  25.598  -7.044   3.763
  396    HA   SER  55           HA       SER  55  27.874  -7.015   3.580
  397   1HB   SER  55          HB2       SER  55  27.311  -8.129   6.338
  398   2HB   SER  55          HB3       SER  55  28.683  -7.102   5.862
  399    HG   SER  55           HG       SER  55  27.012  -5.849   6.752
  400    H    THR  56           H        THR  56  27.990  -8.757   1.875
  401    HA   THR  56           HA       THR  56  29.248 -11.238   2.329
  402    HB   THR  56           HB       THR  56  30.356 -10.602   0.074
  403    HG1  THR  56           HG1      THR  56  29.589  -8.829  -0.879
  404   1HG2  THR  56          HG21      THR  56  28.179 -10.681  -1.181
  405   2HG2  THR  56          HG22      THR  56  28.353 -11.943   0.040
  406   3HG2  THR  56          HG23      THR  56  27.316 -10.535   0.369
  407    H    HIS  57           H        HIS  57  30.601  -7.962   2.196
  408    HA   HIS  57           HA       HIS  57  33.259  -8.199   2.421
  409   1HB   HIS  57          HB2       HIS  57  31.802  -6.169   2.436
  410   2HB   HIS  57          HB3       HIS  57  31.468  -6.429   4.117
  411    HD1  HIS  57           HD1      HIS  57  34.873  -7.015   4.528
  412    HD2  HIS  57           HD2      HIS  57  32.690  -3.714   3.092
  413    HE1  HIS  57           HE1      HIS  57  36.365  -4.967   4.850
  414    H    GLY  58           H        GLY  58  31.056  -9.238   5.100
  415   1HA   GLY  58          HA2       GLY  58  33.321 -10.621   6.286
  416   2HA   GLY  58          HA3       GLY  58  32.747  -9.270   7.277
  417    H    ALA  59           H        ALA  59  30.347 -10.914   5.435
  418    HA   ALA  59           HA       ALA  59  29.590 -12.857   7.507
  419   1HB   ALA  59          HB1       ALA  59  27.349 -11.889   7.755
  420   2HB   ALA  59          HB2       ALA  59  28.570 -10.699   8.238
  421   3HB   ALA  59          HB3       ALA  59  27.761 -10.558   6.659
  422    H    GLY  60           H        GLY  60  30.636 -13.496   5.056
  423   1HA   GLY  60          HA2       GLY  60  28.581 -13.971   3.061
  424   2HA   GLY  60          HA3       GLY  60  30.154 -14.741   3.126
  425    H    ASP  61           H        ASP  61  28.531 -16.505   2.413
  426    HA   ASP  61           HA       ASP  61  27.861 -18.178   4.763
  427   1HB   ASP  61          HB2       ASP  61  25.757 -17.065   3.986
  428   2HB   ASP  61          HB3       ASP  61  26.024 -17.762   2.385
  429    H    ILE  62           H        ILE  62  27.589 -20.500   3.930
  430    HA   ILE  62           HA       ILE  62  30.121 -21.043   2.755
  431    HB   ILE  62           HB       ILE  62  27.905 -23.044   3.301
  432   1HG1  ILE  62          HG12      ILE  62  28.388 -21.875   5.350
  433   2HG1  ILE  62          HG13      ILE  62  29.034 -23.500   5.407
  434   1HG2  ILE  62          HG21      ILE  62  29.770 -24.678   3.453
  435   2HG2  ILE  62          HG22      ILE  62  29.556 -24.023   1.828
  436   3HG2  ILE  62          HG23      ILE  62  30.885 -23.435   2.844
  437   1HD1  ILE  62          HD11      ILE  62  30.583 -21.926   6.436
  438   2HD1  ILE  62          HD12      ILE  62  31.329 -22.609   4.985
  439   3HD1  ILE  62          HD13      ILE  62  30.663 -20.957   4.958
  440    HA   PRO  63           HA       PRO  63  27.969 -22.171  -1.368
  441   1HB   PRO  63          HB2       PRO  63  25.412 -20.608  -1.190
  442   2HB   PRO  63          HB3       PRO  63  25.742 -22.149  -2.030
  443   1HG   PRO  63          HG2       PRO  63  24.420 -22.186   0.344
  444   2HG   PRO  63          HG3       PRO  63  25.710 -23.378   0.017
  445   1HD   PRO  63          HD2       PRO  63  25.943 -20.778   1.570
  446   2HD   PRO  63          HD3       PRO  63  26.448 -22.420   2.032
  447    H    ASP  64           H        ASP  64  26.901 -18.941  -0.057
  448    HA   ASP  64           HA       ASP  64  29.166 -17.651  -1.287
  449   1HB   ASP  64          HB2       ASP  64  27.644 -17.773  -3.283
  450   2HB   ASP  64          HB3       ASP  64  26.427 -16.874  -2.408
  451    H    ASN  65           H        ASN  65  25.832 -16.801  -0.423
  452    HA   ASN  65           HA       ASN  65  25.844 -15.546   2.015
  453   1HB   ASN  65          HB2       ASN  65  27.543 -13.916   1.212
  454   2HB   ASN  65          HB3       ASN  65  26.557 -13.635  -0.214
  455   1HD2  ASN  65          HD22      ASN  65  26.636 -13.084   3.352
  456   2HD2  ASN  65          HD21      ASN  65  25.671 -11.666   3.193
  457    H    LEU  66           H        LEU  66  23.598 -14.904   2.194
  458    HA   LEU  66           HA       LEU  66  21.385 -15.368   1.647
  459   1HB   LEU  66          HB2       LEU  66  22.185 -13.250  -0.361
  460   2HB   LEU  66          HB3       LEU  66  20.536 -13.842  -0.253
  461    HG   LEU  66           HG       LEU  66  22.029 -12.512   2.022
  462   1HD1  LEU  66          HD11      LEU  66  20.450 -10.637   1.590
  463   2HD1  LEU  66          HD12      LEU  66  21.513 -10.946   0.208
  464   3HD1  LEU  66          HD13      LEU  66  19.824 -11.490   0.169
  465   1HD2  LEU  66          HD21      LEU  66  19.218 -13.662   1.780
  466   2HD2  LEU  66          HD22      LEU  66  20.423 -13.952   3.041
  467   3HD2  LEU  66          HD23      LEU  66  19.602 -12.393   2.950
  468    H    SER  67           H        SER  67  22.151 -17.541   1.137
  469    HA   SER  67           HA       SER  67  23.173 -18.259  -1.440
  470   1HB   SER  67          HB2       SER  67  22.430 -19.823   1.053
  471   2HB   SER  67          HB3       SER  67  23.282 -20.477  -0.365
  472    HG   SER  67           HG       SER  67  24.282 -19.218   1.716
  473    HA   PRO  68           HA       PRO  68  18.995 -20.587  -1.915
  474   1HB   PRO  68          HB2       PRO  68  16.768 -19.542  -0.647
  475   2HB   PRO  68          HB3       PRO  68  17.815 -20.824   0.017
  476   1HG   PRO  68          HG2       PRO  68  17.897 -17.899   0.698
  477   2HG   PRO  68          HG3       PRO  68  17.932 -19.299   1.815
  478   1HD   PRO  68          HD2       PRO  68  20.147 -18.031   1.063
  479   2HD   PRO  68          HD3       PRO  68  20.165 -19.792   1.306
  480    H    PHE  69           H        PHE  69  19.095 -17.149  -1.209
  481    HA   PHE  69           HA       PHE  69  17.241 -16.396  -3.307
  482   1HB   PHE  69          HB2       PHE  69  19.314 -14.800  -1.776
  483   2HB   PHE  69          HB3       PHE  69  18.138 -14.139  -2.850
  484    HD1  PHE  69           HD1      PHE  69  18.107 -12.825  -0.493
  485    HD2  PHE  69           HD2      PHE  69  16.261 -16.661  -1.234
  486    HE1  PHE  69           HE1      PHE  69  16.625 -12.506   1.470
  487    HE2  PHE  69           HE2      PHE  69  14.789 -16.322   0.702
  488    HZ   PHE  69           HZ       PHE  69  14.977 -14.273   2.075
  489    H    TYR  70           H        TYR  70  20.816 -16.399  -3.049
  490    HA   TYR  70           HA       TYR  70  21.500 -15.575  -5.631
  491   1HB   TYR  70          HB2       TYR  70  23.246 -15.810  -4.102
  492   2HB   TYR  70          HB3       TYR  70  22.731 -17.392  -3.580
  493    HD1  TYR  70           HD1      TYR  70  23.935 -19.259  -4.264
  494    HD2  TYR  70           HD2      TYR  70  23.964 -15.715  -6.731
  495    HE1  TYR  70           HE1      TYR  70  25.506 -20.365  -5.817
  496    HE2  TYR  70           HE2      TYR  70  25.508 -16.832  -8.309
  497    HH   TYR  70           HH       TYR  70  26.710 -20.177  -7.815
  498    H    GLU  71           H        GLU  71  20.863 -19.006  -4.537
  499    HA   GLU  71           HA       GLU  71  21.029 -20.073  -7.143
  500   1HB   GLU  71          HB2       GLU  71  19.401 -21.073  -4.766
  501   2HB   GLU  71          HB3       GLU  71  19.733 -21.977  -6.252
  502   1HG   GLU  71          HG2       GLU  71  22.241 -21.436  -5.704
  503   2HG   GLU  71          HG3       GLU  71  21.673 -21.133  -4.084
  504    H    ALA  72           H        ALA  72  18.160 -18.765  -5.394
  505    HA   ALA  72           HA       ALA  72  16.280 -19.374  -7.438
  506   1HB   ALA  72          HB1       ALA  72  16.221 -17.036  -5.482
  507   2HB   ALA  72          HB2       ALA  72  14.856 -17.674  -6.413
  508   3HB   ALA  72          HB3       ALA  72  15.611 -18.681  -5.156
  509    H    LEU  73           H        LEU  73  18.454 -16.506  -7.115
  510    HA   LEU  73           HA       LEU  73  17.273 -14.941  -9.143
  511   1HB   LEU  73          HB2       LEU  73  20.108 -15.229  -8.085
  512   2HB   LEU  73          HB3       LEU  73  19.759 -14.192  -9.433
  513    HG   LEU  73           HG       LEU  73  18.416 -13.947  -6.711
  514   1HD1  LEU  73          HD11      LEU  73  20.862 -13.527  -6.587
  515   2HD1  LEU  73          HD12      LEU  73  20.700 -12.284  -7.845
  516   3HD1  LEU  73          HD13      LEU  73  19.907 -12.077  -6.266
  517   1HD2  LEU  73          HD21      LEU  73  18.476 -12.026  -9.085
  518   2HD2  LEU  73          HD22      LEU  73  17.055 -12.908  -8.486
  519   3HD2  LEU  73          HD23      LEU  73  17.790 -11.666  -7.482
  520    H    GLN  74           H        GLN  74  20.035 -17.206  -9.414
  521    HA   GLN  74           HA       GLN  74  20.068 -17.101 -12.255
  522   1HB   GLN  74          HB2       GLN  74  21.208 -19.595 -11.682
  523   2HB   GLN  74          HB3       GLN  74  21.998 -18.068 -11.978
  524   1HG   GLN  74          HG2       GLN  74  21.995 -17.604  -9.540
  525   2HG   GLN  74          HG3       GLN  74  21.209 -19.165  -9.261
  526   1HE2  GLN  74          HE22      GLN  74  24.111 -17.776 -10.983
  527   2HE2  GLN  74          HE21      GLN  74  25.191 -19.039 -10.422
  528    H    GLU  75           H        GLU  75  17.860 -18.808 -10.211
  529    HA   GLU  75           HA       GLU  75  17.227 -20.845 -12.140
  530   1HB   GLU  75          HB2       GLU  75  16.858 -20.985  -9.654
  531   2HB   GLU  75          HB3       GLU  75  15.501 -19.871  -9.857
  532   1HG   GLU  75          HG2       GLU  75  14.356 -21.479 -11.316
  533   2HG   GLU  75          HG3       GLU  75  15.753 -22.558 -11.263
  534    H    GLN  76           H        GLN  76  16.076 -17.547 -11.557
  535    HA   GLN  76           HA       GLN  76  14.075 -17.897 -13.758
  536   1HB   GLN  76          HB2       GLN  76  12.850 -15.998 -12.628
  537   2HB   GLN  76          HB3       GLN  76  12.779 -17.579 -11.866
  538   1HG   GLN  76          HG2       GLN  76  14.041 -16.967 -10.048
  539   2HG   GLN  76          HG3       GLN  76  14.917 -15.695 -10.906
  540   1HE2  GLN  76          HE22      GLN  76  14.449 -14.567  -8.794
  541   2HE2  GLN  76          HE21      GLN  76  12.994 -13.587  -8.742
  542    H    LYS  77           H        LYS  77  16.704 -15.855 -12.667
  543    HA   LYS  77           HA       LYS  77  17.228 -13.681 -13.164
  544   1HB   LYS  77          HB2       LYS  77  17.782 -15.159 -15.728
  545   2HB   LYS  77          HB3       LYS  77  18.481 -13.601 -15.255
  546   1HG   LYS  77          HG2       LYS  77  19.264 -14.773 -13.125
  547   2HG   LYS  77          HG3       LYS  77  18.846 -16.301 -13.915
  548   1HD   LYS  77          HD2       LYS  77  20.843 -14.251 -14.931
  549   2HD   LYS  77          HD3       LYS  77  21.261 -15.726 -14.042
  550   1HE   LYS  77          HE2       LYS  77  20.260 -17.060 -15.882
  551   2HE   LYS  77          HE3       LYS  77  19.872 -15.577 -16.763
  552   1HZ   LYS  77          HZ1       LYS  77  22.603 -16.515 -16.088
  553   2HZ   LYS  77          HZ2       LYS  77  21.927 -16.517 -17.568
  554   3HZ   LYS  77          HZ3       LYS  77  22.271 -15.100 -16.838
  555    HA   PRO  78           HA       PRO  78  13.406 -12.081 -15.255
  556   1HB   PRO  78          HB2       PRO  78  13.136 -10.080 -13.222
  557   2HB   PRO  78          HB3       PRO  78  12.108 -11.492 -13.511
  558   1HG   PRO  78          HG2       PRO  78  14.074 -11.081 -11.387
  559   2HG   PRO  78          HG3       PRO  78  12.862 -12.369 -11.556
  560   1HD   PRO  78          HD2       PRO  78  15.687 -12.576 -11.987
  561   2HD   PRO  78          HD3       PRO  78  14.442 -13.813 -12.291
  562    H    ASP  79           H        ASP  79  13.089  -9.592 -15.746
  563    HA   ASP  79           HA       ASP  79  15.688  -8.554 -16.710
  564   1HB   ASP  79          HB2       ASP  79  13.903  -8.753 -18.335
  565   2HB   ASP  79          HB3       ASP  79  12.813  -7.794 -17.325
  566    H    LEU  80           H        LEU  80  16.489  -7.961 -14.590
  567    HA   LEU  80           HA       LEU  80  14.991  -6.075 -12.956
  568   1HB   LEU  80          HB2       LEU  80  17.860  -7.017 -12.838
  569   2HB   LEU  80          HB3       LEU  80  17.176  -5.923 -11.683
  570    HG   LEU  80           HG       LEU  80  17.464  -8.182 -10.821
  571   1HD1  LEU  80          HD11      LEU  80  15.210  -8.376  -9.765
  572   2HD1  LEU  80          HD12      LEU  80  15.902  -6.749  -9.685
  573   3HD1  LEU  80          HD13      LEU  80  14.627  -7.120 -10.868
  574   1HD2  LEU  80          HD21      LEU  80  16.135 -10.015 -11.440
  575   2HD2  LEU  80          HD22      LEU  80  15.071  -9.013 -12.468
  576   3HD2  LEU  80          HD23      LEU  80  16.740  -9.325 -12.954
  577    H    SER  81           H        SER  81  16.454  -5.429 -15.874
  578    HA   SER  81           HA       SER  81  18.112  -3.264 -15.452
  579   1HB   SER  81          HB2       SER  81  16.306  -3.763 -17.837
  580   2HB   SER  81          HB3       SER  81  17.969  -3.186 -17.763
  581    HG   SER  81           HG       SER  81  16.974  -5.707 -17.871
  582    H    ALA  82           H        ALA  82  14.862  -3.465 -14.711
  583    HA   ALA  82           HA       ALA  82  14.281  -0.588 -15.221
  584   1HB   ALA  82          HB1       ALA  82  11.913  -1.242 -14.884
  585   2HB   ALA  82          HB2       ALA  82  12.654  -2.127 -16.230
  586   3HB   ALA  82          HB3       ALA  82  12.418  -2.933 -14.665
  587    H    VAL  83           H        VAL  83  15.679  -2.495 -12.886
  588    HA   VAL  83           HA       VAL  83  14.692  -0.605 -10.817
  589    HB   VAL  83           HB       VAL  83  13.586  -2.547 -10.227
  590   1HG1  VAL  83          HG11      VAL  83  14.653  -4.245 -11.575
  591   2HG1  VAL  83          HG12      VAL  83  16.118  -4.155 -10.562
  592   3HG1  VAL  83          HG13      VAL  83  14.585  -4.761  -9.890
  593   1HG2  VAL  83          HG21      VAL  83  14.363  -3.191  -8.114
  594   2HG2  VAL  83          HG22      VAL  83  16.050  -2.824  -8.490
  595   3HG2  VAL  83          HG23      VAL  83  14.871  -1.518  -8.289
  596    H    ARG  84           H        ARG  84  16.084   0.099  -9.280
  597    HA   ARG  84           HA       ARG  84  18.979  -0.264  -9.910
  598   1HB   ARG  84          HB2       ARG  84  19.420   1.644  -8.490
  599   2HB   ARG  84          HB3       ARG  84  18.447   2.093  -9.876
  600   1HG   ARG  84          HG2       ARG  84  16.568   2.576  -8.620
  601   2HG   ARG  84          HG3       ARG  84  16.975   1.500  -7.312
  602   1HD   ARG  84          HD2       ARG  84  18.221   4.196  -7.913
  603   2HD   ARG  84          HD3       ARG  84  17.166   3.818  -6.567
  604    HE   ARG  84           HE       ARG  84  19.891   3.799  -6.483
  605   1HH1  ARG  84          HH11      ARG  84  17.549   1.267  -5.652
  606   2HH1  ARG  84          HH12      ARG  84  18.545   0.503  -4.491
  607   1HH2  ARG  84          HH21      ARG  84  21.308   2.743  -5.052
  608   2HH2  ARG  84          HH22      ARG  84  20.724   1.435  -4.114
  609    H    PHE  85           H        PHE  85  20.348  -0.933  -8.291
  610    HA   PHE  85           HA       PHE  85  19.084  -2.300  -5.944
  611   1HB   PHE  85          HB2       PHE  85  19.842  -4.083  -7.190
  612   2HB   PHE  85          HB3       PHE  85  21.064  -3.149  -8.026
  613    HD1  PHE  85           HD1      PHE  85  20.421  -4.356  -4.490
  614    HD2  PHE  85           HD2      PHE  85  23.246  -3.764  -7.692
  615    HE1  PHE  85           HE1      PHE  85  22.230  -5.319  -3.090
  616    HE2  PHE  85           HE2      PHE  85  25.046  -4.733  -6.285
  617    HZ   PHE  85           HZ       PHE  85  24.540  -5.515  -3.982
  618    H    GLY  86           H        GLY  86  20.174  -1.953  -3.962
  619   1HA   GLY  86          HA2       GLY  86  22.653  -0.278  -4.044
  620   2HA   GLY  86          HA3       GLY  86  21.370   0.066  -2.878
  621    H    ALA  87           H        ALA  87  24.236  -1.404  -3.212
  622    HA   ALA  87           HA       ALA  87  23.920  -3.743  -1.498
  623   1HB   ALA  87          HB1       ALA  87  25.847  -3.611  -3.014
  624   2HB   ALA  87          HB2       ALA  87  26.268  -1.990  -2.403
  625   3HB   ALA  87          HB3       ALA  87  26.458  -3.380  -1.360
  626    H    ILE  88           H        ILE  88  23.694  -3.576   0.743
  627    HA   ILE  88           HA       ILE  88  24.647  -1.081   2.072
  628    HB   ILE  88           HB       ILE  88  22.262  -2.802   2.796
  629   1HG1  ILE  88          HG12      ILE  88  22.437  -0.180   1.290
  630   2HG1  ILE  88          HG13      ILE  88  21.567  -1.641   0.864
  631   1HG2  ILE  88          HG21      ILE  88  21.818  -1.233   4.544
  632   2HG2  ILE  88          HG22      ILE  88  23.467  -1.767   4.714
  633   3HG2  ILE  88          HG23      ILE  88  23.145  -0.165   4.019
  634   1HD1  ILE  88          HD11      ILE  88  20.806   0.309   3.076
  635   2HD1  ILE  88          HD12      ILE  88  20.045   0.133   1.506
  636   3HD1  ILE  88          HD13      ILE  88  19.928  -1.194   2.679
  637    H    GLY  89           H        GLY  89  26.498  -1.638   3.040
  638   1HA   GLY  89          HA2       GLY  89  28.024  -2.777   4.326
  639   2HA   GLY  89          HA3       GLY  89  26.745  -3.882   4.841
  640    H    ILE  90           H        ILE  90  26.029  -4.686   2.058
  641    HA   ILE  90           HA       ILE  90  27.765  -6.819   1.459
  642    HB   ILE  90           HB       ILE  90  26.265  -5.401  -0.744
  643   1HG1  ILE  90          HG12      ILE  90  24.999  -7.075   1.412
  644   2HG1  ILE  90          HG13      ILE  90  24.623  -5.401   1.021
  645   1HG2  ILE  90          HG21      ILE  90  27.715  -7.381  -1.197
  646   2HG2  ILE  90          HG22      ILE  90  26.668  -8.345  -0.127
  647   3HG2  ILE  90          HG23      ILE  90  26.039  -7.639  -1.624
  648   1HD1  ILE  90          HD11      ILE  90  24.020  -7.783  -0.773
  649   2HD1  ILE  90          HD12      ILE  90  22.891  -6.844   0.182
  650   3HD1  ILE  90          HD13      ILE  90  23.736  -6.072  -1.179
  651    H    GLY  91           H        GLY  91  29.788  -6.852   0.587
  652   1HA   GLY  91          HA2       GLY  91  30.869  -4.701  -0.962
  653   2HA   GLY  91          HA3       GLY  91  31.364  -4.567   0.758
  654    H    SER  92           H        SER  92  30.707  -7.245  -1.423
  655    HA   SER  92           HA       SER  92  33.071  -8.763  -0.998
  656   1HB   SER  92          HB2       SER  92  31.980  -9.046  -3.672
  657   2HB   SER  92          HB3       SER  92  31.927 -10.167  -2.299
  658    HG   SER  92           HG       SER  92  29.981  -8.321  -3.182
  659    H    ARG  93           H        ARG  93  32.128  -6.196  -3.168
  660    HA   ARG  93           HA       ARG  93  33.181  -4.986  -4.753
  661   1HB   ARG  93          HB2       ARG  93  32.902  -3.994  -2.322
  662   2HB   ARG  93          HB3       ARG  93  34.642  -3.837  -2.414
  663   1HG   ARG  93          HG2       ARG  93  33.522  -1.775  -3.092
  664   2HG   ARG  93          HG3       ARG  93  34.412  -2.450  -4.458
  665   1HD   ARG  93          HD2       ARG  93  32.238  -1.528  -5.131
  666   2HD   ARG  93          HD3       ARG  93  32.305  -3.244  -5.473
  667    HE   ARG  93           HE       ARG  93  30.845  -1.924  -3.209
  668   1HH1  ARG  93          HH11      ARG  93  30.817  -4.684  -5.574
  669   2HH1  ARG  93          HH12      ARG  93  29.730  -5.575  -4.557
  670   1HH2  ARG  93          HH21      ARG  93  29.070  -2.995  -2.306
  671   2HH2  ARG  93          HH22      ARG  93  28.510  -4.505  -3.027
  672    H    GLU  94           H        GLU  94  35.996  -5.636  -2.703
  673    HA   GLU  94           HA       GLU  94  37.920  -5.257  -4.800
  674   1HB   GLU  94          HB2       GLU  94  38.070  -6.852  -2.246
  675   2HB   GLU  94          HB3       GLU  94  39.458  -6.507  -3.273
  676   1HG   GLU  94          HG2       GLU  94  37.752  -4.428  -1.826
  677   2HG   GLU  94          HG3       GLU  94  39.329  -5.006  -1.313
  678    H    TYR  95           H        TYR  95  35.949  -7.993  -3.844
  679    HA   TYR  95           HA       TYR  95  37.039  -9.754  -5.937
  680   1HB   TYR  95          HB2       TYR  95  35.588 -10.280  -3.304
  681   2HB   TYR  95          HB3       TYR  95  36.148 -11.492  -4.421
  682    HD1  TYR  95           HD1      TYR  95  37.072  -9.318  -1.668
  683    HD2  TYR  95           HD2      TYR  95  38.659 -11.769  -4.849
  684    HE1  TYR  95           HE1      TYR  95  39.279  -9.344  -0.541
  685    HE2  TYR  95           HE2      TYR  95  40.866 -11.804  -3.730
  686    HH   TYR  95           HH       TYR  95  42.118 -11.088  -1.899
  687    H    ASP  96           H        ASP  96  34.693  -7.549  -5.852
  688    HA   ASP  96           HA       ASP  96  32.370  -9.201  -6.667
  689   1HB   ASP  96          HB2       ASP  96  31.801  -7.238  -5.317
  690   2HB   ASP  96          HB3       ASP  96  32.750  -6.213  -6.387
  691    H    THR  97           H        THR  97  34.063 -10.125  -8.164
  692    HA   THR  97           HA       THR  97  33.899  -8.931 -10.815
  693    HB   THR  97           HB       THR  97  35.796  -7.728  -9.772
  694    HG1  THR  97           HG1      THR  97  37.082  -7.960 -11.497
  695   1HG2  THR  97          HG21      THR  97  37.919  -8.863  -9.306
  696   2HG2  THR  97          HG22      THR  97  36.654  -9.457  -8.228
  697   3HG2  THR  97          HG23      THR  97  37.174 -10.445  -9.607
  698    H    PHE  98           H        PHE  98  35.405 -10.423 -12.276
  699    HA   PHE  98           HA       PHE  98  33.918 -12.751 -12.539
  700   1HB   PHE  98          HB2       PHE  98  36.649 -12.149 -13.734
  701   2HB   PHE  98          HB3       PHE  98  35.473 -13.294 -14.363
  702    HD1  PHE  98           HD1      PHE  98  36.516  -9.804 -14.302
  703    HD2  PHE  98           HD2      PHE  98  33.228 -12.444 -15.232
  704    HE1  PHE  98           HE1      PHE  98  35.460  -8.017 -15.658
  705    HE2  PHE  98           HE2      PHE  98  32.178 -10.649 -16.589
  706    HZ   PHE  98           HZ       PHE  98  33.291  -8.433 -16.804
  707    H    CYS  99           H        CYS  99  36.768 -12.412 -10.545
  708    HA   CYS  99           HA       CYS  99  37.001 -15.366 -10.327
  709   1HB   CYS  99          HB2       CYS  99  39.394 -14.902  -9.698
  710   2HB   CYS  99          HB3       CYS  99  38.982 -14.455 -11.358
  711    HG   CYS  99           HG       CYS  99  40.642 -12.695 -10.363
  712    H    GLY 100           H        GLY 100  35.283 -13.374  -8.823
  713   1HA   GLY 100          HA2       GLY 100  36.195 -13.500  -6.051
  714   2HA   GLY 100          HA3       GLY 100  34.605 -13.012  -6.644
  715    H    ALA 101           H        ALA 101  34.843 -14.593  -4.394
  716    HA   ALA 101           HA       ALA 101  33.370 -17.015  -5.218
  717   1HB   ALA 101          HB1       ALA 101  35.788 -17.080  -3.348
  718   2HB   ALA 101          HB2       ALA 101  34.753 -18.459  -3.778
  719   3HB   ALA 101          HB3       ALA 101  35.762 -17.698  -5.018
  720    H    ILE 102           H        ILE 102  32.994 -14.295  -3.697
  721    HA   ILE 102           HA       ILE 102  31.293 -15.327  -1.572
  722    HB   ILE 102           HB       ILE 102  33.564 -15.177  -0.566
  723   1HG1  ILE 102          HG12      ILE 102  31.640 -13.212   0.724
  724   2HG1  ILE 102          HG13      ILE 102  31.468 -14.968   0.756
  725   1HG2  ILE 102          HG21      ILE 102  34.425 -13.222  -1.864
  726   2HG2  ILE 102          HG22      ILE 102  33.378 -12.159  -0.900
  727   3HG2  ILE 102          HG23      ILE 102  34.682 -13.079  -0.130
  728   1HD1  ILE 102          HD11      ILE 102  33.691 -15.137   1.892
  729   2HD1  ILE 102          HD12      ILE 102  33.762 -13.357   1.948
  730   3HD1  ILE 102          HD13      ILE 102  32.487 -14.219   2.818
  731    H    ASP 103           H        ASP 103  31.105 -13.983  -4.177
  732    HA   ASP 103           HA       ASP 103  29.852 -11.365  -3.533
  733   1HB   ASP 103          HB2       ASP 103  30.999 -10.390  -5.366
  734   2HB   ASP 103          HB3       ASP 103  32.258 -11.263  -4.487
  735    H    LYS 104           H        LYS 104  29.297 -14.451  -4.718
  736    HA   LYS 104           HA       LYS 104  28.428 -13.926  -7.387
  737   1HB   LYS 104          HB2       LYS 104  27.751 -16.273  -5.599
  738   2HB   LYS 104          HB3       LYS 104  27.552 -16.198  -7.349
  739   1HG   LYS 104          HG2       LYS 104  29.908 -15.998  -7.693
  740   2HG   LYS 104          HG3       LYS 104  30.255 -15.920  -5.970
  741   1HD   LYS 104          HD2       LYS 104  29.107 -18.336  -7.430
  742   2HD   LYS 104          HD3       LYS 104  30.785 -18.126  -6.891
  743   1HE   LYS 104          HE2       LYS 104  29.891 -17.817  -4.525
  744   2HE   LYS 104          HE3       LYS 104  28.301 -18.281  -5.136
  745   1HZ   LYS 104          HZ1       LYS 104  29.427 -20.124  -4.144
  746   2HZ   LYS 104          HZ2       LYS 104  29.231 -20.435  -5.744
  747   3HZ   LYS 104          HZ3       LYS 104  30.703 -20.007  -5.164
  748    H    LEU 105           H        LEU 105  26.785 -13.683  -4.272
  749    HA   LEU 105           HA       LEU 105  24.110 -13.479  -5.139
  750   1HB   LEU 105          HB2       LEU 105  24.917 -13.524  -2.803
  751   2HB   LEU 105          HB3       LEU 105  25.603 -11.924  -2.973
  752    HG   LEU 105           HG       LEU 105  23.507 -12.008  -1.696
  753   1HD1  LEU 105          HD11      LEU 105  24.161  -9.926  -2.946
  754   2HD1  LEU 105          HD12      LEU 105  22.990 -10.390  -4.204
  755   3HD1  LEU 105          HD13      LEU 105  22.442 -10.077  -2.553
  756   1HD2  LEU 105          HD21      LEU 105  21.339 -12.393  -2.747
  757   2HD2  LEU 105          HD22      LEU 105  22.103 -12.712  -4.315
  758   3HD2  LEU 105          HD23      LEU 105  22.363 -13.821  -2.946
  759    H    GLU 106           H        GLU 106  26.607 -10.841  -4.901
  760    HA   GLU 106           HA       GLU 106  24.874  -8.834  -6.030
  761   1HB   GLU 106          HB2       GLU 106  27.927  -8.849  -5.987
  762   2HB   GLU 106          HB3       GLU 106  26.869  -7.479  -6.284
  763   1HG   GLU 106          HG2       GLU 106  25.948  -7.753  -3.960
  764   2HG   GLU 106          HG3       GLU 106  27.208  -8.963  -3.656
  765    H    ALA 107           H        ALA 107  27.321 -11.113  -7.299
  766    HA   ALA 107           HA       ALA 107  27.550 -10.026  -9.884
  767   1HB   ALA 107          HB1       ALA 107  28.418 -12.172 -10.572
  768   2HB   ALA 107          HB2       ALA 107  29.012 -11.847  -8.932
  769   3HB   ALA 107          HB3       ALA 107  27.671 -12.992  -9.198
  770    H    GLU 108           H        GLU 108  25.262 -12.551  -8.625
  771    HA   GLU 108           HA       GLU 108  23.921 -12.898 -11.125
  772   1HB   GLU 108          HB2       GLU 108  23.333 -13.582  -8.255
  773   2HB   GLU 108          HB3       GLU 108  22.033 -13.675  -9.425
  774   1HG   GLU 108          HG2       GLU 108  24.690 -15.130  -9.689
  775   2HG   GLU 108          HG3       GLU 108  23.179 -15.834  -9.117
  776    H    LEU 109           H        LEU 109  23.264 -10.700  -8.335
  777    HA   LEU 109           HA       LEU 109  20.783  -9.697  -9.308
  778   1HB   LEU 109          HB2       LEU 109  22.990  -8.536  -7.559
  779   2HB   LEU 109          HB3       LEU 109  21.613  -7.543  -8.030
  780    HG   LEU 109           HG       LEU 109  21.442 -10.145  -6.463
  781   1HD1  LEU 109          HD11      LEU 109  21.049  -7.253  -5.577
  782   2HD1  LEU 109          HD12      LEU 109  20.894  -8.702  -4.559
  783   3HD1  LEU 109          HD13      LEU 109  22.472  -8.247  -5.220
  784   1HD2  LEU 109          HD21      LEU 109  19.270  -8.118  -7.189
  785   2HD2  LEU 109          HD22      LEU 109  19.356  -9.807  -7.731
  786   3HD2  LEU 109          HD23      LEU 109  19.084  -9.452  -6.030
  787    H    LYS 110           H        LYS 110  24.123  -8.548  -9.932
  788    HA   LYS 110           HA       LYS 110  23.261  -6.337 -11.543
  789   1HB   LYS 110          HB2       LYS 110  25.968  -7.690 -11.128
  790   2HB   LYS 110          HB3       LYS 110  25.736  -6.139 -11.955
  791   1HG   LYS 110          HG2       LYS 110  24.861  -5.099  -9.944
  792   2HG   LYS 110          HG3       LYS 110  24.735  -6.604  -9.103
  793   1HD   LYS 110          HD2       LYS 110  26.567  -5.719  -8.098
  794   2HD   LYS 110          HD3       LYS 110  27.302  -6.812  -9.265
  795   1HE   LYS 110          HE2       LYS 110  27.926  -4.994 -10.719
  796   2HE   LYS 110          HE3       LYS 110  26.843  -3.871  -9.898
  797   1HZ   LYS 110          HZ1       LYS 110  28.232  -3.862  -8.000
  798   2HZ   LYS 110          HZ2       LYS 110  29.223  -5.043  -8.544
  799   3HZ   LYS 110          HZ3       LYS 110  29.198  -3.584  -9.289
  800    H    ASN 111           H        ASN 111  24.313  -9.691 -12.274
  801    HA   ASN 111           HA       ASN 111  24.339  -9.476 -15.118
  802   1HB   ASN 111          HB2       ASN 111  25.313 -11.433 -14.579
  803   2HB   ASN 111          HB3       ASN 111  24.596 -11.511 -13.036
  804   1HD2  ASN 111          HD22      ASN 111  22.507 -12.371 -12.674
  805   2HD2  ASN 111          HD21      ASN 111  22.303 -13.876 -13.465
  806    H    SER 112           H        SER 112  21.740 -10.044 -12.736
  807    HA   SER 112           HA       SER 112  19.810 -10.768 -14.742
  808   1HB   SER 112          HB2       SER 112  19.244  -9.814 -11.938
  809   2HB   SER 112          HB3       SER 112  18.194 -10.757 -13.024
  810    HG   SER 112           HG       SER 112  20.594 -11.595 -11.800
  811    H    GLY 113           H        GLY 113  21.145  -7.734 -13.716
  812   1HA   GLY 113          HA2       GLY 113  20.820  -6.133 -15.565
  813   2HA   GLY 113          HA3       GLY 113  19.082  -6.284 -15.319
  814    H    ALA 114           H        ALA 114  19.933  -6.359 -12.164
  815    HA   ALA 114           HA       ALA 114  18.925  -3.720 -11.922
  816   1HB   ALA 114          HB1       ALA 114  19.205  -3.879  -9.557
  817   2HB   ALA 114          HB2       ALA 114  18.524  -5.397 -10.127
  818   3HB   ALA 114          HB3       ALA 114  20.253  -5.319  -9.702
  819    H    LYS 115           H        LYS 115  19.865  -1.800 -11.650
  820    HA   LYS 115           HA       LYS 115  22.784  -1.696 -12.174
  821   1HB   LYS 115          HB2       LYS 115  22.400   0.758 -12.479
  822   2HB   LYS 115          HB3       LYS 115  21.638  -0.316 -13.645
  823   1HG   LYS 115          HG2       LYS 115  19.442  -0.002 -12.573
  824   2HG   LYS 115          HG3       LYS 115  20.178   1.050 -11.349
  825   1HD   LYS 115          HD2       LYS 115  20.886   2.627 -13.116
  826   2HD   LYS 115          HD3       LYS 115  20.141   1.578 -14.346
  827   1HE   LYS 115          HE2       LYS 115  17.933   1.858 -13.222
  828   2HE   LYS 115          HE3       LYS 115  18.684   2.920 -12.022
  829   1HZ   LYS 115          HZ1       LYS 115  19.221   4.461 -13.821
  830   2HZ   LYS 115          HZ2       LYS 115  18.527   3.480 -14.929
  831   3HZ   LYS 115          HZ3       LYS 115  17.617   4.186 -13.779
  832    H    GLN 116           H        GLN 116  24.096  -1.806 -10.430
  833    HA   GLN 116           HA       GLN 116  23.292  -1.026  -7.793
  834   1HB   GLN 116          HB2       GLN 116  25.134  -2.598  -8.188
  835   2HB   GLN 116          HB3       GLN 116  26.102  -1.297  -8.884
  836   1HG   GLN 116          HG2       GLN 116  26.074  -0.070  -6.762
  837   2HG   GLN 116          HG3       GLN 116  24.885  -1.184  -6.082
  838   1HE2  GLN 116          HE22      GLN 116  26.933  -0.809  -4.477
  839   2HE2  GLN 116          HE21      GLN 116  27.960  -2.217  -4.463
  840    H    THR 117           H        THR 117  22.860   1.032  -7.164
  841    HA   THR 117           HA       THR 117  24.028   3.290  -8.759
  842    HB   THR 117           HB       THR 117  21.204   2.786  -7.802
  843    HG1  THR 117           HG1      THR 117  21.624   1.677  -9.642
  844   1HG2  THR 117          HG21      THR 117  20.596   4.896  -8.972
  845   2HG2  THR 117          HG22      THR 117  21.664   5.181  -7.585
  846   3HG2  THR 117          HG23      THR 117  22.329   5.226  -9.230
  847    H    GLY 118           H        GLY 118  24.555   5.119  -7.707
  848   1HA   GLY 118          HA2       GLY 118  24.806   6.630  -5.928
  849   2HA   GLY 118          HA3       GLY 118  24.153   5.430  -4.791
  850    H    GLU 119           H        GLU 119  25.486   4.026  -3.870
  851    HA   GLU 119           HA       GLU 119  27.873   2.923  -4.937
  852   1HB   GLU 119          HB2       GLU 119  29.541   3.735  -3.375
  853   2HB   GLU 119          HB3       GLU 119  28.935   5.078  -4.321
  854   1HG   GLU 119          HG2       GLU 119  27.520   5.816  -2.452
  855   2HG   GLU 119          HG3       GLU 119  28.001   4.411  -1.504
  856    H    THR 120           H        THR 120  28.994   1.778  -2.853
  857    HA   THR 120           HA       THR 120  26.987   0.111  -1.587
  858    HB   THR 120           HB       THR 120  29.975   0.518  -1.115
  859    HG1  THR 120           HG1      THR 120  29.231  -0.361  -3.115
  860   1HG2  THR 120          HG21      THR 120  28.058  -1.527   0.066
  861   2HG2  THR 120          HG22      THR 120  29.834  -1.712   0.032
  862   3HG2  THR 120          HG23      THR 120  29.097  -0.391   0.949
  863    H    LEU 121           H        LEU 121  25.646   0.785  -0.034
  864    HA   LEU 121           HA       LEU 121  26.173   3.105   1.688
  865   1HB   LEU 121          HB2       LEU 121  23.888   2.057   0.744
  866   2HB   LEU 121          HB3       LEU 121  23.996   1.077   2.197
  867    HG   LEU 121           HG       LEU 121  24.147   4.094   2.270
  868   1HD1  LEU 121          HD11      LEU 121  22.085   3.346   1.086
  869   2HD1  LEU 121          HD12      LEU 121  21.571   2.561   2.596
  870   3HD1  LEU 121          HD13      LEU 121  21.841   4.332   2.522
  871   1HD2  LEU 121          HD21      LEU 121  23.070   3.810   4.539
  872   2HD2  LEU 121          HD22      LEU 121  23.469   2.087   4.426
  873   3HD2  LEU 121          HD23      LEU 121  24.741   3.337   4.416
  874    H    LYS 122           H        LYS 122  26.394   2.745   4.079
  875    HA   LYS 122           HA       LYS 122  27.751   0.165   4.717
  876   1HB   LYS 122          HB2       LYS 122  28.693   2.993   5.286
  877   2HB   LYS 122          HB3       LYS 122  29.489   1.546   5.874
  878   1HG   LYS 122          HG2       LYS 122  30.126   0.896   3.642
  879   2HG   LYS 122          HG3       LYS 122  29.090   2.112   2.908
  880   1HD   LYS 122          HD2       LYS 122  30.566   3.852   4.217
  881   2HD   LYS 122          HD3       LYS 122  31.715   2.521   4.332
  882   1HE   LYS 122          HE2       LYS 122  32.274   3.865   2.401
  883   2HE   LYS 122          HE3       LYS 122  31.667   2.312   1.820
  884   1HZ   LYS 122          HZ1       LYS 122  30.736   4.293   0.616
  885   2HZ   LYS 122          HZ2       LYS 122  29.584   3.355   1.265
  886   3HZ   LYS 122          HZ3       LYS 122  30.017   4.772   1.990
  887    H    ILE 123           H        ILE 123  27.415  -0.509   6.780
  888    HA   ILE 123           HA       ILE 123  25.745   1.121   8.637
  889    HB   ILE 123           HB       ILE 123  24.676  -0.979   9.314
  890   1HG1  ILE 123          HG12      ILE 123  26.707  -2.237   7.529
  891   2HG1  ILE 123          HG13      ILE 123  25.978  -2.800   9.017
  892   1HG2  ILE 123          HG21      ILE 123  23.178  -1.191   7.408
  893   2HG2  ILE 123          HG22      ILE 123  23.657   0.491   7.627
  894   3HG2  ILE 123          HG23      ILE 123  24.398  -0.465   6.334
  895   1HD1  ILE 123          HD11      ILE 123  25.406  -4.266   7.195
  896   2HD1  ILE 123          HD12      ILE 123  23.924  -3.418   7.675
  897   3HD1  ILE 123          HD13      ILE 123  24.832  -2.912   6.217
  898    H    ASN 124           H        ASN 124  26.238   0.644  10.945
  899    HA   ASN 124           HA       ASN 124  28.697  -0.856  11.398
  900   1HB   ASN 124          HB2       ASN 124  28.888   1.884  10.745
  901   2HB   ASN 124          HB3       ASN 124  29.047   1.867  12.495
  902   1HD2  ASN 124          HD22      ASN 124  30.014  -0.240   9.730
  903   2HD2  ASN 124          HD21      ASN 124  31.665  -0.508  10.269
  904    H    ILE 125           H        ILE 125  26.028  -1.236  12.282
  905    HA   ILE 125           HA       ILE 125  25.960  -0.694  15.140
  906    HB   ILE 125           HB       ILE 125  24.189  -2.279  15.262
  907   1HG1  ILE 125          HG12      ILE 125  24.902  -4.098  13.834
  908   2HG1  ILE 125          HG13      ILE 125  23.266  -3.591  13.482
  909   1HG2  ILE 125          HG21      ILE 125  22.529  -1.245  13.792
  910   2HG2  ILE 125          HG22      ILE 125  23.626  -0.045  14.487
  911   3HG2  ILE 125          HG23      ILE 125  23.810  -0.531  12.796
  912   1HD1  ILE 125          HD11      ILE 125  24.368  -4.129  11.421
  913   2HD1  ILE 125          HD12      ILE 125  24.105  -2.381  11.442
  914   3HD1  ILE 125          HD13      ILE 125  25.722  -3.045  11.774
  915    H    LEU 126           H        LEU 126  26.336  -2.430  16.756
  916    HA   LEU 126           HA       LEU 126  28.946  -3.195  16.702
  917   1HB   LEU 126          HB2       LEU 126  27.522  -3.013  18.710
  918   2HB   LEU 126          HB3       LEU 126  26.672  -4.491  18.253
  919    HG   LEU 126           HG       LEU 126  28.758  -5.806  18.565
  920   1HD1  LEU 126          HD11      LEU 126  30.477  -4.104  18.094
  921   2HD1  LEU 126          HD12      LEU 126  29.958  -3.155  19.504
  922   3HD1  LEU 126          HD13      LEU 126  30.703  -4.755  19.716
  923   1HD2  LEU 126          HD21      LEU 126  28.022  -4.066  20.954
  924   2HD2  LEU 126          HD22      LEU 126  27.165  -5.528  20.418
  925   3HD2  LEU 126          HD23      LEU 126  28.827  -5.651  21.012
  926    H    ASP 127           H        ASP 127  26.226  -5.249  15.620
  927    HA   ASP 127           HA       ASP 127  27.766  -7.658  15.460
  928   1HB   ASP 127          HB2       ASP 127  25.284  -7.533  15.652
  929   2HB   ASP 127          HB3       ASP 127  25.208  -6.924  13.995
  930    H    HIS 128           H        HIS 128  27.605  -4.914  13.299
  931    HA   HIS 128           HA       HIS 128  29.184  -6.316  11.241
  932   1HB   HIS 128          HB2       HIS 128  26.542  -4.910  10.691
  933   2HB   HIS 128          HB3       HIS 128  27.766  -5.155   9.463
  934    HD1  HIS 128           HD1      HIS 128  27.752  -8.316  11.301
  935    HD2  HIS 128           HD2      HIS 128  25.345  -6.369   8.453
  936    HE1  HIS 128           HE1      HIS 128  26.451 -10.143  10.088
  937    H    ASP 129           H        ASP 129  30.494  -4.810  12.918
  938    HA   ASP 129           HA       ASP 129  30.702  -2.031  12.236
  939   1HB   ASP 129          HB2       ASP 129  32.832  -3.971  13.119
  940   2HB   ASP 129          HB3       ASP 129  33.041  -2.211  12.998
  941    H    ILE 130           H        ILE 130  31.660  -4.921  10.719
  942    HA   ILE 130           HA       ILE 130  33.370  -5.158   8.981
  943    HB   ILE 130           HB       ILE 130  30.454  -4.908   8.297
  944   1HG1  ILE 130          HG12      ILE 130  32.273  -7.283   8.657
  945   2HG1  ILE 130          HG13      ILE 130  31.221  -6.630   9.905
  946   1HG2  ILE 130          HG21      ILE 130  32.557  -6.094   6.445
  947   2HG2  ILE 130          HG22      ILE 130  30.790  -6.056   6.195
  948   3HG2  ILE 130          HG23      ILE 130  31.700  -4.572   6.128
  949   1HD1  ILE 130          HD11      ILE 130  29.241  -7.096   8.414
  950   2HD1  ILE 130          HD12      ILE 130  30.343  -7.972   7.326
  951   3HD1  ILE 130          HD13      ILE 130  30.115  -8.529   8.988
  952    HA   PRO 131           HA       PRO 131  33.454  -1.820   5.864
  953   1HB   PRO 131          HB2       PRO 131  31.652   0.148   5.410
  954   2HB   PRO 131          HB3       PRO 131  31.404  -1.545   4.896
  955   1HG   PRO 131          HG2       PRO 131  30.297  -0.178   7.361
  956   2HG   PRO 131          HG3       PRO 131  29.443  -1.229   6.193
  957   1HD   PRO 131          HD2       PRO 131  30.443  -2.171   8.581
  958   2HD   PRO 131          HD3       PRO 131  30.334  -3.146   7.094
  959    H    GLU 132           H        GLU 132  31.785   0.585   7.944
  960    HA   GLU 132           HA       GLU 132  33.970   1.792   9.178
  961   1HB   GLU 132          HB2       GLU 132  34.655   2.271   6.759
  962   2HB   GLU 132          HB3       GLU 132  33.154   3.154   6.555
  963   1HG   GLU 132          HG2       GLU 132  35.163   4.577   6.915
  964   2HG   GLU 132          HG3       GLU 132  33.904   4.876   8.091
  965    H    ASP 133           H        ASP 133  33.249   3.871  10.136
  966    HA   ASP 133           HA       ASP 133  30.853   3.554  11.404
  967   1HB   ASP 133          HB2       ASP 133  32.714   4.795  12.284
  968   2HB   ASP 133          HB3       ASP 133  32.499   6.067  11.082
  969    HA   PRO 134           HA       PRO 134  28.629   7.174   9.358
  970   1HB   PRO 134          HB2       PRO 134  29.096   8.053   6.814
  971   2HB   PRO 134          HB3       PRO 134  30.074   8.567   8.223
  972   1HG   PRO 134          HG2       PRO 134  30.705   6.391   6.210
  973   2HG   PRO 134          HG3       PRO 134  31.781   7.697   6.803
  974   1HD   PRO 134          HD2       PRO 134  31.787   5.159   7.813
  975   2HD   PRO 134          HD3       PRO 134  32.153   6.583   8.842
  976    H    ALA 135           H        ALA 135  26.707   7.364   8.034
  977    HA   ALA 135           HA       ALA 135  26.094   5.268   6.066
  978   1HB   ALA 135          HB1       ALA 135  24.454   5.567   8.634
  979   2HB   ALA 135          HB2       ALA 135  24.077   4.516   7.252
  980   3HB   ALA 135          HB3       ALA 135  25.514   4.199   8.243
  981    H    GLU 136           H        GLU 136  24.732   7.935   8.098
  982    HA   GLU 136           HA       GLU 136  22.555   8.439   6.445
  983   1HB   GLU 136          HB2       GLU 136  22.224  10.459   7.731
  984   2HB   GLU 136          HB3       GLU 136  22.718   9.133   8.782
  985   1HG   GLU 136          HG2       GLU 136  25.050  10.045   8.814
  986   2HG   GLU 136          HG3       GLU 136  24.526  11.387   7.795
  987    H    GLU 137           H        GLU 137  25.849   9.557   5.986
  988    HA   GLU 137           HA       GLU 137  25.285  11.812   4.326
  989   1HB   GLU 137          HB2       GLU 137  27.699   9.947   4.377
  990   2HB   GLU 137          HB3       GLU 137  27.608  11.472   3.485
  991   1HG   GLU 137          HG2       GLU 137  27.128  12.654   5.666
  992   2HG   GLU 137          HG3       GLU 137  27.441  11.135   6.510
  993    H    TRP 138           H        TRP 138  25.411   8.313   3.643
  994    HA   TRP 138           HA       TRP 138  25.364   8.394   0.787
  995   1HB   TRP 138          HB2       TRP 138  25.613   6.417   2.423
  996   2HB   TRP 138          HB3       TRP 138  23.898   6.388   2.501
  997    HD1  TRP 138           HD1      TRP 138  26.705   5.285   0.331
  998    HE1  TRP 138           HE1      TRP 138  25.788   3.858  -1.588
  999    HE3  TRP 138           HE3      TRP 138  21.712   6.380   0.742
 1000    HZ2  TRP 138           HZ2      TRP 138  23.281   3.365  -2.888
 1001    HZ3  TRP 138           HZ3      TRP 138  20.083   5.323  -0.780
 1002    HH2  TRP 138           HH2      TRP 138  20.843   3.856  -2.621
 1003    H    LEU 139           H        LEU 139  22.887   8.047   3.201
 1004    HA   LEU 139           HA       LEU 139  20.593   8.063   1.657
 1005   1HB   LEU 139          HB2       LEU 139  21.232   8.014   4.400
 1006   2HB   LEU 139          HB3       LEU 139  20.341   9.504   4.267
 1007    HG   LEU 139           HG       LEU 139  18.843   7.776   4.902
 1008   1HD1  LEU 139          HD11      LEU 139  18.040   9.464   3.235
 1009   2HD1  LEU 139          HD12      LEU 139  18.333   8.274   1.949
 1010   3HD1  LEU 139          HD13      LEU 139  17.134   7.942   3.222
 1011   1HD2  LEU 139          HD21      LEU 139  19.626   6.182   2.420
 1012   2HD2  LEU 139          HD22      LEU 139  20.156   5.833   4.079
 1013   3HD2  LEU 139          HD23      LEU 139  18.444   5.731   3.662
 1014    H    GLY 140           H        GLY 140  22.021  10.926   3.302
 1015   1HA   GLY 140          HA2       GLY 140  20.204  12.807   2.189
 1016   2HA   GLY 140          HA3       GLY 140  21.802  13.181   2.853
 1017    H    SER 141           H        SER 141  23.465  11.751   1.018
 1018    HA   SER 141           HA       SER 141  23.651  13.596  -1.123
 1019   1HB   SER 141          HB2       SER 141  25.517  12.257  -0.195
 1020   2HB   SER 141          HB3       SER 141  24.823  10.793  -0.918
 1021    HG   SER 141           HG       SER 141  26.464  11.790  -2.203
 1022    H    TRP 142           H        TRP 142  22.632  10.125  -1.186
 1023    HA   TRP 142           HA       TRP 142  21.930  10.019  -3.888
 1024   1HB   TRP 142          HB2       TRP 142  22.338   8.089  -2.498
 1025   2HB   TRP 142          HB3       TRP 142  21.000   8.504  -1.451
 1026    HD1  TRP 142           HD1      TRP 142  21.417   7.491  -5.184
 1027    HE1  TRP 142           HE1      TRP 142  19.353   6.160  -5.881
 1028    HE3  TRP 142           HE3      TRP 142  18.861   7.678  -0.776
 1029    HZ2  TRP 142           HZ2      TRP 142  16.911   5.160  -4.617
 1030    HZ3  TRP 142           HZ3      TRP 142  16.629   6.600  -0.571
 1031    HH2  TRP 142           HH2      TRP 142  15.658   5.329  -2.470
 1032    H    VAL 143           H        VAL 143  19.813  10.731  -1.053
 1033    HA   VAL 143           HA       VAL 143  17.392  10.954  -2.503
 1034    HB   VAL 143           HB       VAL 143  18.374  12.062   0.154
 1035   1HG1  VAL 143          HG11      VAL 143  16.012  12.586   0.719
 1036   2HG1  VAL 143          HG12      VAL 143  16.646  13.643  -0.541
 1037   3HG1  VAL 143          HG13      VAL 143  15.560  12.295  -0.978
 1038   1HG2  VAL 143          HG21      VAL 143  17.953   9.586  -0.108
 1039   2HG2  VAL 143          HG22      VAL 143  16.904  10.349   1.082
 1040   3HG2  VAL 143          HG23      VAL 143  16.280   9.948  -0.537
 1041    H    ASN 144           H        ASN 144  19.677  13.613  -1.476
 1042    HA   ASN 144           HA       ASN 144  18.031  15.498  -2.862
 1043   1HB   ASN 144          HB2       ASN 144  19.216  17.165  -2.008
 1044   2HB   ASN 144          HB3       ASN 144  19.690  15.921  -0.860
 1045   1HD2  ASN 144          HD22      ASN 144  21.776  14.719  -1.461
 1046   2HD2  ASN 144          HD21      ASN 144  23.024  15.627  -2.293
 1047    H    LEU 145           H        LEU 145  20.450  13.357  -4.028
 1048    HA   LEU 145           HA       LEU 145  21.041  14.908  -6.449
 1049   1HB   LEU 145          HB2       LEU 145  21.870  12.253  -5.321
 1050   2HB   LEU 145          HB3       LEU 145  21.754  12.339  -7.065
 1051    HG   LEU 145           HG       LEU 145  23.281  14.207  -7.196
 1052   1HD1  LEU 145          HD11      LEU 145  22.840  15.325  -5.005
 1053   2HD1  LEU 145          HD12      LEU 145  23.679  13.992  -4.188
 1054   3HD1  LEU 145          HD13      LEU 145  24.561  15.051  -5.303
 1055   1HD2  LEU 145          HD21      LEU 145  24.160  11.901  -7.241
 1056   2HD2  LEU 145          HD22      LEU 145  25.331  13.018  -6.521
 1057   3HD2  LEU 145          HD23      LEU 145  24.375  11.940  -5.477
 1058    H    LEU 146           H        LEU 146  19.002  11.971  -5.680
 1059    HA   LEU 146           HA       LEU 146  18.092  11.829  -8.379
 1060   1HB   LEU 146          HB2       LEU 146  16.781  10.070  -7.683
 1061   2HB   LEU 146          HB3       LEU 146  18.285   9.944  -6.814
 1062    HG   LEU 146           HG       LEU 146  16.845  11.100  -4.866
 1063   1HD1  LEU 146          HD11      LEU 146  14.702   9.626  -6.471
 1064   2HD1  LEU 146          HD12      LEU 146  14.523  10.261  -4.823
 1065   3HD1  LEU 146          HD13      LEU 146  14.721  11.372  -6.172
 1066   1HD2  LEU 146          HD21      LEU 146  16.611   8.170  -5.660
 1067   2HD2  LEU 146          HD22      LEU 146  17.932   8.918  -4.748
 1068   3HD2  LEU 146          HD23      LEU 146  16.321   8.830  -4.033
 1069    H    LYS 147           H        LYS 147  16.875  13.460  -5.505
 1070    HA   LYS 147           HA       LYS 147  14.298  14.177  -6.469
 1071   1HB   LYS 147          HB2       LYS 147  16.202  15.265  -4.370
 1072   2HB   LYS 147          HB3       LYS 147  14.747  16.169  -4.811
 1073   1HG   LYS 147          HG2       LYS 147  13.329  14.186  -4.346
 1074   2HG   LYS 147          HG3       LYS 147  14.761  13.277  -3.840
 1075   1HD   LYS 147          HD2       LYS 147  15.140  14.886  -2.005
 1076   2HD   LYS 147          HD3       LYS 147  13.739  15.842  -2.532
 1077   1HE   LYS 147          HE2       LYS 147  12.298  13.882  -2.159
 1078   2HE   LYS 147          HE3       LYS 147  13.678  12.924  -1.635
 1079   1HZ   LYS 147          HZ1       LYS 147  12.523  15.269  -0.245
 1080   2HZ   LYS 147          HZ2       LYS 147  12.564  13.714   0.282
 1081   3HZ   LYS 147          HZ3       LYS 147  13.942  14.582   0.200
  Start of MODEL   15
    1   1H    MET   1          H1        MET   1   2.619  -1.043  -2.081
    2   2H    MET   1          H2        MET   1   1.103  -0.417  -2.078
    3   3H    MET   1          H3        MET   1   2.319   0.384  -2.823
    4    HA   MET   1           HA       MET   1   1.769   1.445  -0.777
    5   1HB   MET   1          HB2       MET   1   0.911  -0.478   0.441
    6   2HB   MET   1          HB3       MET   1   2.517  -1.208   0.516
    7   1HG   MET   1          HG2       MET   1   1.883  -0.104   2.623
    8   2HG   MET   1          HG3       MET   1   3.331   0.606   1.925
    9   1HE   MET   1          HE1       MET   1   1.791   3.671   3.755
   10   2HE   MET   1          HE2       MET   1   1.824   1.977   4.294
   11   3HE   MET   1          HE3       MET   1   3.244   2.682   3.487
   12    H    ALA   2           H        ALA   2   4.587  -0.838  -0.312
   13    HA   ALA   2           HA       ALA   2   6.338   1.342   0.242
   14   1HB   ALA   2          HB1       ALA   2   6.735  -0.895   1.134
   15   2HB   ALA   2          HB2       ALA   2   6.902  -1.559  -0.503
   16   3HB   ALA   2          HB3       ALA   2   8.100  -0.412   0.113
   17    H    ASP   3           H        ASP   3   8.064   2.169  -0.940
   18    HA   ASP   3           HA       ASP   3   7.979   2.013  -3.895
   19   1HB   ASP   3          HB2       ASP   3   8.016   4.247  -2.631
   20   2HB   ASP   3          HB3       ASP   3   9.595   3.803  -2.033
   21    H    ILE   4           H        ILE   4   9.783   1.014  -1.064
   22    HA   ILE   4           HA       ILE   4  11.979  -0.084  -2.747
   23    HB   ILE   4           HB       ILE   4  12.323   1.083   0.036
   24   1HG1  ILE   4          HG12      ILE   4  12.883   2.542  -2.576
   25   2HG1  ILE   4          HG13      ILE   4  11.657   2.978  -1.384
   26   1HG2  ILE   4          HG21      ILE   4  14.387   0.569  -2.129
   27   2HG2  ILE   4          HG22      ILE   4  14.664   0.929  -0.416
   28   3HG2  ILE   4          HG23      ILE   4  13.978  -0.619  -0.904
   29   1HD1  ILE   4          HD11      ILE   4  13.449   3.417   0.279
   30   2HD1  ILE   4          HD12      ILE   4  14.660   3.141  -1.002
   31   3HD1  ILE   4          HD13      ILE   4  13.501   4.467  -1.147
   32    H    THR   5           H        THR   5  12.332  -2.243  -2.359
   33    HA   THR   5           HA       THR   5  11.066  -3.510   0.010
   34    HB   THR   5           HB       THR   5  10.638  -4.518  -2.244
   35    HG1  THR   5           HG1      THR   5  10.503  -5.863  -0.550
   36   1HG2  THR   5          HG21      THR   5  13.590  -5.194  -2.314
   37   2HG2  THR   5          HG22      THR   5  12.326  -5.800  -3.400
   38   3HG2  THR   5          HG23      THR   5  12.725  -4.079  -3.401
   39    H    LEU   6           H        LEU   6  12.351  -4.000   1.767
   40    HA   LEU   6           HA       LEU   6  15.293  -3.429   1.615
   41   1HB   LEU   6          HB2       LEU   6  13.192  -3.052   3.745
   42   2HB   LEU   6          HB3       LEU   6  14.845  -3.294   4.218
   43    HG   LEU   6           HG       LEU   6  13.987  -0.942   4.190
   44   1HD1  LEU   6          HD11      LEU   6  16.083   0.039   3.275
   45   2HD1  LEU   6          HD12      LEU   6  16.338  -1.317   4.368
   46   3HD1  LEU   6          HD13      LEU   6  16.503  -1.556   2.609
   47   1HD2  LEU   6          HD21      LEU   6  13.917   0.331   2.137
   48   2HD2  LEU   6          HD22      LEU   6  14.366  -1.109   1.200
   49   3HD2  LEU   6          HD23      LEU   6  12.786  -1.032   2.012
   50    H    ILE   7           H        ILE   7  16.026  -5.423   1.161
   51    HA   ILE   7           HA       ILE   7  14.767  -7.826   2.280
   52    HB   ILE   7           HB       ILE   7  17.235  -7.609   0.516
   53   1HG1  ILE   7          HG12      ILE   7  15.509  -6.485  -0.754
   54   2HG1  ILE   7          HG13      ILE   7  15.892  -8.039  -1.458
   55   1HG2  ILE   7          HG21      ILE   7  16.956  -9.765   1.612
   56   2HG2  ILE   7          HG22      ILE   7  15.286  -9.883   1.017
   57   3HG2  ILE   7          HG23      ILE   7  16.665  -9.904  -0.118
   58   1HD1  ILE   7          HD11      ILE   7  13.507  -7.592  -1.551
   59   2HD1  ILE   7          HD12      ILE   7  13.806  -9.002  -0.526
   60   3HD1  ILE   7          HD13      ILE   7  13.422  -7.426   0.216
   61    H    SER   8           H        SER   8  15.534  -8.858   4.043
   62    HA   SER   8           HA       SER   8  18.322  -8.479   5.000
   63   1HB   SER   8          HB2       SER   8  16.056  -8.723   6.963
   64   2HB   SER   8          HB3       SER   8  17.628  -7.935   7.152
   65    HG   SER   8           HG       SER   8  15.310  -7.060   5.814
   66    H    GLY   9           H        GLY   9  18.440 -10.266   7.038
   67   1HA   GLY   9          HA2       GLY   9  18.276 -12.433   7.754
   68   2HA   GLY   9          HA3       GLY   9  16.725 -12.536   6.896
   69    H    SER  10           H        SER  10  20.028 -11.983   5.647
   70    HA   SER  10           HA       SER  10  19.817 -13.089   3.257
   71   1HB   SER  10          HB2       SER  10  22.412 -13.475   4.727
   72   2HB   SER  10          HB3       SER  10  22.107 -12.734   3.148
   73    HG   SER  10           HG       SER  10  22.070 -10.915   4.052
   74    H    THR  11           H        THR  11  20.800 -14.995   6.150
   75    HA   THR  11           HA       THR  11  21.281 -17.419   4.660
   76    HB   THR  11           HB       THR  11  21.615 -18.199   7.137
   77    HG1  THR  11           HG1      THR  11  21.691 -16.573   8.635
   78   1HG2  THR  11          HG21      THR  11  23.771 -17.051   7.324
   79   2HG2  THR  11          HG22      THR  11  23.486 -17.556   5.651
   80   3HG2  THR  11          HG23      THR  11  23.264 -15.855   6.110
   81    H    LEU  12           H        LEU  12  18.445 -16.222   4.723
   82    HA   LEU  12           HA       LEU  12  16.310 -16.802   4.974
   83   1HB   LEU  12          HB2       LEU  12  17.273 -18.987   3.903
   84   2HB   LEU  12          HB3       LEU  12  16.896 -19.723   5.448
   85    HG   LEU  12           HG       LEU  12  14.964 -18.267   3.580
   86   1HD1  LEU  12          HD11      LEU  12  15.178 -21.220   4.308
   87   2HD1  LEU  12          HD12      LEU  12  13.987 -20.489   3.207
   88   3HD1  LEU  12          HD13      LEU  12  15.703 -20.485   2.779
   89   1HD2  LEU  12          HD21      LEU  12  14.161 -17.938   5.868
   90   2HD2  LEU  12          HD22      LEU  12  13.134 -19.099   5.029
   91   3HD2  LEU  12          HD23      LEU  12  14.334 -19.678   6.206
   92    H    GLY  13           H        GLY  13  17.239 -15.541   6.838
   93   1HA   GLY  13          HA2       GLY  13  16.447 -16.697   9.480
   94   2HA   GLY  13          HA3       GLY  13  18.042 -15.956   9.260
   95    H    GLY  14           H        GLY  14  17.834 -14.018  10.414
   96   1HA   GLY  14          HA2       GLY  14  16.066 -12.005   9.214
   97   2HA   GLY  14          HA3       GLY  14  15.836 -12.310  10.939
   98    H    ALA  15           H        ALA  15  16.767  -9.930   9.571
   99    HA   ALA  15           HA       ALA  15  19.031  -9.253  11.265
  100   1HB   ALA  15          HB1       ALA  15  20.527  -8.485   9.480
  101   2HB   ALA  15          HB2       ALA  15  20.205 -10.211   9.266
  102   3HB   ALA  15          HB3       ALA  15  19.384  -9.013   8.235
  103    H    GLU  16           H        GLU  16  16.089  -8.553  10.355
  104    HA   GLU  16           HA       GLU  16  16.021  -6.155   9.034
  105   1HB   GLU  16          HB2       GLU  16  14.060  -7.181  11.131
  106   2HB   GLU  16          HB3       GLU  16  13.765  -5.827  10.052
  107   1HG   GLU  16          HG2       GLU  16  12.676  -7.473   8.923
  108   2HG   GLU  16          HG3       GLU  16  14.232  -7.495   8.108
  109    H    TYR  17           H        TYR  17  17.117  -6.470  12.330
  110    HA   TYR  17           HA       TYR  17  16.177  -4.149  13.530
  111   1HB   TYR  17          HB2       TYR  17  17.443  -5.864  14.707
  112   2HB   TYR  17          HB3       TYR  17  18.891  -5.498  13.778
  113    HD1  TYR  17           HD1      TYR  17  20.365  -3.697  14.412
  114    HD2  TYR  17           HD2      TYR  17  16.533  -4.151  16.350
  115    HE1  TYR  17           HE1      TYR  17  21.028  -2.019  16.109
  116    HE2  TYR  17           HE2      TYR  17  17.186  -2.476  18.048
  117    HH   TYR  17           HH       TYR  17  18.852  -1.025  18.794
  118    H    VAL  18           H        VAL  18  19.119  -4.422  11.433
  119    HA   VAL  18           HA       VAL  18  19.568  -1.538  11.677
  120    HB   VAL  18           HB       VAL  18  21.375  -3.241  11.651
  121   1HG1  VAL  18          HG11      VAL  18  22.218  -4.174   9.577
  122   2HG1  VAL  18          HG12      VAL  18  20.560  -4.729   9.833
  123   3HG1  VAL  18          HG13      VAL  18  20.896  -3.438   8.654
  124   1HG2  VAL  18          HG21      VAL  18  22.954  -1.941  10.376
  125   2HG2  VAL  18          HG22      VAL  18  21.640  -1.138   9.479
  126   3HG2  VAL  18          HG23      VAL  18  21.836  -0.866  11.225
  127    H    ALA  19           H        ALA  19  18.041  -3.759   9.387
  128    HA   ALA  19           HA       ALA  19  17.841  -1.963   7.168
  129   1HB   ALA  19          HB1       ALA  19  17.472  -4.446   7.053
  130   2HB   ALA  19          HB2       ALA  19  15.950  -4.218   7.946
  131   3HB   ALA  19          HB3       ALA  19  16.151  -3.495   6.346
  132    H    GLU  20           H        GLU  20  15.822  -2.477  10.082
  133    HA   GLU  20           HA       GLU  20  13.662  -0.821   9.290
  134   1HB   GLU  20          HB2       GLU  20  13.671  -2.543  11.116
  135   2HB   GLU  20          HB3       GLU  20  14.639  -1.439  12.106
  136   1HG   GLU  20          HG2       GLU  20  12.803   0.246  11.968
  137   2HG   GLU  20          HG3       GLU  20  11.870  -0.858  10.957
  138    H    HIS  21           H        HIS  21  16.772  -0.074  10.949
  139    HA   HIS  21           HA       HIS  21  16.101   2.650  11.572
  140   1HB   HIS  21          HB2       HIS  21  18.008   1.272  12.521
  141   2HB   HIS  21          HB3       HIS  21  18.883   1.570  11.019
  142    HD1  HIS  21           HD1      HIS  21  18.272   4.687  10.640
  143    HD2  HIS  21           HD2      HIS  21  19.045   2.778  14.302
  144    HE1  HIS  21           HE1      HIS  21  19.152   6.493  12.210
  145    H    LEU  22           H        LEU  22  17.662   1.067   8.760
  146    HA   LEU  22           HA       LEU  22  18.183   3.425   7.218
  147   1HB   LEU  22          HB2       LEU  22  17.719   0.488   6.600
  148   2HB   LEU  22          HB3       LEU  22  17.880   1.633   5.300
  149    HG   LEU  22           HG       LEU  22  19.969   1.331   7.516
  150   1HD1  LEU  22          HD11      LEU  22  19.799  -0.081   4.829
  151   2HD1  LEU  22          HD12      LEU  22  21.230  -0.064   5.888
  152   3HD1  LEU  22          HD13      LEU  22  19.737  -0.826   6.440
  153   1HD2  LEU  22          HD21      LEU  22  20.115   2.555   4.721
  154   2HD2  LEU  22          HD22      LEU  22  20.213   3.421   6.274
  155   3HD2  LEU  22          HD23      LEU  22  21.502   2.320   5.805
  156    H    ALA  23           H        ALA  23  15.492   1.101   7.097
  157    HA   ALA  23           HA       ALA  23  13.793   2.302   5.279
  158   1HB   ALA  23          HB1       ALA  23  13.086   0.793   7.827
  159   2HB   ALA  23          HB2       ALA  23  11.979   1.105   6.503
  160   3HB   ALA  23          HB3       ALA  23  13.400   0.081   6.229
  161    H    GLU  24           H        GLU  24  13.925   2.981   8.840
  162    HA   GLU  24           HA       GLU  24  11.808   4.789   8.972
  163   1HB   GLU  24          HB2       GLU  24  13.237   3.856  10.859
  164   2HB   GLU  24          HB3       GLU  24  14.449   5.063  10.494
  165   1HG   GLU  24          HG2       GLU  24  12.808   6.848  10.913
  166   2HG   GLU  24          HG3       GLU  24  11.549   5.654  11.229
  167    H    LYS  25           H        LYS  25  15.272   5.573   8.523
  168    HA   LYS  25           HA       LYS  25  14.911   8.326   7.995
  169   1HB   LYS  25          HB2       LYS  25  17.051   6.327   7.154
  170   2HB   LYS  25          HB3       LYS  25  17.212   8.056   6.944
  171   1HG   LYS  25          HG2       LYS  25  16.903   6.514   9.574
  172   2HG   LYS  25          HG3       LYS  25  18.349   7.261   8.980
  173   1HD   LYS  25          HD2       LYS  25  15.888   8.562  10.125
  174   2HD   LYS  25          HD3       LYS  25  17.544   8.635  10.719
  175   1HE   LYS  25          HE2       LYS  25  18.141   9.935   8.600
  176   2HE   LYS  25          HE3       LYS  25  16.405  10.003   8.240
  177   1HZ   LYS  25          HZ1       LYS  25  17.696  11.135  10.657
  178   2HZ   LYS  25          HZ2       LYS  25  17.137  11.988   9.389
  179   3HZ   LYS  25          HZ3       LYS  25  16.092  11.183  10.346
  180    H    LEU  26           H        LEU  26  14.976   5.601   5.712
  181    HA   LEU  26           HA       LEU  26  14.805   7.131   3.308
  182   1HB   LEU  26          HB2       LEU  26  13.895   4.342   4.075
  183   2HB   LEU  26          HB3       LEU  26  13.582   4.978   2.468
  184    HG   LEU  26           HG       LEU  26  16.395   4.900   3.628
  185   1HD1  LEU  26          HD11      LEU  26  16.741   2.803   2.396
  186   2HD1  LEU  26          HD12      LEU  26  15.504   2.603   3.641
  187   3HD1  LEU  26          HD13      LEU  26  15.024   2.761   1.938
  188   1HD2  LEU  26          HD21      LEU  26  15.272   5.105   0.796
  189   2HD2  LEU  26          HD22      LEU  26  16.137   6.370   1.690
  190   3HD2  LEU  26          HD23      LEU  26  16.987   4.903   1.183
  191    H    GLU  27           H        GLU  27  12.164   5.978   5.537
  192    HA   GLU  27           HA       GLU  27  10.131   7.060   3.825
  193   1HB   GLU  27          HB2       GLU  27  10.136   6.136   6.727
  194   2HB   GLU  27          HB3       GLU  27   8.713   6.711   5.856
  195   1HG   GLU  27          HG2       GLU  27   9.267   4.979   4.049
  196   2HG   GLU  27          HG3       GLU  27  10.400   4.288   5.182
  197    H    GLU  28           H        GLU  28  11.970   8.369   6.644
  198    HA   GLU  28           HA       GLU  28  10.592  10.843   6.816
  199   1HB   GLU  28          HB2       GLU  28  13.445   9.967   7.413
  200   2HB   GLU  28          HB3       GLU  28  12.889  11.592   7.710
  201   1HG   GLU  28          HG2       GLU  28  11.616   9.128   8.960
  202   2HG   GLU  28          HG3       GLU  28  12.893  10.085   9.703
  203    H    ALA  29           H        ALA  29  13.074   9.679   4.519
  204    HA   ALA  29           HA       ALA  29  13.660  12.271   3.409
  205   1HB   ALA  29          HB1       ALA  29  15.198  10.339   3.194
  206   2HB   ALA  29          HB2       ALA  29  14.008   9.513   2.157
  207   3HB   ALA  29          HB3       ALA  29  14.746  11.023   1.618
  208    H    GLY  30           H        GLY  30  10.984  10.070   3.028
  209   1HA   GLY  30          HA2       GLY  30   9.066  11.457   2.245
  210   2HA   GLY  30          HA3       GLY  30   9.946  11.666   0.727
  211    H    PHE  31           H        PHE  31  10.660   8.472   1.551
  212    HA   PHE  31           HA       PHE  31   8.640   7.662  -0.464
  213   1HB   PHE  31          HB2       PHE  31  10.868   5.883   0.473
  214   2HB   PHE  31          HB3       PHE  31  10.072   5.960  -1.079
  215    HD1  PHE  31           HD1      PHE  31  13.072   6.693   0.563
  216    HD2  PHE  31           HD2      PHE  31  10.349   8.375  -2.330
  217    HE1  PHE  31           HE1      PHE  31  14.874   8.157  -0.281
  218    HE2  PHE  31           HE2      PHE  31  12.159   9.853  -3.168
  219    HZ   PHE  31           HZ       PHE  31  14.417   9.763  -2.135
  220    H    THR  32           H        THR  32   8.419   4.981  -0.043
  221    HA   THR  32           HA       THR  32   7.618   4.507   2.755
  222    HB   THR  32           HB       THR  32   5.856   2.959   1.695
  223    HG1  THR  32           HG1      THR  32   5.153   3.490  -0.314
  224   1HG2  THR  32          HG21      THR  32   4.144   4.732   1.776
  225   2HG2  THR  32          HG22      THR  32   5.318   4.888   3.098
  226   3HG2  THR  32          HG23      THR  32   5.418   5.977   1.693
  227    H    THR  33           H        THR  33   8.122   2.373   3.395
  228    HA   THR  33           HA       THR  33   9.750   0.798   1.438
  229    HB   THR  33           HB       THR  33  11.528   0.675   3.082
  230    HG1  THR  33           HG1      THR  33  10.271   1.003   4.978
  231   1HG2  THR  33          HG21      THR  33  11.485   2.643   1.458
  232   2HG2  THR  33          HG22      THR  33  10.806   3.624   2.764
  233   3HG2  THR  33          HG23      THR  33  12.418   2.897   2.942
  234    H    GLU  34           H        GLU  34  10.048  -1.420   1.906
  235    HA   GLU  34           HA       GLU  34   8.214  -2.576   3.913
  236   1HB   GLU  34          HB2       GLU  34   8.191  -2.718   1.167
  237   2HB   GLU  34          HB3       GLU  34   9.157  -4.109   1.543
  238   1HG   GLU  34          HG2       GLU  34   6.971  -4.759   1.450
  239   2HG   GLU  34          HG3       GLU  34   7.398  -4.840   3.149
  240    H    THR  35           H        THR  35   9.778  -2.610   5.666
  241    HA   THR  35           HA       THR  35  12.338  -3.884   5.398
  242    HB   THR  35           HB       THR  35  10.762  -3.783   7.968
  243    HG1  THR  35           HG1      THR  35  11.142  -1.673   8.169
  244   1HG2  THR  35          HG21      THR  35  13.076  -4.840   7.753
  245   2HG2  THR  35          HG22      THR  35  13.696  -3.240   7.308
  246   3HG2  THR  35          HG23      THR  35  12.987  -3.503   8.921
  247    H    LEU  36           H        LEU  36  12.685  -5.974   4.999
  248    HA   LEU  36           HA       LEU  36  10.704  -8.056   5.853
  249   1HB   LEU  36          HB2       LEU  36  11.887  -7.487   3.098
  250   2HB   LEU  36          HB3       LEU  36  10.992  -8.944   3.475
  251    HG   LEU  36           HG       LEU  36   9.775  -6.180   3.671
  252   1HD1  LEU  36          HD11      LEU  36   9.714  -8.207   1.401
  253   2HD1  LEU  36          HD12      LEU  36   8.773  -6.689   1.481
  254   3HD1  LEU  36          HD13      LEU  36  10.546  -6.642   1.405
  255   1HD2  LEU  36          HD21      LEU  36   8.580  -7.899   4.990
  256   2HD2  LEU  36          HD22      LEU  36   7.634  -7.398   3.586
  257   3HD2  LEU  36          HD23      LEU  36   8.498  -8.947   3.556
  258    H    HIS  37           H        HIS  37  11.518 -10.255   5.464
  259    HA   HIS  37           HA       HIS  37  14.473 -10.497   5.443
  260   1HB   HIS  37          HB2       HIS  37  14.211 -12.620   6.589
  261   2HB   HIS  37          HB3       HIS  37  13.547 -11.291   7.518
  262    HD1  HIS  37           HD1      HIS  37  12.215 -14.124   5.227
  263    HD2  HIS  37           HD2      HIS  37  11.140 -11.665   8.467
  264    HE1  HIS  37           HE1      HIS  37   9.961 -14.994   6.075
  265    H    GLY  38           H        GLY  38  12.913 -10.001   3.131
  266   1HA   GLY  38          HA2       GLY  38  12.375 -10.698   1.035
  267   2HA   GLY  38          HA3       GLY  38  13.749 -11.792   1.200
  268    HA   PRO  39           HA       PRO  39  10.329 -14.650   2.793
  269   1HB   PRO  39          HB2       PRO  39   7.686 -13.882   3.000
  270   2HB   PRO  39          HB3       PRO  39   8.897 -13.632   4.291
  271   1HG   PRO  39          HG2       PRO  39   7.984 -11.655   2.183
  272   2HG   PRO  39          HG3       PRO  39   8.149 -11.398   3.951
  273   1HD   PRO  39          HD2       PRO  39  10.096 -10.633   2.215
  274   2HD   PRO  39          HD3       PRO  39  10.501 -11.336   3.815
  275    H    LEU  40           H        LEU  40   9.523 -12.536   0.079
  276    HA   LEU  40           HA       LEU  40   8.300 -14.786  -1.414
  277   1HB   LEU  40          HB2       LEU  40   7.925 -11.748  -1.445
  278   2HB   LEU  40          HB3       LEU  40   7.264 -12.819  -2.648
  279    HG   LEU  40           HG       LEU  40   6.542 -12.883   0.306
  280   1HD1  LEU  40          HD11      LEU  40   4.972 -11.881  -2.107
  281   2HD1  LEU  40          HD12      LEU  40   4.388 -11.950  -0.430
  282   3HD1  LEU  40          HD13      LEU  40   5.724 -10.871  -0.854
  283   1HD2  LEU  40          HD21      LEU  40   6.259 -15.121  -0.647
  284   2HD2  LEU  40          HD22      LEU  40   4.678 -14.377  -0.418
  285   3HD2  LEU  40          HD23      LEU  40   5.388 -14.451  -2.046
  286    H    LEU  41           H        LEU  41  11.235 -13.702  -0.984
  287    HA   LEU  41           HA       LEU  41  13.112 -13.257  -2.067
  288   1HB   LEU  41          HB2       LEU  41  12.285 -15.222  -3.482
  289   2HB   LEU  41          HB3       LEU  41  11.739 -14.027  -4.649
  290    HG   LEU  41           HG       LEU  41  14.213 -13.169  -4.645
  291   1HD1  LEU  41          HD11      LEU  41  14.949 -14.490  -2.653
  292   2HD1  LEU  41          HD12      LEU  41  14.623 -15.987  -3.545
  293   3HD1  LEU  41          HD13      LEU  41  15.874 -14.856  -4.115
  294   1HD2  LEU  41          HD21      LEU  41  13.426 -15.864  -5.804
  295   2HD2  LEU  41          HD22      LEU  41  13.161 -14.270  -6.531
  296   3HD2  LEU  41          HD23      LEU  41  14.816 -14.876  -6.329
  297    H    GLU  42           H        GLU  42  10.225 -11.709  -3.289
  298    HA   GLU  42           HA       GLU  42  11.504  -9.143  -3.839
  299   1HB   GLU  42          HB2       GLU  42  10.837  -9.223  -6.276
  300   2HB   GLU  42          HB3       GLU  42  12.250 -10.157  -5.834
  301   1HG   GLU  42          HG2       GLU  42  10.905 -12.253  -5.900
  302   2HG   GLU  42          HG3       GLU  42   9.500 -11.331  -6.418
  303    H    ASP  43           H        ASP  43   9.988  -8.585  -2.193
  304    HA   ASP  43           HA       ASP  43   7.158  -9.075  -2.497
  305   1HB   ASP  43          HB2       ASP  43   8.085  -8.472  -0.335
  306   2HB   ASP  43          HB3       ASP  43   8.626  -6.906  -0.969
  307    H    LEU  44           H        LEU  44   9.367  -6.363  -3.457
  308    HA   LEU  44           HA       LEU  44   7.136  -5.255  -5.095
  309   1HB   LEU  44          HB2       LEU  44   9.944  -4.190  -4.720
  310   2HB   LEU  44          HB3       LEU  44   8.722  -3.434  -5.673
  311    HG   LEU  44           HG       LEU  44   8.598  -3.798  -2.658
  312   1HD1  LEU  44          HD11      LEU  44  10.116  -2.011  -3.589
  313   2HD1  LEU  44          HD12      LEU  44   8.708  -1.276  -4.368
  314   3HD1  LEU  44          HD13      LEU  44   8.779  -1.388  -2.597
  315   1HD2  LEU  44          HD21      LEU  44   6.531  -2.387  -2.789
  316   2HD2  LEU  44          HD22      LEU  44   6.535  -2.585  -4.554
  317   3HD2  LEU  44          HD23      LEU  44   6.313  -3.990  -3.481
  318    HA   PRO  45           HA       PRO  45   8.427  -7.487  -8.617
  319   1HB   PRO  45          HB2       PRO  45   7.827  -5.727 -10.710
  320   2HB   PRO  45          HB3       PRO  45   6.663  -6.674  -9.782
  321   1HG   PRO  45          HG2       PRO  45   7.525  -3.786  -9.424
  322   2HG   PRO  45          HG3       PRO  45   5.866  -4.447  -9.365
  323   1HD   PRO  45          HD2       PRO  45   7.339  -3.885  -7.110
  324   2HD   PRO  45          HD3       PRO  45   6.153  -5.228  -7.178
  325    H    ALA  46           H        ALA  46   9.488  -7.029 -10.862
  326    HA   ALA  46           HA       ALA  46  12.256  -6.276 -10.453
  327   1HB   ALA  46          HB1       ALA  46  10.751  -7.088 -12.990
  328   2HB   ALA  46          HB2       ALA  46  12.513  -7.013 -12.812
  329   3HB   ALA  46          HB3       ALA  46  11.591  -8.203 -11.882
  330    H    SER  47           H        SER  47  10.510  -4.094  -9.991
  331    HA   SER  47           HA       SER  47  11.450  -2.021 -11.734
  332   1HB   SER  47          HB2       SER  47   8.467  -2.452 -11.465
  333   2HB   SER  47          HB3       SER  47   9.261  -1.119 -12.311
  334    HG   SER  47           HG       SER  47   8.509  -2.759 -13.731
  335    H    GLY  48           H        GLY  48  11.916  -0.372 -10.241
  336   1HA   GLY  48          HA2       GLY  48  10.699   0.979  -8.363
  337   2HA   GLY  48          HA3       GLY  48  10.670  -0.580  -7.538
  338    H    ILE  49           H        ILE  49  12.051  -0.125  -5.906
  339    HA   ILE  49           HA       ILE  49  14.940   0.097  -6.599
  340    HB   ILE  49           HB       ILE  49  13.584   1.191  -4.131
  341   1HG1  ILE  49          HG12      ILE  49  12.848   2.618  -5.961
  342   2HG1  ILE  49          HG13      ILE  49  13.873   3.457  -4.821
  343   1HG2  ILE  49          HG21      ILE  49  16.441   1.588  -5.117
  344   2HG2  ILE  49          HG22      ILE  49  15.737   2.305  -3.657
  345   3HG2  ILE  49          HG23      ILE  49  15.947   0.555  -3.785
  346   1HD1  ILE  49          HD11      ILE  49  14.862   2.425  -7.510
  347   2HD1  ILE  49          HD12      ILE  49  14.312   4.077  -7.185
  348   3HD1  ILE  49          HD13      ILE  49  15.748   3.456  -6.364
  349    H    TRP  50           H        TRP  50  16.115  -1.572  -5.653
  350    HA   TRP  50           HA       TRP  50  14.816  -3.315  -3.599
  351   1HB   TRP  50          HB2       TRP  50  16.587  -3.960  -5.993
  352   2HB   TRP  50          HB3       TRP  50  16.537  -4.994  -4.597
  353    HD1  TRP  50           HD1      TRP  50  13.172  -3.644  -5.834
  354    HE1  TRP  50           HE1      TRP  50  11.877  -5.459  -7.070
  355    HE3  TRP  50           HE3      TRP  50  16.798  -7.259  -5.937
  356    HZ2  TRP  50           HZ2      TRP  50  12.325  -8.178  -7.926
  357    HZ3  TRP  50           HZ3      TRP  50  16.322  -9.463  -6.969
  358    HH2  TRP  50           HH2      TRP  50  14.094  -9.936  -7.961
  359    H    LEU  51           H        LEU  51  16.003  -3.325  -1.715
  360    HA   LEU  51           HA       LEU  51  18.878  -2.492  -1.831
  361   1HB   LEU  51          HB2       LEU  51  16.751  -1.770   0.224
  362   2HB   LEU  51          HB3       LEU  51  18.472  -1.535   0.450
  363    HG   LEU  51           HG       LEU  51  16.696  -0.115  -1.579
  364   1HD1  LEU  51          HD11      LEU  51  17.149   1.868  -0.263
  365   2HD1  LEU  51          HD12      LEU  51  16.547   0.604   0.823
  366   3HD1  LEU  51          HD13      LEU  51  18.274   0.986   0.788
  367   1HD2  LEU  51          HD21      LEU  51  19.710   0.162  -1.163
  368   2HD2  LEU  51          HD22      LEU  51  18.884  -0.379  -2.639
  369   3HD2  LEU  51          HD23      LEU  51  18.699   1.286  -2.099
  370    H    VAL  52           H        VAL  52  20.202  -3.938  -0.811
  371    HA   VAL  52           HA       VAL  52  18.869  -6.215   0.593
  372    HB   VAL  52           HB       VAL  52  21.159  -6.376  -1.395
  373   1HG1  VAL  52          HG11      VAL  52  19.514  -8.561  -0.030
  374   2HG1  VAL  52          HG12      VAL  52  20.759  -8.818  -1.271
  375   3HG1  VAL  52          HG13      VAL  52  21.215  -8.172   0.306
  376   1HG2  VAL  52          HG21      VAL  52  18.208  -7.078  -1.744
  377   2HG2  VAL  52          HG22      VAL  52  19.116  -5.835  -2.630
  378   3HG2  VAL  52          HG23      VAL  52  19.498  -7.540  -2.873
  379    H    ILE  53           H        ILE  53  19.351  -5.999   2.616
  380    HA   ILE  53           HA       ILE  53  21.964  -5.100   3.604
  381    HB   ILE  53           HB       ILE  53  19.486  -6.128   5.081
  382   1HG1  ILE  53          HG12      ILE  53  19.434  -3.593   5.812
  383   2HG1  ILE  53          HG13      ILE  53  20.325  -3.306   4.331
  384   1HG2  ILE  53          HG21      ILE  53  20.530  -5.180   7.073
  385   2HG2  ILE  53          HG22      ILE  53  21.605  -6.369   6.356
  386   3HG2  ILE  53          HG23      ILE  53  21.935  -4.636   6.125
  387   1HD1  ILE  53          HD11      ILE  53  17.870  -2.946   4.169
  388   2HD1  ILE  53          HD12      ILE  53  18.417  -4.143   3.000
  389   3HD1  ILE  53          HD13      ILE  53  17.595  -4.665   4.490
  390    H    SER  54           H        SER  54  23.566  -6.431   3.912
  391    HA   SER  54           HA       SER  54  23.234  -9.043   5.049
  392   1HB   SER  54          HB2       SER  54  24.182  -8.755   2.161
  393   2HB   SER  54          HB3       SER  54  24.625 -10.140   3.171
  394    HG   SER  54           HG       SER  54  21.944  -9.307   2.862
  395    H    SER  55           H        SER  55  25.654  -9.938   5.270
  396    HA   SER  55           HA       SER  55  27.735  -7.893   5.029
  397   1HB   SER  55          HB2       SER  55  26.937  -9.081   7.724
  398   2HB   SER  55          HB3       SER  55  28.416  -8.144   7.424
  399    HG   SER  55           HG       SER  55  26.204  -6.882   6.486
  400    H    THR  56           H        THR  56  27.875  -9.587   3.348
  401    HA   THR  56           HA       THR  56  28.041 -12.297   3.706
  402    HB   THR  56           HB       THR  56  29.210 -12.142   1.408
  403    HG1  THR  56           HG1      THR  56  29.948 -10.376   0.825
  404   1HG2  THR  56          HG21      THR  56  26.761 -12.187   1.607
  405   2HG2  THR  56          HG22      THR  56  26.735 -10.413   1.769
  406   3HG2  THR  56          HG23      THR  56  27.318 -11.175   0.273
  407    H    HIS  57           H        HIS  57  30.602  -9.986   4.390
  408    HA   HIS  57           HA       HIS  57  32.323 -12.225   5.313
  409   1HB   HIS  57          HB2       HIS  57  33.239  -9.818   3.691
  410   2HB   HIS  57          HB3       HIS  57  34.307 -10.954   4.509
  411    HD1  HIS  57           HD1      HIS  57  32.164 -13.427   3.271
  412    HD2  HIS  57           HD2      HIS  57  34.561 -10.532   1.435
  413    HE1  HIS  57           HE1      HIS  57  32.830 -14.402   1.024
  414    H    GLY  58           H        GLY  58  30.496 -10.906   6.932
  415   1HA   GLY  58          HA2       GLY  58  32.356  -9.731   8.890
  416   2HA   GLY  58          HA3       GLY  58  31.092  -8.641   8.307
  417    H    ALA  59           H        ALA  59  28.977 -10.640   8.059
  418    HA   ALA  59           HA       ALA  59  28.636 -11.957  10.627
  419   1HB   ALA  59          HB1       ALA  59  28.012  -9.645  11.257
  420   2HB   ALA  59          HB2       ALA  59  26.859  -9.570   9.909
  421   3HB   ALA  59          HB3       ALA  59  26.596 -10.707  11.246
  422    H    GLY  60           H        GLY  60  28.902 -13.352   8.493
  423   1HA   GLY  60          HA2       GLY  60  26.267 -14.298   7.694
  424   2HA   GLY  60          HA3       GLY  60  27.198 -13.524   6.403
  425    H    ASP  61           H        ASP  61  26.541 -16.097   6.077
  426    HA   ASP  61           HA       ASP  61  28.719 -17.896   6.947
  427   1HB   ASP  61          HB2       ASP  61  26.448 -18.795   6.805
  428   2HB   ASP  61          HB3       ASP  61  26.347 -18.362   5.098
  429    H    ILE  62           H        ILE  62  30.438 -16.716   6.085
  430    HA   ILE  62           HA       ILE  62  30.680 -15.402   3.882
  431    HB   ILE  62           HB       ILE  62  33.030 -15.428   4.004
  432   1HG1  ILE  62          HG12      ILE  62  32.833 -17.989   5.630
  433   2HG1  ILE  62          HG13      ILE  62  33.550 -17.787   4.020
  434   1HG2  ILE  62          HG21      ILE  62  31.588 -14.436   5.879
  435   2HG2  ILE  62          HG22      ILE  62  32.051 -15.840   6.855
  436   3HG2  ILE  62          HG23      ILE  62  33.287 -14.719   6.259
  437   1HD1  ILE  62          HD11      ILE  62  35.240 -16.220   5.033
  438   2HD1  ILE  62          HD12      ILE  62  34.616 -16.674   6.636
  439   3HD1  ILE  62          HD13      ILE  62  35.340 -17.903   5.591
  440    HA   PRO  63           HA       PRO  63  31.972 -18.414   0.609
  441   1HB   PRO  63          HB2       PRO  63  31.325 -21.050   0.587
  442   2HB   PRO  63          HB3       PRO  63  32.732 -20.423   1.500
  443   1HG   PRO  63          HG2       PRO  63  29.934 -20.983   2.559
  444   2HG   PRO  63          HG3       PRO  63  31.498 -21.576   3.213
  445   1HD   PRO  63          HD2       PRO  63  30.293 -19.378   4.214
  446   2HD   PRO  63          HD3       PRO  63  32.063 -19.459   4.044
  447    H    ASP  64           H        ASP  64  28.774 -18.191   1.949
  448    HA   ASP  64           HA       ASP  64  27.540 -18.597  -0.746
  449   1HB   ASP  64          HB2       ASP  64  27.524 -20.802   0.200
  450   2HB   ASP  64          HB3       ASP  64  26.960 -20.199   1.757
  451    H    ASN  65           H        ASN  65  27.017 -17.727   2.626
  452    HA   ASN  65           HA       ASN  65  25.428 -16.748   3.793
  453   1HB   ASN  65          HB2       ASN  65  27.226 -15.115   3.231
  454   2HB   ASN  65          HB3       ASN  65  26.146 -14.435   2.007
  455   1HD2  ASN  65          HD22      ASN  65  25.142 -12.540   2.900
  456   2HD2  ASN  65          HD21      ASN  65  24.587 -12.461   4.559
  457    H    LEU  66           H        LEU  66  24.556 -15.739   0.456
  458    HA   LEU  66           HA       LEU  66  21.752 -15.178   1.281
  459   1HB   LEU  66          HB2       LEU  66  23.436 -14.611  -1.197
  460   2HB   LEU  66          HB3       LEU  66  21.706 -14.626  -1.314
  461    HG   LEU  66           HG       LEU  66  22.478 -12.370  -1.133
  462   1HD1  LEU  66          HD11      LEU  66  20.929 -13.221   1.317
  463   2HD1  LEU  66          HD12      LEU  66  21.171 -11.542   0.800
  464   3HD1  LEU  66          HD13      LEU  66  20.307 -12.672  -0.244
  465   1HD2  LEU  66          HD21      LEU  66  23.637 -11.457   0.762
  466   2HD2  LEU  66          HD22      LEU  66  23.605 -13.027   1.594
  467   3HD2  LEU  66          HD23      LEU  66  24.573 -12.813   0.116
  468    H    SER  67           H        SER  67  21.437 -17.503   1.859
  469    HA   SER  67           HA       SER  67  22.356 -19.511   0.002
  470   1HB   SER  67          HB2       SER  67  20.527 -19.878   2.408
  471   2HB   SER  67          HB3       SER  67  21.485 -21.108   1.571
  472    HG   SER  67           HG       SER  67  23.344 -19.891   2.115
  473    HA   PRO  68           HA       PRO  68  17.804 -20.054  -1.259
  474   1HB   PRO  68          HB2       PRO  68  15.894 -18.224  -0.560
  475   2HB   PRO  68          HB3       PRO  68  16.377 -19.557   0.530
  476   1HG   PRO  68          HG2       PRO  68  17.298 -16.679   0.625
  477   2HG   PRO  68          HG3       PRO  68  16.789 -17.700   1.992
  478   1HD   PRO  68          HD2       PRO  68  19.352 -17.316   1.391
  479   2HD   PRO  68          HD3       PRO  68  18.759 -18.848   2.084
  480    H    PHE  69           H        PHE  69  18.875 -16.718  -0.860
  481    HA   PHE  69           HA       PHE  69  17.604 -15.712  -3.179
  482   1HB   PHE  69          HB2       PHE  69  19.555 -14.712  -1.198
  483   2HB   PHE  69          HB3       PHE  69  19.707 -13.968  -2.789
  484    HD1  PHE  69           HD1      PHE  69  17.488 -14.448   0.141
  485    HD2  PHE  69           HD2      PHE  69  17.946 -12.553  -3.710
  486    HE1  PHE  69           HE1      PHE  69  15.489 -13.066   0.587
  487    HE2  PHE  69           HE2      PHE  69  15.959 -11.143  -3.243
  488    HZ   PHE  69           HZ       PHE  69  14.712 -11.411  -1.115
  489    H    TYR  70           H        TYR  70  21.087 -16.690  -2.758
  490    HA   TYR  70           HA       TYR  70  21.820 -15.994  -5.367
  491   1HB   TYR  70          HB2       TYR  70  23.379 -16.499  -3.490
  492   2HB   TYR  70          HB3       TYR  70  22.985 -18.198  -3.677
  493    HD1  TYR  70           HD1      TYR  70  24.731 -19.394  -4.689
  494    HD2  TYR  70           HD2      TYR  70  23.917 -15.375  -6.042
  495    HE1  TYR  70           HE1      TYR  70  26.550 -19.585  -6.347
  496    HE2  TYR  70           HE2      TYR  70  25.743 -15.559  -7.702
  497    HH   TYR  70           HH       TYR  70  27.718 -18.542  -8.053
  498    H    GLU  71           H        GLU  71  20.655 -19.222  -4.154
  499    HA   GLU  71           HA       GLU  71  20.874 -20.481  -6.685
  500   1HB   GLU  71          HB2       GLU  71  18.976 -21.110  -4.380
  501   2HB   GLU  71          HB3       GLU  71  19.346 -22.165  -5.757
  502   1HG   GLU  71          HG2       GLU  71  21.819 -21.876  -5.024
  503   2HG   GLU  71          HG3       GLU  71  21.190 -21.281  -3.509
  504    H    ALA  72           H        ALA  72  18.015 -18.880  -5.109
  505    HA   ALA  72           HA       ALA  72  16.269 -19.344  -7.309
  506   1HB   ALA  72          HB1       ALA  72  15.490 -18.663  -5.064
  507   2HB   ALA  72          HB2       ALA  72  16.228 -17.058  -5.298
  508   3HB   ALA  72          HB3       ALA  72  14.881 -17.580  -6.333
  509    H    LEU  73           H        LEU  73  18.615 -16.690  -6.772
  510    HA   LEU  73           HA       LEU  73  17.693 -14.946  -8.796
  511   1HB   LEU  73          HB2       LEU  73  20.372 -15.459  -7.455
  512   2HB   LEU  73          HB3       LEU  73  20.292 -14.362  -8.806
  513    HG   LEU  73           HG       LEU  73  18.586 -14.088  -6.295
  514   1HD1  LEU  73          HD11      LEU  73  21.210 -12.738  -7.027
  515   2HD1  LEU  73          HD12      LEU  73  20.162 -12.269  -5.664
  516   3HD1  LEU  73          HD13      LEU  73  20.906 -13.870  -5.694
  517   1HD2  LEU  73          HD21      LEU  73  19.159 -12.086  -8.525
  518   2HD2  LEU  73          HD22      LEU  73  17.608 -12.907  -8.253
  519   3HD2  LEU  73          HD23      LEU  73  18.207 -11.783  -7.050
  520    H    GLN  74           H        GLN  74  20.333 -17.375  -8.947
  521    HA   GLN  74           HA       GLN  74  20.688 -17.035 -11.769
  522   1HB   GLN  74          HB2       GLN  74  21.416 -19.534 -10.196
  523   2HB   GLN  74          HB3       GLN  74  22.099 -18.974 -11.731
  524   1HG   GLN  74          HG2       GLN  74  22.818 -16.861 -10.471
  525   2HG   GLN  74          HG3       GLN  74  22.340 -17.700  -9.003
  526   1HE2  GLN  74          HE21      GLN  74  24.782 -17.279 -11.362
  527   2HE2  GLN  74          HE22      GLN  74  25.942 -18.458 -10.737
  528    H    GLU  75           H        GLU  75  18.379 -18.861  -9.988
  529    HA   GLU  75           HA       GLU  75  17.769 -20.752 -12.030
  530   1HB   GLU  75          HB2       GLU  75  17.212 -21.010  -9.619
  531   2HB   GLU  75          HB3       GLU  75  15.944 -19.796  -9.816
  532   1HG   GLU  75          HG2       GLU  75  14.755 -21.241 -11.401
  533   2HG   GLU  75          HG3       GLU  75  16.078 -22.411 -11.365
  534    H    GLN  76           H        GLN  76  16.549 -17.481 -11.402
  535    HA   GLN  76           HA       GLN  76  14.859 -17.712 -13.862
  536   1HB   GLN  76          HB2       GLN  76  13.350 -16.031 -12.791
  537   2HB   GLN  76          HB3       GLN  76  13.315 -17.654 -12.120
  538   1HG   GLN  76          HG2       GLN  76  14.242 -17.043 -10.110
  539   2HG   GLN  76          HG3       GLN  76  15.157 -15.699 -10.784
  540   1HE2  GLN  76          HE22      GLN  76  14.337 -14.632  -8.765
  541   2HE2  GLN  76          HE21      GLN  76  12.820 -13.756  -8.883
  542    H    LYS  77           H        LYS  77  17.326 -15.785 -12.362
  543    HA   LYS  77           HA       LYS  77  18.048 -13.626 -12.721
  544   1HB   LYS  77          HB2       LYS  77  18.395 -15.016 -15.370
  545   2HB   LYS  77          HB3       LYS  77  19.210 -13.508 -14.921
  546   1HG   LYS  77          HG2       LYS  77  20.220 -14.609 -12.991
  547   2HG   LYS  77          HG3       LYS  77  19.429 -16.134 -13.393
  548   1HD   LYS  77          HD2       LYS  77  21.402 -14.745 -15.235
  549   2HD   LYS  77          HD3       LYS  77  21.857 -15.971 -14.038
  550   1HE   LYS  77          HE2       LYS  77  20.295 -17.560 -15.117
  551   2HE   LYS  77          HE3       LYS  77  19.879 -16.353 -16.337
  552   1HZ   LYS  77          HZ1       LYS  77  22.195 -16.394 -17.072
  553   2HZ   LYS  77          HZ2       LYS  77  22.582 -17.511 -15.940
  554   3HZ   LYS  77          HZ3       LYS  77  21.557 -17.890 -17.146
  555    HA   PRO  78           HA       PRO  78  14.048 -12.222 -14.604
  556   1HB   PRO  78          HB2       PRO  78  13.306 -10.363 -12.653
  557   2HB   PRO  78          HB3       PRO  78  12.863 -12.080 -12.703
  558   1HG   PRO  78          HG2       PRO  78  15.081 -10.738 -11.167
  559   2HG   PRO  78          HG3       PRO  78  13.986 -12.032 -10.605
  560   1HD   PRO  78          HD2       PRO  78  16.550 -12.517 -11.438
  561   2HD   PRO  78          HD3       PRO  78  15.223 -13.678 -11.737
  562    H    ASP  79           H        ASP  79  13.223 -10.109 -15.237
  563    HA   ASP  79           HA       ASP  79  15.399  -8.630 -16.485
  564   1HB   ASP  79          HB2       ASP  79  13.466  -9.361 -17.797
  565   2HB   ASP  79          HB3       ASP  79  12.381  -8.405 -16.782
  566    H    LEU  80           H        LEU  80  16.044  -7.979 -14.251
  567    HA   LEU  80           HA       LEU  80  14.633  -5.922 -12.827
  568   1HB   LEU  80          HB2       LEU  80  17.504  -6.860 -12.817
  569   2HB   LEU  80          HB3       LEU  80  16.977  -5.593 -11.790
  570    HG   LEU  80           HG       LEU  80  16.501  -6.898 -10.168
  571   1HD1  LEU  80          HD11      LEU  80  14.508  -8.358 -11.927
  572   2HD1  LEU  80          HD12      LEU  80  14.657  -8.507 -10.164
  573   3HD1  LEU  80          HD13      LEU  80  14.215  -6.959 -10.858
  574   1HD2  LEU  80          HD21      LEU  80  18.223  -8.377 -11.031
  575   2HD2  LEU  80          HD22      LEU  80  16.961  -9.283 -10.190
  576   3HD2  LEU  80          HD23      LEU  80  17.001  -9.280 -11.965
  577    H    SER  81           H        SER  81  15.606  -5.389 -15.849
  578    HA   SER  81           HA       SER  81  17.428  -3.306 -15.908
  579   1HB   SER  81          HB2       SER  81  15.164  -4.101 -17.794
  580   2HB   SER  81          HB3       SER  81  16.708  -3.359 -18.194
  581    HG   SER  81           HG       SER  81  16.069  -5.928 -18.020
  582    H    ALA  82           H        ALA  82  14.411  -3.269 -14.523
  583    HA   ALA  82           HA       ALA  82  13.951  -0.375 -15.087
  584   1HB   ALA  82          HB1       ALA  82  11.849  -2.517 -14.567
  585   2HB   ALA  82          HB2       ALA  82  11.545  -0.784 -14.795
  586   3HB   ALA  82          HB3       ALA  82  12.187  -1.750 -16.136
  587    H    VAL  83           H        VAL  83  15.283  -2.361 -12.846
  588    HA   VAL  83           HA       VAL  83  14.370  -0.538 -10.684
  589    HB   VAL  83           HB       VAL  83  13.244  -2.502 -10.167
  590   1HG1  VAL  83          HG11      VAL  83  14.313  -4.137 -11.619
  591   2HG1  VAL  83          HG12      VAL  83  15.770  -4.115 -10.606
  592   3HG1  VAL  83          HG13      VAL  83  14.240  -4.754  -9.966
  593   1HG2  VAL  83          HG21      VAL  83  14.618  -1.604  -8.202
  594   2HG2  VAL  83          HG22      VAL  83  14.014  -3.248  -8.102
  595   3HG2  VAL  83          HG23      VAL  83  15.719  -2.955  -8.480
  596    H    ARG  84           H        ARG  84  15.920  -0.078  -9.018
  597    HA   ARG  84           HA       ARG  84  18.716  -0.592  -9.900
  598   1HB   ARG  84          HB2       ARG  84  19.463   1.326  -9.112
  599   2HB   ARG  84          HB3       ARG  84  17.895   1.853  -9.672
  600   1HG   ARG  84          HG2       ARG  84  18.233   2.985  -7.674
  601   2HG   ARG  84          HG3       ARG  84  17.151   1.667  -7.201
  602   1HD   ARG  84          HD2       ARG  84  18.865   0.553  -5.999
  603   2HD   ARG  84          HD3       ARG  84  20.132   1.287  -7.002
  604    HE   ARG  84           HE       ARG  84  18.753   3.218  -5.355
  605   1HH1  ARG  84          HH11      ARG  84  21.418   0.855  -5.418
  606   2HH1  ARG  84          HH12      ARG  84  22.483   1.877  -4.507
  607   1HH2  ARG  84          HH21      ARG  84  20.044   4.319  -3.757
  608   2HH2  ARG  84          HH22      ARG  84  21.579   3.682  -3.307
  609    H    PHE  85           H        PHE  85  20.112  -1.397  -8.425
  610    HA   PHE  85           HA       PHE  85  18.936  -2.904  -6.116
  611   1HB   PHE  85          HB2       PHE  85  19.819  -4.483  -7.611
  612   2HB   PHE  85          HB3       PHE  85  21.104  -3.421  -8.159
  613    HD1  PHE  85           HD1      PHE  85  20.020  -5.336  -5.096
  614    HD2  PHE  85           HD2      PHE  85  23.286  -3.715  -7.408
  615    HE1  PHE  85           HE1      PHE  85  21.656  -6.496  -3.630
  616    HE2  PHE  85           HE2      PHE  85  24.905  -4.870  -5.931
  617    HZ   PHE  85           HZ       PHE  85  24.085  -6.291  -4.054
  618    H    GLY  86           H        GLY  86  20.201  -2.716  -4.130
  619   1HA   GLY  86          HA2       GLY  86  22.644  -1.052  -4.239
  620   2HA   GLY  86          HA3       GLY  86  21.359  -0.541  -3.144
  621    H    ALA  87           H        ALA  87  24.110  -2.370  -3.456
  622    HA   ALA  87           HA       ALA  87  23.621  -4.513  -1.548
  623   1HB   ALA  87          HB1       ALA  87  26.143  -3.128  -2.618
  624   2HB   ALA  87          HB2       ALA  87  26.163  -4.521  -1.524
  625   3HB   ALA  87          HB3       ALA  87  25.490  -4.685  -3.153
  626    H    ILE  88           H        ILE  88  23.636  -4.254   0.680
  627    HA   ILE  88           HA       ILE  88  24.655  -1.717   1.836
  628    HB   ILE  88           HB       ILE  88  22.134  -3.245   2.575
  629   1HG1  ILE  88          HG12      ILE  88  22.559  -0.684   1.038
  630   2HG1  ILE  88          HG13      ILE  88  21.603  -2.093   0.621
  631   1HG2  ILE  88          HG21      ILE  88  21.785  -1.537   4.268
  632   2HG2  ILE  88          HG22      ILE  88  23.294  -2.357   4.547
  633   3HG2  ILE  88          HG23      ILE  88  23.303  -0.727   3.828
  634   1HD1  ILE  88          HD11      ILE  88  20.913  -0.051   2.763
  635   2HD1  ILE  88          HD12      ILE  88  20.170  -0.232   1.182
  636   3HD1  ILE  88          HD13      ILE  88  19.966  -1.519   2.398
  637    H    GLY  89           H        GLY  89  26.375  -2.230   3.025
  638   1HA   GLY  89          HA2       GLY  89  27.556  -3.128   4.801
  639   2HA   GLY  89          HA3       GLY  89  26.206  -4.223   5.130
  640    H    ILE  90           H        ILE  90  26.630  -4.964   2.075
  641    HA   ILE  90           HA       ILE  90  27.825  -7.453   2.410
  642    HB   ILE  90           HB       ILE  90  27.628  -5.774  -0.115
  643   1HG1  ILE  90          HG12      ILE  90  25.598  -7.399   1.399
  644   2HG1  ILE  90          HG13      ILE  90  25.449  -5.768   0.772
  645   1HG2  ILE  90          HG21      ILE  90  27.598  -7.830  -1.357
  646   2HG2  ILE  90          HG22      ILE  90  29.028  -7.867  -0.332
  647   3HG2  ILE  90          HG23      ILE  90  27.588  -8.795   0.125
  648   1HD1  ILE  90          HD11      ILE  90  24.001  -7.154  -0.506
  649   2HD1  ILE  90          HD12      ILE  90  25.366  -6.755  -1.567
  650   3HD1  ILE  90          HD13      ILE  90  25.264  -8.356  -0.802
  651    H    GLY  91           H        GLY  91  29.929  -8.206   2.394
  652   1HA   GLY  91          HA2       GLY  91  32.014  -6.097   2.622
  653   2HA   GLY  91          HA3       GLY  91  32.072  -7.719   3.311
  654    H    SER  92           H        SER  92  31.406  -9.208   1.063
  655    HA   SER  92           HA       SER  92  33.676  -9.568  -0.525
  656   1HB   SER  92          HB2       SER  92  30.882 -10.030  -1.559
  657   2HB   SER  92          HB3       SER  92  32.329 -11.022  -1.791
  658    HG   SER  92           HG       SER  92  32.186 -11.651   0.369
  659    H    ARG  93           H        ARG  93  30.951  -7.359  -0.937
  660    HA   ARG  93           HA       ARG  93  31.439  -6.631  -3.625
  661   1HB   ARG  93          HB2       ARG  93  29.280  -6.293  -2.456
  662   2HB   ARG  93          HB3       ARG  93  30.042  -5.184  -1.327
  663   1HG   ARG  93          HG2       ARG  93  28.691  -4.032  -3.020
  664   2HG   ARG  93          HG3       ARG  93  30.381  -3.545  -3.021
  665   1HD   ARG  93          HD2       ARG  93  30.753  -5.064  -5.026
  666   2HD   ARG  93          HD3       ARG  93  29.015  -5.367  -5.033
  667    HE   ARG  93           HE       ARG  93  28.655  -3.294  -5.952
  668   1HH1  ARG  93          HH11      ARG  93  31.993  -3.277  -4.664
  669   2HH1  ARG  93          HH12      ARG  93  32.384  -1.763  -5.395
  670   1HH2  ARG  93          HH22      ARG  93  29.168  -1.306  -6.828
  671   2HH2  ARG  93          HH21      ARG  93  30.754  -0.614  -6.673
  672    H    GLU  94           H        GLU  94  33.073  -5.640  -0.673
  673    HA   GLU  94           HA       GLU  94  33.992  -3.160  -2.013
  674   1HB   GLU  94          HB2       GLU  94  33.914  -3.858   0.911
  675   2HB   GLU  94          HB3       GLU  94  34.465  -2.324   0.229
  676   1HG   GLU  94          HG2       GLU  94  31.630  -3.395  -0.092
  677   2HG   GLU  94          HG3       GLU  94  32.146  -2.312   1.189
  678    H    TYR  95           H        TYR  95  35.485  -5.237   0.433
  679    HA   TYR  95           HA       TYR  95  37.968  -5.365  -1.178
  680   1HB   TYR  95          HB2       TYR  95  39.329  -4.121   0.332
  681   2HB   TYR  95          HB3       TYR  95  37.977  -3.099  -0.103
  682    HD1  TYR  95           HD1      TYR  95  36.194  -2.583   1.579
  683    HD2  TYR  95           HD2      TYR  95  39.674  -4.903   2.623
  684    HE1  TYR  95           HE1      TYR  95  35.630  -2.328   3.971
  685    HE2  TYR  95           HE2      TYR  95  39.142  -4.622   5.025
  686    HH   TYR  95           HH       TYR  95  36.190  -2.885   6.126
  687    H    ASP  96           H        ASP  96  36.162  -6.456   1.697
  688    HA   ASP  96           HA       ASP  96  38.504  -7.877   2.697
  689   1HB   ASP  96          HB2       ASP  96  36.880  -6.658   4.174
  690   2HB   ASP  96          HB3       ASP  96  35.687  -7.911   3.819
  691    H    THR  97           H        THR  97  37.754  -8.765   0.137
  692    HA   THR  97           HA       THR  97  36.007 -10.938  -0.082
  693    HB   THR  97           HB       THR  97  37.678 -11.485  -2.031
  694    HG1  THR  97           HG1      THR  97  39.404 -10.201  -1.330
  695   1HG2  THR  97          HG21      THR  97  35.471 -10.437  -2.298
  696   2HG2  THR  97          HG22      THR  97  36.144  -8.840  -1.881
  697   3HG2  THR  97          HG23      THR  97  36.659  -9.681  -3.364
  698    H    PHE  98           H        PHE  98  35.986 -12.848   0.864
  699    HA   PHE  98           HA       PHE  98  38.198 -14.050   2.242
  700   1HB   PHE  98          HB2       PHE  98  35.832 -14.523   2.749
  701   2HB   PHE  98          HB3       PHE  98  35.586 -15.157   1.127
  702    HD1  PHE  98           HD1      PHE  98  35.314 -17.476   1.091
  703    HD2  PHE  98           HD2      PHE  98  38.083 -15.754   3.925
  704    HE1  PHE  98           HE1      PHE  98  35.944 -19.744   1.858
  705    HE2  PHE  98           HE2      PHE  98  38.714 -18.030   4.678
  706    HZ   PHE  98           HZ       PHE  98  37.651 -20.028   3.646
  707    H    CYS  99           H        CYS  99  39.104 -16.215   1.550
  708    HA   CYS  99           HA       CYS  99  40.206 -16.225  -1.121
  709   1HB   CYS  99          HB2       CYS  99  40.261 -18.347   1.077
  710   2HB   CYS  99          HB3       CYS  99  41.334 -18.256  -0.328
  711    HG   CYS  99           HG       CYS  99  42.387 -15.928   0.252
  712    H    GLY 100           H        GLY 100  37.424 -16.218  -1.338
  713   1HA   GLY 100          HA2       GLY 100  36.534 -18.180  -3.037
  714   2HA   GLY 100          HA3       GLY 100  36.214 -18.848  -1.415
  715    H    ALA 101           H        ALA 101  36.196 -15.465  -2.651
  716    HA   ALA 101           HA       ALA 101  34.161 -14.653  -0.885
  717   1HB   ALA 101          HB1       ALA 101  35.860 -13.143  -1.860
  718   2HB   ALA 101          HB2       ALA 101  35.115 -13.334  -3.466
  719   3HB   ALA 101          HB3       ALA 101  34.219 -12.542  -2.151
  720    H    ILE 102           H        ILE 102  32.058 -13.738  -1.405
  721    HA   ILE 102           HA       ILE 102  30.638 -15.353  -3.444
  722    HB   ILE 102           HB       ILE 102  30.255 -16.000  -1.133
  723   1HG1  ILE 102          HG12      ILE 102  27.907 -16.135  -1.056
  724   2HG1  ILE 102          HG13      ILE 102  27.664 -14.772  -2.124
  725   1HG2  ILE 102          HG21      ILE 102  29.011 -14.582   0.448
  726   2HG2  ILE 102          HG22      ILE 102  30.573 -13.876   0.048
  727   3HG2  ILE 102          HG23      ILE 102  29.099 -13.222  -0.693
  728   1HD1  ILE 102          HD11      ILE 102  28.964 -17.411  -2.938
  729   2HD1  ILE 102          HD12      ILE 102  27.267 -16.971  -3.218
  730   3HD1  ILE 102          HD13      ILE 102  28.552 -16.061  -4.026
  731    H    ASP 103           H        ASP 103  31.965 -12.674  -3.761
  732    HA   ASP 103           HA       ASP 103  30.047 -10.620  -4.012
  733   1HB   ASP 103          HB2       ASP 103  31.662  -9.403  -5.120
  734   2HB   ASP 103          HB3       ASP 103  32.634 -10.494  -4.144
  735    H    LYS 104           H        LYS 104  30.410 -13.489  -5.851
  736    HA   LYS 104           HA       LYS 104  29.280 -12.770  -8.344
  737   1HB   LYS 104          HB2       LYS 104  28.969 -15.361  -6.777
  738   2HB   LYS 104          HB3       LYS 104  28.557 -15.125  -8.477
  739   1HG   LYS 104          HG2       LYS 104  30.957 -14.536  -8.892
  740   2HG   LYS 104          HG3       LYS 104  31.324 -14.913  -7.210
  741   1HD   LYS 104          HD2       LYS 104  31.939 -16.837  -8.496
  742   2HD   LYS 104          HD3       LYS 104  30.505 -17.241  -7.562
  743   1HE   LYS 104          HE2       LYS 104  30.239 -18.184  -9.745
  744   2HE   LYS 104          HE3       LYS 104  29.090 -16.856  -9.600
  745   1HZ   LYS 104          HZ1       LYS 104  30.243 -16.842 -11.730
  746   2HZ   LYS 104          HZ2       LYS 104  30.630 -15.488 -10.912
  747   3HZ   LYS 104          HZ3       LYS 104  31.697 -16.724 -11.014
  748    H    LEU 105           H        LEU 105  27.795 -12.954  -5.139
  749    HA   LEU 105           HA       LEU 105  25.102 -13.374  -5.952
  750   1HB   LEU 105          HB2       LEU 105  25.884 -13.629  -3.664
  751   2HB   LEU 105          HB3       LEU 105  26.326 -11.941  -3.561
  752    HG   LEU 105           HG       LEU 105  24.311 -12.542  -2.343
  753   1HD1  LEU 105          HD11      LEU 105  23.478 -10.604  -4.517
  754   2HD1  LEU 105          HD12      LEU 105  22.947 -10.664  -2.837
  755   3HD1  LEU 105          HD13      LEU 105  24.615 -10.196  -3.208
  756   1HD2  LEU 105          HD21      LEU 105  23.400 -14.251  -3.853
  757   2HD2  LEU 105          HD22      LEU 105  22.181 -13.020  -3.485
  758   3HD2  LEU 105          HD23      LEU 105  23.007 -12.998  -5.053
  759    H    GLU 106           H        GLU 106  26.715 -10.203  -5.048
  760    HA   GLU 106           HA       GLU 106  24.756  -8.569  -6.173
  761   1HB   GLU 106          HB2       GLU 106  27.677  -7.845  -6.387
  762   2HB   GLU 106          HB3       GLU 106  26.264  -6.821  -6.212
  763   1HG   GLU 106          HG2       GLU 106  26.987  -6.801  -4.097
  764   2HG   GLU 106          HG3       GLU 106  25.880  -8.128  -3.946
  765    H    ALA 107           H        ALA 107  27.505 -10.193  -7.760
  766    HA   ALA 107           HA       ALA 107  27.448  -8.757 -10.189
  767   1HB   ALA 107          HB1       ALA 107  28.262 -11.673  -9.906
  768   2HB   ALA 107          HB2       ALA 107  28.791 -10.516 -11.130
  769   3HB   ALA 107          HB3       ALA 107  29.306 -10.298  -9.445
  770    H    GLU 108           H        GLU 108  25.726 -11.846  -9.287
  771    HA   GLU 108           HA       GLU 108  24.543 -12.200 -11.865
  772   1HB   GLU 108          HB2       GLU 108  23.853 -13.183  -9.095
  773   2HB   GLU 108          HB3       GLU 108  22.941 -13.635 -10.523
  774   1HG   GLU 108          HG2       GLU 108  25.895 -14.221 -10.083
  775   2HG   GLU 108          HG3       GLU 108  24.556 -15.347  -9.899
  776    H    LEU 109           H        LEU 109  23.479 -10.345  -8.982
  777    HA   LEU 109           HA       LEU 109  20.839  -9.753  -9.960
  778   1HB   LEU 109          HB2       LEU 109  22.756  -8.516  -7.965
  779   2HB   LEU 109          HB3       LEU 109  21.348  -7.588  -8.449
  780    HG   LEU 109           HG       LEU 109  21.093 -10.445  -7.465
  781   1HD1  LEU 109          HD11      LEU 109  20.894  -7.937  -5.761
  782   2HD1  LEU 109          HD12      LEU 109  20.661  -9.613  -5.223
  783   3HD1  LEU 109          HD13      LEU 109  22.265  -9.063  -5.736
  784   1HD2  LEU 109          HD21      LEU 109  19.094  -9.533  -8.584
  785   2HD2  LEU 109          HD22      LEU 109  18.795  -9.603  -6.839
  786   3HD2  LEU 109          HD23      LEU 109  19.182  -8.055  -7.602
  787    H    LYS 110           H        LYS 110  23.964  -8.006 -10.277
  788    HA   LYS 110           HA       LYS 110  22.831  -5.850 -11.773
  789   1HB   LYS 110          HB2       LYS 110  25.696  -6.840 -11.444
  790   2HB   LYS 110          HB3       LYS 110  25.248  -5.295 -12.189
  791   1HG   LYS 110          HG2       LYS 110  24.242  -4.499 -10.121
  792   2HG   LYS 110          HG3       LYS 110  24.391  -6.051  -9.350
  793   1HD   LYS 110          HD2       LYS 110  26.100  -4.759  -8.412
  794   2HD   LYS 110          HD3       LYS 110  26.900  -5.883  -9.510
  795   1HE   LYS 110          HE2       LYS 110  27.166  -4.155 -11.211
  796   2HE   LYS 110          HE3       LYS 110  26.143  -3.035 -10.308
  797   1HZ   LYS 110          HZ1       LYS 110  27.826  -2.959  -8.572
  798   2HZ   LYS 110          HZ2       LYS 110  28.782  -4.021  -9.391
  799   3HZ   LYS 110          HZ3       LYS 110  28.490  -2.544 -10.010
  800    H    ASN 111           H        ASN 111  24.315  -8.935 -12.690
  801    HA   ASN 111           HA       ASN 111  24.333  -8.555 -15.530
  802   1HB   ASN 111          HB2       ASN 111  25.610 -10.348 -15.033
  803   2HB   ASN 111          HB3       ASN 111  24.778 -10.707 -13.557
  804   1HD2  ASN 111          HD21      ASN 111  22.874 -11.994 -13.482
  805   2HD2  ASN 111          HD22      ASN 111  22.705 -13.229 -14.693
  806    H    SER 112           H        SER 112  21.850  -9.670 -13.212
  807    HA   SER 112           HA       SER 112  20.024 -10.603 -15.195
  808   1HB   SER 112          HB2       SER 112  19.495  -9.675 -12.374
  809   2HB   SER 112          HB3       SER 112  18.358 -10.560 -13.402
  810    HG   SER 112           HG       SER 112  20.846 -11.437 -12.378
  811    H    GLY 113           H        GLY 113  20.565  -7.371 -13.726
  812   1HA   GLY 113          HA2       GLY 113  20.041  -5.969 -15.967
  813   2HA   GLY 113          HA3       GLY 113  18.408  -6.173 -15.333
  814    H    ALA 114           H        ALA 114  19.585  -5.950 -12.415
  815    HA   ALA 114           HA       ALA 114  18.746  -3.239 -12.313
  816   1HB   ALA 114          HB1       ALA 114  20.007  -4.967 -10.140
  817   2HB   ALA 114          HB2       ALA 114  19.279  -3.361  -9.897
  818   3HB   ALA 114          HB3       ALA 114  18.263  -4.688 -10.405
  819    H    LYS 115           H        LYS 115  19.862  -1.320 -11.924
  820    HA   LYS 115           HA       LYS 115  22.802  -1.367 -12.363
  821   1HB   LYS 115          HB2       LYS 115  22.620   1.081 -12.442
  822   2HB   LYS 115          HB3       LYS 115  21.579   0.308 -13.637
  823   1HG   LYS 115          HG2       LYS 115  19.598   0.693 -12.186
  824   2HG   LYS 115          HG3       LYS 115  20.651   1.421 -10.962
  825   1HD   LYS 115          HD2       LYS 115  21.291   3.203 -12.558
  826   2HD   LYS 115          HD3       LYS 115  20.211   2.487 -13.777
  827   1HE   LYS 115          HE2       LYS 115  18.278   2.807 -12.250
  828   2HE   LYS 115          HE3       LYS 115  19.346   3.500 -11.024
  829   1HZ   LYS 115          HZ1       LYS 115  18.842   4.671 -13.702
  830   2HZ   LYS 115          HZ2       LYS 115  18.224   5.217 -12.299
  831   3HZ   LYS 115          HZ3       LYS 115  19.828   5.314 -12.567
  832    H    GLN 116           H        GLN 116  24.243  -0.637 -10.673
  833    HA   GLN 116           HA       GLN 116  23.043  -0.648  -7.954
  834   1HB   GLN 116          HB2       GLN 116  24.977  -2.160  -8.377
  835   2HB   GLN 116          HB3       GLN 116  25.965  -0.728  -8.705
  836   1HG   GLN 116          HG2       GLN 116  25.317   0.126  -6.389
  837   2HG   GLN 116          HG3       GLN 116  24.518  -1.422  -6.104
  838   1HE2  GLN 116          HE22      GLN 116  26.404  -0.655  -4.335
  839   2HE2  GLN 116          HE21      GLN 116  27.885  -1.544  -4.493
  840    H    THR 117           H        THR 117  22.145   1.417  -7.729
  841    HA   THR 117           HA       THR 117  23.508   3.732  -8.879
  842    HB   THR 117           HB       THR 117  21.118   3.604  -6.996
  843    HG1  THR 117           HG1      THR 117  21.356   3.631  -9.815
  844   1HG2  THR 117          HG21      THR 117  20.544   5.802  -8.002
  845   2HG2  THR 117          HG22      THR 117  22.027   5.848  -7.027
  846   3HG2  THR 117          HG23      THR 117  22.131   5.830  -8.802
  847    H    GLY 118           H        GLY 118  24.471   5.470  -7.723
  848   1HA   GLY 118          HA2       GLY 118  25.656   6.519  -6.071
  849   2HA   GLY 118          HA3       GLY 118  24.782   5.543  -4.880
  850    H    GLU 119           H        GLU 119  25.980   4.135  -3.778
  851    HA   GLU 119           HA       GLU 119  27.973   2.482  -5.072
  852   1HB   GLU 119          HB2       GLU 119  29.790   2.887  -3.525
  853   2HB   GLU 119          HB3       GLU 119  29.411   4.388  -4.356
  854   1HG   GLU 119          HG2       GLU 119  28.356   5.340  -2.443
  855   2HG   GLU 119          HG3       GLU 119  28.296   3.781  -1.628
  856    H    THR 120           H        THR 120  28.837   0.901  -3.197
  857    HA   THR 120           HA       THR 120  26.741  -0.479  -1.939
  858    HB   THR 120           HB       THR 120  29.638  -0.256  -1.074
  859    HG1  THR 120           HG1      THR 120  30.227  -1.456  -2.647
  860   1HG2  THR 120          HG21      THR 120  29.369  -2.689  -0.554
  861   2HG2  THR 120          HG22      THR 120  28.327  -1.644   0.422
  862   3HG2  THR 120          HG23      THR 120  27.642  -2.549  -0.939
  863    H    LEU 121           H        LEU 121  25.566   0.041  -0.181
  864    HA   LEU 121           HA       LEU 121  26.209   2.449   1.394
  865   1HB   LEU 121          HB2       LEU 121  23.859   1.326   0.519
  866   2HB   LEU 121          HB3       LEU 121  23.956   0.636   2.140
  867    HG   LEU 121           HG       LEU 121  24.165   3.586   1.489
  868   1HD1  LEU 121          HD11      LEU 121  21.883   3.856   2.143
  869   2HD1  LEU 121          HD12      LEU 121  21.984   2.694   0.814
  870   3HD1  LEU 121          HD13      LEU 121  21.721   2.103   2.472
  871   1HD2  LEU 121          HD21      LEU 121  25.101   3.249   3.676
  872   2HD2  LEU 121          HD22      LEU 121  23.463   3.817   3.945
  873   3HD2  LEU 121          HD23      LEU 121  23.819   2.086   4.121
  874    H    LYS 122           H        LYS 122  26.587   2.208   3.756
  875    HA   LYS 122           HA       LYS 122  27.360  -0.512   4.645
  876   1HB   LYS 122          HB2       LYS 122  29.121   1.940   4.575
  877   2HB   LYS 122          HB3       LYS 122  29.465   0.586   5.605
  878   1HG   LYS 122          HG2       LYS 122  29.762  -0.907   3.779
  879   2HG   LYS 122          HG3       LYS 122  29.173   0.240   2.585
  880   1HD   LYS 122          HD2       LYS 122  31.669   0.764   4.225
  881   2HD   LYS 122          HD3       LYS 122  31.712  -0.145   2.719
  882   1HE   LYS 122          HE2       LYS 122  30.608   2.687   2.953
  883   2HE   LYS 122          HE3       LYS 122  32.278   2.307   2.517
  884   1HZ   LYS 122          HZ1       LYS 122  31.433   1.078   0.583
  885   2HZ   LYS 122          HZ2       LYS 122  29.890   1.551   0.934
  886   3HZ   LYS 122          HZ3       LYS 122  30.982   2.662   0.522
  887    H    ILE 123           H        ILE 123  27.026  -0.799   6.710
  888    HA   ILE 123           HA       ILE 123  26.074   1.276   8.571
  889    HB   ILE 123           HB       ILE 123  24.186  -0.544   8.990
  890   1HG1  ILE 123          HG12      ILE 123  23.257  -1.468   6.897
  891   2HG1  ILE 123          HG13      ILE 123  24.682  -1.047   6.012
  892   1HG2  ILE 123          HG21      ILE 123  23.747   1.759   8.406
  893   2HG2  ILE 123          HG22      ILE 123  23.958   1.392   6.671
  894   3HG2  ILE 123          HG23      ILE 123  22.624   0.676   7.604
  895   1HD1  ILE 123          HD11      ILE 123  24.678  -2.950   8.400
  896   2HD1  ILE 123          HD12      ILE 123  24.421  -3.470   6.724
  897   3HD1  ILE 123          HD13      ILE 123  25.961  -2.741   7.174
  898    H    ASN 124           H        ASN 124  25.911   0.383  10.793
  899    HA   ASN 124           HA       ASN 124  26.611  -2.327  11.274
  900   1HB   ASN 124          HB2       ASN 124  28.926  -0.968  10.969
  901   2HB   ASN 124          HB3       ASN 124  28.598  -0.503  12.636
  902   1HD2  ASN 124          HD22      ASN 124  28.947  -3.262  10.391
  903   2HD2  ASN 124          HD21      ASN 124  29.371  -4.451  11.603
  904    H    ILE 125           H        ILE 125  27.009  -2.453  13.881
  905    HA   ILE 125           HA       ILE 125  25.011  -0.684  15.200
  906    HB   ILE 125           HB       ILE 125  24.179  -2.613  16.437
  907   1HG1  ILE 125          HG12      ILE 125  25.913  -4.357  14.622
  908   2HG1  ILE 125          HG13      ILE 125  26.238  -4.031  16.325
  909   1HG2  ILE 125          HG21      ILE 125  24.000  -3.150  13.441
  910   2HG2  ILE 125          HG22      ILE 125  22.806  -3.550  14.688
  911   3HG2  ILE 125          HG23      ILE 125  23.119  -1.860  14.287
  912   1HD1  ILE 125          HD11      ILE 125  23.844  -5.541  15.211
  913   2HD1  ILE 125          HD12      ILE 125  25.197  -6.189  16.147
  914   3HD1  ILE 125          HD13      ILE 125  24.044  -5.084  16.921
  915    H    LEU 126           H        LEU 126  28.208  -1.374  15.059
  916    HA   LEU 126           HA       LEU 126  28.673  -0.451  17.792
  917   1HB   LEU 126          HB2       LEU 126  28.833  -3.003  17.676
  918   2HB   LEU 126          HB3       LEU 126  30.162  -2.820  16.553
  919    HG   LEU 126           HG       LEU 126  30.724  -3.392  18.911
  920   1HD1  LEU 126          HD11      LEU 126  32.077  -0.775  18.207
  921   2HD1  LEU 126          HD12      LEU 126  32.704  -2.140  19.127
  922   3HD1  LEU 126          HD13      LEU 126  32.406  -2.318  17.393
  923   1HD2  LEU 126          HD21      LEU 126  29.048  -1.949  20.037
  924   2HD2  LEU 126          HD22      LEU 126  30.682  -1.774  20.692
  925   3HD2  LEU 126          HD23      LEU 126  30.023  -0.520  19.630
  926    H    ASP 127           H        ASP 127  30.545   0.905  17.787
  927    HA   ASP 127           HA       ASP 127  30.905   2.428  15.499
  928   1HB   ASP 127          HB2       ASP 127  31.369   3.278  17.712
  929   2HB   ASP 127          HB3       ASP 127  32.693   2.127  17.932
  930    H    HIS 128           H        HIS 128  32.107   2.375  13.792
  931    HA   HIS 128           HA       HIS 128  33.238   1.508  12.068
  932   1HB   HIS 128          HB2       HIS 128  34.469   3.370  13.135
  933   2HB   HIS 128          HB3       HIS 128  35.501   2.197  13.956
  934    HD1  HIS 128           HD1      HIS 128  34.485   3.099  10.294
  935    HD2  HIS 128           HD2      HIS 128  37.621   1.434  12.580
  936    HE1  HIS 128           HE1      HIS 128  36.413   2.671   8.678
  937    H    ASP 129           H        ASP 129  32.928  -0.572  11.553
  938    HA   ASP 129           HA       ASP 129  35.106  -2.423  12.184
  939   1HB   ASP 129          HB2       ASP 129  32.167  -3.187  12.179
  940   2HB   ASP 129          HB3       ASP 129  33.452  -4.352  12.010
  941    H    ILE 130           H        ILE 130  34.001  -4.382  10.380
  942    HA   ILE 130           HA       ILE 130  35.511  -3.781   8.190
  943    HB   ILE 130           HB       ILE 130  33.202  -5.708   8.505
  944   1HG1  ILE 130          HG12      ILE 130  35.115  -6.168   9.936
  945   2HG1  ILE 130          HG13      ILE 130  34.892  -7.413   8.726
  946   1HG2  ILE 130          HG21      ILE 130  35.059  -5.514   6.110
  947   2HG2  ILE 130          HG22      ILE 130  34.068  -6.935   6.511
  948   3HG2  ILE 130          HG23      ILE 130  33.285  -5.402   6.133
  949   1HD1  ILE 130          HD11      ILE 130  36.785  -6.447   7.392
  950   2HD1  ILE 130          HD12      ILE 130  37.039  -5.244   8.680
  951   3HD1  ILE 130          HD13      ILE 130  37.256  -6.964   9.018
  952    HA   PRO 131           HA       PRO 131  32.052  -2.031   5.488
  953   1HB   PRO 131          HB2       PRO 131  29.542  -1.470   6.416
  954   2HB   PRO 131          HB3       PRO 131  30.044  -3.084   5.858
  955   1HG   PRO 131          HG2       PRO 131  29.968  -2.060   8.714
  956   2HG   PRO 131          HG3       PRO 131  29.264  -3.575   8.058
  957   1HD   PRO 131          HD2       PRO 131  31.684  -3.508   9.281
  958   2HD   PRO 131          HD3       PRO 131  31.378  -4.576   7.878
  959    H    GLU 132           H        GLU 132  30.289  -0.227   7.947
  960    HA   GLU 132           HA       GLU 132  32.303   1.483   8.870
  961   1HB   GLU 132          HB2       GLU 132  31.208   2.287   6.289
  962   2HB   GLU 132          HB3       GLU 132  30.591   3.393   7.503
  963   1HG   GLU 132          HG2       GLU 132  33.546   2.730   7.141
  964   2HG   GLU 132          HG3       GLU 132  32.723   4.098   6.404
  965    H    ASP 133           H        ASP 133  31.238   3.098  10.363
  966    HA   ASP 133           HA       ASP 133  28.762   1.952  11.475
  967   1HB   ASP 133          HB2       ASP 133  30.389   2.565  13.062
  968   2HB   ASP 133          HB3       ASP 133  30.549   4.196  12.423
  969    HA   PRO 134           HA       PRO 134  26.791   6.121  10.427
  970   1HB   PRO 134          HB2       PRO 134  27.911   7.970   8.747
  971   2HB   PRO 134          HB3       PRO 134  28.289   7.885  10.495
  972   1HG   PRO 134          HG2       PRO 134  29.867   6.698   8.188
  973   2HG   PRO 134          HG3       PRO 134  30.476   7.690   9.554
  974   1HD   PRO 134          HD2       PRO 134  30.605   4.979   9.569
  975   2HD   PRO 134          HD3       PRO 134  30.274   5.901  11.066
  976    H    ALA 135           H        ALA 135  25.256   6.508   8.811
  977    HA   ALA 135           HA       ALA 135  25.654   5.312   6.110
  978   1HB   ALA 135          HB1       ALA 135  23.555   4.074   6.357
  979   2HB   ALA 135          HB2       ALA 135  24.723   3.604   7.608
  980   3HB   ALA 135          HB3       ALA 135  23.362   4.675   8.018
  981    H    GLU 136           H        GLU 136  24.069   7.710   8.173
  982    HA   GLU 136           HA       GLU 136  21.968   8.421   6.446
  983   1HB   GLU 136          HB2       GLU 136  21.810  10.464   7.735
  984   2HB   GLU 136          HB3       GLU 136  22.085   9.081   8.794
  985   1HG   GLU 136          HG2       GLU 136  24.509   9.710   8.946
  986   2HG   GLU 136          HG3       GLU 136  24.190  11.122   7.937
  987    H    GLU 137           H        GLU 137  25.394   9.169   6.210
  988    HA   GLU 137           HA       GLU 137  25.223  11.399   4.431
  989   1HB   GLU 137          HB2       GLU 137  27.340   9.229   4.782
  990   2HB   GLU 137          HB3       GLU 137  27.559  10.657   3.774
  991   1HG   GLU 137          HG2       GLU 137  27.023  10.720   6.779
  992   2HG   GLU 137          HG3       GLU 137  28.607  10.837   6.030
  993    H    TRP 138           H        TRP 138  25.231   7.846   3.843
  994    HA   TRP 138           HA       TRP 138  25.313   8.000   0.977
  995   1HB   TRP 138          HB2       TRP 138  24.455   5.865   2.932
  996   2HB   TRP 138          HB3       TRP 138  24.182   5.730   1.204
  997    HD1  TRP 138           HD1      TRP 138  26.001   4.781  -0.227
  998    HE1  TRP 138           HE1      TRP 138  28.422   4.084   0.053
  999    HE3  TRP 138           HE3      TRP 138  26.795   6.611   4.496
 1000    HZ2  TRP 138           HZ2      TRP 138  30.582   4.633   1.955
 1001    HZ3  TRP 138           HZ3      TRP 138  29.042   6.488   5.522
 1002    HH2  TRP 138           HH2      TRP 138  30.950   5.518   4.256
 1003    H    LEU 139           H        LEU 139  22.649   7.611   3.364
 1004    HA   LEU 139           HA       LEU 139  20.555   7.484   1.472
 1005   1HB   LEU 139          HB2       LEU 139  20.670   8.457   4.369
 1006   2HB   LEU 139          HB3       LEU 139  19.191   8.307   3.454
 1007    HG   LEU 139           HG       LEU 139  21.063   6.027   4.231
 1008   1HD1  LEU 139          HD11      LEU 139  19.110   5.313   5.590
 1009   2HD1  LEU 139          HD12      LEU 139  19.661   6.929   6.059
 1010   3HD1  LEU 139          HD13      LEU 139  18.209   6.737   5.046
 1011   1HD2  LEU 139          HD21      LEU 139  20.107   5.439   2.065
 1012   2HD2  LEU 139          HD22      LEU 139  19.240   4.540   3.311
 1013   3HD2  LEU 139          HD23      LEU 139  18.503   5.989   2.587
 1014    H    GLY 140           H        GLY 140  21.698  10.314   3.387
 1015   1HA   GLY 140          HA2       GLY 140  19.978  12.219   2.284
 1016   2HA   GLY 140          HA3       GLY 140  21.576  12.552   2.982
 1017    H    SER 141           H        SER 141  23.353  11.364   1.199
 1018    HA   SER 141           HA       SER 141  23.383  13.323  -0.847
 1019   1HB   SER 141          HB2       SER 141  25.360  12.153   0.183
 1020   2HB   SER 141          HB3       SER 141  24.937  10.696  -0.733
 1021    HG   SER 141           HG       SER 141  26.531  12.013  -1.755
 1022    H    TRP 142           H        TRP 142  22.552   9.779  -0.984
 1023    HA   TRP 142           HA       TRP 142  22.085   9.685  -3.781
 1024   1HB   TRP 142          HB2       TRP 142  22.406   7.685  -2.503
 1025   2HB   TRP 142          HB3       TRP 142  21.052   8.076  -1.450
 1026    HD1  TRP 142           HD1      TRP 142  21.603   7.184  -5.170
 1027    HE1  TRP 142           HE1      TRP 142  19.505   6.022  -6.061
 1028    HE3  TRP 142           HE3      TRP 142  18.763   7.391  -0.940
 1029    HZ2  TRP 142           HZ2      TRP 142  16.937   5.119  -4.993
 1030    HZ3  TRP 142           HZ3      TRP 142  16.486   6.384  -0.904
 1031    HH2  TRP 142           HH2      TRP 142  15.579   5.235  -2.907
 1032    H    VAL 143           H        VAL 143  19.863  10.407  -1.062
 1033    HA   VAL 143           HA       VAL 143  17.489  10.792  -2.547
 1034    HB   VAL 143           HB       VAL 143  18.561  11.771   0.109
 1035   1HG1  VAL 143          HG11      VAL 143  17.099  13.593  -0.558
 1036   2HG1  VAL 143          HG12      VAL 143  15.823  12.427  -1.008
 1037   3HG1  VAL 143          HG13      VAL 143  16.323  12.623   0.692
 1038   1HG2  VAL 143          HG21      VAL 143  16.940  10.246   1.028
 1039   2HG2  VAL 143          HG22      VAL 143  16.188  10.000  -0.567
 1040   3HG2  VAL 143          HG23      VAL 143  17.806   9.373  -0.235
 1041    H    ASN 144           H        ASN 144  20.018  13.226  -1.603
 1042    HA   ASN 144           HA       ASN 144  18.804  15.394  -2.931
 1043   1HB   ASN 144          HB2       ASN 144  21.786  14.887  -2.538
 1044   2HB   ASN 144          HB3       ASN 144  21.071  16.436  -2.945
 1045   1HD2  ASN 144          HD22      ASN 144  22.732  15.671  -0.605
 1046   2HD2  ASN 144          HD21      ASN 144  21.771  15.976   0.810
 1047    H    LEU 145           H        LEU 145  20.658  12.734  -4.242
 1048    HA   LEU 145           HA       LEU 145  21.290  14.087  -6.766
 1049   1HB   LEU 145          HB2       LEU 145  21.941  11.469  -5.484
 1050   2HB   LEU 145          HB3       LEU 145  21.707  11.400  -7.223
 1051    HG   LEU 145           HG       LEU 145  23.367  13.172  -7.582
 1052   1HD1  LEU 145          HD11      LEU 145  23.186  14.379  -5.400
 1053   2HD1  LEU 145          HD12      LEU 145  23.944  12.996  -4.595
 1054   3HD1  LEU 145          HD13      LEU 145  24.852  13.938  -5.793
 1055   1HD2  LEU 145          HD21      LEU 145  24.041  10.800  -7.618
 1056   2HD2  LEU 145          HD22      LEU 145  25.353  11.822  -7.012
 1057   3HD2  LEU 145          HD23      LEU 145  24.385  10.857  -5.875
 1058    H    LEU 146           H        LEU 146  18.987  11.468  -5.719
 1059    HA   LEU 146           HA       LEU 146  17.894  11.245  -8.348
 1060   1HB   LEU 146          HB2       LEU 146  16.428   9.726  -7.438
 1061   2HB   LEU 146          HB3       LEU 146  17.939   9.487  -6.603
 1062    HG   LEU 146           HG       LEU 146  16.712  11.046  -4.771
 1063   1HD1  LEU 146          HD11      LEU 146  14.379   9.585  -6.090
 1064   2HD1  LEU 146          HD12      LEU 146  14.328  10.489  -4.564
 1065   3HD1  LEU 146          HD13      LEU 146  14.586  11.343  -6.080
 1066   1HD2  LEU 146          HD21      LEU 146  16.184   8.080  -5.151
 1067   2HD2  LEU 146          HD22      LEU 146  17.604   8.815  -4.378
 1068   3HD2  LEU 146          HD23      LEU 146  16.018   8.975  -3.625
 1069    H    LYS 147           H        LYS 147  17.051  13.213  -5.519
 1070    HA   LYS 147           HA       LYS 147  14.540  14.167  -6.453
 1071   1HB   LYS 147          HB2       LYS 147  16.597  15.109  -4.425
 1072   2HB   LYS 147          HB3       LYS 147  15.209  16.126  -4.844
 1073   1HG   LYS 147          HG2       LYS 147  13.644  14.272  -4.326
 1074   2HG   LYS 147          HG3       LYS 147  15.003  13.249  -3.842
 1075   1HD   LYS 147          HD2       LYS 147  15.533  14.797  -2.003
 1076   2HD   LYS 147          HD3       LYS 147  14.228  15.889  -2.516
 1077   1HE   LYS 147          HE2       LYS 147  12.608  14.062  -2.171
 1078   2HE   LYS 147          HE3       LYS 147  13.891  12.977  -1.646
 1079   1HZ   LYS 147          HZ1       LYS 147  14.281  14.575   0.217
 1080   2HZ   LYS 147          HZ2       LYS 147  12.948  15.408  -0.241
 1081   3HZ   LYS 147          HZ3       LYS 147  12.815  13.854   0.265
  Start of MODEL   16
    1   1H    MET   1          H1        MET   1   1.350  -2.673   0.847
    2   2H    MET   1          H2        MET   1   2.954  -2.518   1.206
    3   3H    MET   1          H3        MET   1   1.859  -1.538   1.925
    4    HA   MET   1           HA       MET   1   2.472  -1.594  -0.941
    5   1HB   MET   1          HB2       MET   1   0.153  -0.866  -0.469
    6   2HB   MET   1          HB3       MET   1   0.749   0.368   0.642
    7   1HG   MET   1          HG2       MET   1   0.180   1.300  -1.568
    8   2HG   MET   1          HG3       MET   1   1.868   1.544  -1.158
    9   1HE   MET   1          HE1       MET   1  -0.064  -1.628  -2.738
   10   2HE   MET   1          HE2       MET   1  -0.718  -0.164  -3.509
   11   3HE   MET   1          HE3       MET   1   0.264  -1.305  -4.453
   12    H    ALA   2           H        ALA   2   4.307  -0.526  -1.545
   13    HA   ALA   2           HA       ALA   2   5.612   1.419   0.220
   14   1HB   ALA   2          HB1       ALA   2   6.754  -1.340  -0.449
   15   2HB   ALA   2          HB2       ALA   2   7.686  -0.015   0.260
   16   3HB   ALA   2          HB3       ALA   2   6.348  -0.743   1.174
   17    H    ASP   3           H        ASP   3   7.533   2.309  -0.835
   18    HA   ASP   3           HA       ASP   3   7.512   2.170  -3.785
   19   1HB   ASP   3          HB2       ASP   3   7.505   4.405  -2.510
   20   2HB   ASP   3          HB3       ASP   3   9.095   3.973  -1.923
   21    H    ILE   4           H        ILE   4   9.319   1.207  -0.930
   22    HA   ILE   4           HA       ILE   4  11.519   0.142  -2.634
   23    HB   ILE   4           HB       ILE   4  11.799   1.290   0.167
   24   1HG1  ILE   4          HG12      ILE   4  12.468   2.704  -2.443
   25   2HG1  ILE   4          HG13      ILE   4  11.169   3.146  -1.337
   26   1HG2  ILE   4          HG21      ILE   4  13.874   0.578  -1.944
   27   2HG2  ILE   4          HG22      ILE   4  14.203   1.192  -0.307
   28   3HG2  ILE   4          HG23      ILE   4  13.485  -0.395  -0.513
   29   1HD1  ILE   4          HD11      ILE   4  14.136   3.376  -0.798
   30   2HD1  ILE   4          HD12      ILE   4  12.952   4.670  -1.010
   31   3HD1  ILE   4          HD13      ILE   4  12.857   3.627   0.420
   32    H    THR   5           H        THR   5  11.766  -2.039  -2.396
   33    HA   THR   5           HA       THR   5  10.596  -3.402  -0.036
   34    HB   THR   5           HB       THR   5  10.156  -4.393  -2.246
   35    HG1  THR   5           HG1      THR   5  10.297  -5.833  -0.601
   36   1HG2  THR   5          HG21      THR   5  13.130  -4.787  -2.604
   37   2HG2  THR   5          HG22      THR   5  11.838  -5.473  -3.602
   38   3HG2  THR   5          HG23      THR   5  12.070  -3.723  -3.556
   39    H    LEU   6           H        LEU   6  11.940  -3.872   1.711
   40    HA   LEU   6           HA       LEU   6  14.893  -3.531   1.334
   41   1HB   LEU   6          HB2       LEU   6  13.148  -3.338   3.814
   42   2HB   LEU   6          HB3       LEU   6  14.859  -3.706   3.883
   43    HG   LEU   6           HG       LEU   6  15.230  -1.560   2.462
   44   1HD1  LEU   6          HD11      LEU   6  12.885  -1.087   1.872
   45   2HD1  LEU   6          HD12      LEU   6  12.458  -0.991   3.593
   46   3HD1  LEU   6          HD13      LEU   6  13.540   0.221   2.862
   47   1HD2  LEU   6          HD21      LEU   6  14.336  -1.447   5.361
   48   2HD2  LEU   6          HD22      LEU   6  15.971  -1.786   4.762
   49   3HD2  LEU   6          HD23      LEU   6  15.268  -0.181   4.526
   50    H    ILE   7           H        ILE   7  15.577  -5.400   0.632
   51    HA   ILE   7           HA       ILE   7  14.297  -7.913   1.428
   52    HB   ILE   7           HB       ILE   7  16.590  -7.527  -0.542
   53   1HG1  ILE   7          HG12      ILE   7  13.645  -7.487  -1.343
   54   2HG1  ILE   7          HG13      ILE   7  14.606  -6.023  -1.196
   55   1HG2  ILE   7          HG21      ILE   7  15.950  -9.820   0.319
   56   2HG2  ILE   7          HG22      ILE   7  14.330  -9.573  -0.379
   57   3HG2  ILE   7          HG23      ILE   7  15.744  -9.656  -1.430
   58   1HD1  ILE   7          HD11      ILE   7  15.234  -8.272  -3.129
   59   2HD1  ILE   7          HD12      ILE   7  14.528  -6.696  -3.505
   60   3HD1  ILE   7          HD13      ILE   7  16.189  -6.793  -2.891
   61    H    SER   8           H        SER   8  14.997  -7.622   3.707
   62    HA   SER   8           HA       SER   8  17.810  -7.252   4.254
   63   1HB   SER   8          HB2       SER   8  15.793  -8.165   6.300
   64   2HB   SER   8          HB3       SER   8  17.180  -7.087   6.501
   65    HG   SER   8           HG       SER   8  14.630  -6.640   5.445
   66    H    GLY   9           H        GLY   9  19.337  -8.756   4.746
   67   1HA   GLY   9          HA2       GLY   9  19.405 -10.748   6.341
   68   2HA   GLY   9          HA3       GLY   9  18.604 -11.619   5.016
   69    H    SER  10           H        SER  10  21.457 -11.534   6.367
   70    HA   SER  10           HA       SER  10  23.097 -11.409   3.966
   71   1HB   SER  10          HB2       SER  10  23.935 -12.474   6.655
   72   2HB   SER  10          HB3       SER  10  24.862 -11.599   5.410
   73    HG   SER  10           HG       SER  10  24.281 -10.387   7.362
   74    H    THR  11           H        THR  11  20.933 -13.530   5.319
   75    HA   THR  11           HA       THR  11  21.556 -15.682   3.453
   76    HB   THR  11           HB       THR  11  22.706 -16.482   5.426
   77    HG1  THR  11           HG1      THR  11  21.792 -18.165   4.585
   78   1HG2  THR  11          HG21      THR  11  20.150 -15.997   7.010
   79   2HG2  THR  11          HG22      THR  11  21.536 -16.960   7.556
   80   3HG2  THR  11          HG23      THR  11  21.731 -15.232   7.256
   81    H    LEU  12           H        LEU  12  19.143 -17.023   4.935
   82    HA   LEU  12           HA       LEU  12  17.026 -15.496   3.706
   83   1HB   LEU  12          HB2       LEU  12  15.599 -17.145   4.166
   84   2HB   LEU  12          HB3       LEU  12  17.110 -18.026   3.991
   85    HG   LEU  12           HG       LEU  12  15.791 -17.209   6.584
   86   1HD1  LEU  12          HD11      LEU  12  15.955 -19.944   5.254
   87   2HD1  LEU  12          HD12      LEU  12  15.216 -19.601   6.836
   88   3HD1  LEU  12          HD13      LEU  12  14.508 -18.919   5.364
   89   1HD2  LEU  12          HD21      LEU  12  17.384 -18.812   7.677
   90   2HD2  LEU  12          HD22      LEU  12  18.238 -18.965   6.125
   91   3HD2  LEU  12          HD23      LEU  12  18.183 -17.405   6.981
   92    H    GLY  13           H        GLY  13  18.627 -14.363   6.016
   93   1HA   GLY  13          HA2       GLY  13  16.936 -12.399   6.962
   94   2HA   GLY  13          HA3       GLY  13  16.943 -13.669   8.210
   95    H    GLY  14           H        GLY  14  18.079 -11.484   9.147
   96   1HA   GLY  14          HA2       GLY  14  20.110 -11.902  10.529
   97   2HA   GLY  14          HA3       GLY  14  21.029 -12.050   9.033
   98    H    ALA  15           H        ALA  15  18.637  -9.535   8.821
   99    HA   ALA  15           HA       ALA  15  20.580  -7.458   9.707
  100   1HB   ALA  15          HB1       ALA  15  20.493  -6.332   7.542
  101   2HB   ALA  15          HB2       ALA  15  21.139  -7.970   7.343
  102   3HB   ALA  15          HB3       ALA  15  19.459  -7.611   6.879
  103    H    GLU  16           H        GLU  16  17.400  -8.519   9.637
  104    HA   GLU  16           HA       GLU  16  15.861  -6.382   8.946
  105   1HB   GLU  16          HB2       GLU  16  15.260  -8.281  11.247
  106   2HB   GLU  16          HB3       GLU  16  14.114  -7.249  10.393
  107   1HG   GLU  16          HG2       GLU  16  13.727  -9.291   9.405
  108   2HG   GLU  16          HG3       GLU  16  14.809  -8.536   8.247
  109    H    TYR  17           H        TYR  17  17.564  -6.763  12.043
  110    HA   TYR  17           HA       TYR  17  16.215  -4.820  13.565
  111   1HB   TYR  17          HB2       TYR  17  17.812  -6.453  14.475
  112   2HB   TYR  17          HB3       TYR  17  19.138  -5.673  13.621
  113    HD1  TYR  17           HD1      TYR  17  16.495  -5.057  16.224
  114    HD2  TYR  17           HD2      TYR  17  20.356  -3.909  14.668
  115    HE1  TYR  17           HE1      TYR  17  16.839  -3.573  18.178
  116    HE2  TYR  17           HE2      TYR  17  20.710  -2.431  16.618
  117    HH   TYR  17           HH       TYR  17  19.824  -1.616  18.619
  118    H    VAL  18           H        VAL  18  18.950  -4.411  11.245
  119    HA   VAL  18           HA       VAL  18  18.945  -1.499  11.768
  120    HB   VAL  18           HB       VAL  18  20.703  -3.082   9.855
  121   1HG1  VAL  18          HG11      VAL  18  20.787  -0.233  10.959
  122   2HG1  VAL  18          HG12      VAL  18  22.182  -1.008  10.204
  123   3HG1  VAL  18          HG13      VAL  18  20.716  -0.736   9.257
  124   1HG2  VAL  18          HG21      VAL  18  21.221  -2.214  12.737
  125   2HG2  VAL  18          HG22      VAL  18  21.135  -3.885  12.134
  126   3HG2  VAL  18          HG23      VAL  18  22.457  -2.841  11.624
  127    H    ALA  19           H        ALA  19  17.773  -3.874   9.375
  128    HA   ALA  19           HA       ALA  19  17.157  -2.066   7.296
  129   1HB   ALA  19          HB1       ALA  19  15.598  -3.688   6.516
  130   2HB   ALA  19          HB2       ALA  19  17.002  -4.559   7.165
  131   3HB   ALA  19          HB3       ALA  19  15.483  -4.451   8.103
  132    H    GLU  20           H        GLU  20  15.264  -2.884  10.276
  133    HA   GLU  20           HA       GLU  20  13.031  -1.278   9.695
  134   1HB   GLU  20          HB2       GLU  20  13.300  -2.923  11.570
  135   2HB   GLU  20          HB3       GLU  20  14.291  -1.733  12.430
  136   1HG   GLU  20          HG2       GLU  20  12.366  -0.145  12.399
  137   2HG   GLU  20          HG3       GLU  20  11.402  -1.334  11.524
  138    H    HIS  21           H        HIS  21  16.189  -0.276  11.120
  139    HA   HIS  21           HA       HIS  21  15.352   2.453  11.600
  140   1HB   HIS  21          HB2       HIS  21  17.222   1.427  12.823
  141   2HB   HIS  21          HB3       HIS  21  18.125   1.217  11.320
  142    HD1  HIS  21           HD1      HIS  21  19.663   3.249  10.658
  143    HD2  HIS  21           HD2      HIS  21  16.654   4.149  13.464
  144    HE1  HIS  21           HE1      HIS  21  20.058   5.655  11.384
  145    H    LEU  22           H        LEU  22  17.102   0.787   8.954
  146    HA   LEU  22           HA       LEU  22  17.652   3.032   7.310
  147   1HB   LEU  22          HB2       LEU  22  17.160   0.081   6.839
  148   2HB   LEU  22          HB3       LEU  22  17.336   1.136   5.469
  149    HG   LEU  22           HG       LEU  22  19.406   1.062   7.715
  150   1HD1  LEU  22          HD11      LEU  22  20.693  -0.550   6.415
  151   2HD1  LEU  22          HD12      LEU  22  19.139  -1.230   6.853
  152   3HD1  LEU  22          HD13      LEU  22  19.396  -0.646   5.193
  153   1HD2  LEU  22          HD21      LEU  22  19.584   1.896   4.780
  154   2HD2  LEU  22          HD22      LEU  22  19.575   2.990   6.176
  155   3HD2  LEU  22          HD23      LEU  22  20.933   1.888   5.934
  156    H    ALA  23           H        ALA  23  14.878   0.789   7.218
  157    HA   ALA  23           HA       ALA  23  13.263   2.057   5.335
  158   1HB   ALA  23          HB1       ALA  23  12.504   0.545   7.868
  159   2HB   ALA  23          HB2       ALA  23  11.359   1.008   6.611
  160   3HB   ALA  23          HB3       ALA  23  12.674  -0.110   6.225
  161    H    GLU  24           H        GLU  24  13.368   2.732   8.911
  162    HA   GLU  24           HA       GLU  24  11.420   4.737   8.958
  163   1HB   GLU  24          HB2       GLU  24  12.784   3.649  10.891
  164   2HB   GLU  24          HB3       GLU  24  14.000   4.857  10.579
  165   1HG   GLU  24          HG2       GLU  24  12.674   5.676  12.364
  166   2HG   GLU  24          HG3       GLU  24  12.336   6.667  10.953
  167    H    LYS  25           H        LYS  25  14.984   5.173   8.574
  168    HA   LYS  25           HA       LYS  25  14.893   7.934   8.020
  169   1HB   LYS  25          HB2       LYS  25  16.818   5.736   7.132
  170   2HB   LYS  25          HB3       LYS  25  17.131   7.437   6.897
  171   1HG   LYS  25          HG2       LYS  25  16.734   5.987   9.569
  172   2HG   LYS  25          HG3       LYS  25  18.229   6.565   8.923
  173   1HD   LYS  25          HD2       LYS  25  15.932   8.122  10.088
  174   2HD   LYS  25          HD3       LYS  25  17.608   8.081  10.625
  175   1HE   LYS  25          HE2       LYS  25  18.272   9.303   8.527
  176   2HE   LYS  25          HE3       LYS  25  16.553   9.386   8.074
  177   1HZ   LYS  25          HZ1       LYS  25  17.670  10.593  10.532
  178   2HZ   LYS  25          HZ2       LYS  25  17.315  11.410   9.165
  179   3HZ   LYS  25          HZ3       LYS  25  16.109  10.691  10.007
  180    H    LEU  26           H        LEU  26  14.653   5.228   5.686
  181    HA   LEU  26           HA       LEU  26  14.519   6.919   3.390
  182   1HB   LEU  26          HB2       LEU  26  13.848   4.053   3.981
  183   2HB   LEU  26          HB3       LEU  26  12.984   4.785   2.645
  184    HG   LEU  26           HG       LEU  26  14.843   3.657   1.757
  185   1HD1  LEU  26          HD11      LEU  26  15.630   5.309   0.314
  186   2HD1  LEU  26          HD12      LEU  26  14.155   6.026   0.926
  187   3HD1  LEU  26          HD13      LEU  26  15.723   6.551   1.580
  188   1HD2  LEU  26          HD21      LEU  26  17.195   4.215   2.270
  189   2HD2  LEU  26          HD22      LEU  26  16.647   5.286   3.580
  190   3HD2  LEU  26          HD23      LEU  26  16.340   3.542   3.655
  191    H    GLU  27           H        GLU  27  11.932   5.943   5.718
  192    HA   GLU  27           HA       GLU  27   9.859   7.100   4.117
  193   1HB   GLU  27          HB2       GLU  27  10.064   6.368   7.061
  194   2HB   GLU  27          HB3       GLU  27   8.648   7.107   6.334
  195   1HG   GLU  27          HG2       GLU  27   8.536   5.237   4.672
  196   2HG   GLU  27          HG3       GLU  27   9.865   4.446   5.495
  197    H    GLU  28           H        GLU  28  12.050   8.450   6.725
  198    HA   GLU  28           HA       GLU  28  10.938  11.042   6.670
  199   1HB   GLU  28          HB2       GLU  28  13.848  10.258   7.162
  200   2HB   GLU  28          HB3       GLU  28  13.025  11.731   7.598
  201   1HG   GLU  28          HG2       GLU  28  11.438  10.060   8.960
  202   2HG   GLU  28          HG3       GLU  28  12.903   9.059   8.894
  203    H    ALA  29           H        ALA  29  13.126   9.370   4.427
  204    HA   ALA  29           HA       ALA  29  14.075  11.732   3.087
  205   1HB   ALA  29          HB1       ALA  29  14.933  10.193   1.407
  206   2HB   ALA  29          HB2       ALA  29  15.290   9.563   3.024
  207   3HB   ALA  29          HB3       ALA  29  13.973   8.867   2.051
  208    H    GLY  30           H        GLY  30  11.031  10.069   3.003
  209   1HA   GLY  30          HA2       GLY  30   9.286  11.515   2.165
  210   2HA   GLY  30          HA3       GLY  30  10.221  11.785   0.694
  211    H    PHE  31           H        PHE  31  10.213   8.459   1.820
  212    HA   PHE  31           HA       PHE  31   8.231   7.815  -0.338
  213   1HB   PHE  31          HB2       PHE  31  10.600   6.085   0.325
  214   2HB   PHE  31          HB3       PHE  31   9.578   6.067  -1.088
  215    HD1  PHE  31           HD1      PHE  31   9.770   7.856  -2.850
  216    HD2  PHE  31           HD2      PHE  31  12.523   7.588   0.455
  217    HE1  PHE  31           HE1      PHE  31  11.371   9.318  -4.059
  218    HE2  PHE  31           HE2      PHE  31  14.127   9.038  -0.758
  219    HZ   PHE  31           HZ       PHE  31  13.551   9.905  -3.022
  220    H    THR  32           H        THR  32   7.903   5.154  -0.028
  221    HA   THR  32           HA       THR  32   7.293   4.630   2.829
  222    HB   THR  32           HB       THR  32   5.408   3.171   1.856
  223    HG1  THR  32           HG1      THR  32   4.551   3.997  -0.112
  224   1HG2  THR  32          HG21      THR  32   5.042   5.192   3.193
  225   2HG2  THR  32          HG22      THR  32   5.142   6.206   1.734
  226   3HG2  THR  32          HG23      THR  32   3.812   5.036   1.927
  227    H    THR  33           H        THR  33   7.618   2.416   3.422
  228    HA   THR  33           HA       THR  33   9.333   0.901   1.508
  229    HB   THR  33           HB       THR  33  10.950   0.678   3.266
  230    HG1  THR  33           HG1      THR  33   9.560   0.982   5.094
  231   1HG2  THR  33          HG21      THR  33  10.328   3.654   3.043
  232   2HG2  THR  33          HG22      THR  33  11.897   2.868   3.313
  233   3HG2  THR  33          HG23      THR  33  11.084   2.714   1.744
  234    H    GLU  34           H        GLU  34   9.535  -1.341   1.873
  235    HA   GLU  34           HA       GLU  34   7.649  -2.576   3.778
  236   1HB   GLU  34          HB2       GLU  34   7.803  -2.707   1.005
  237   2HB   GLU  34          HB3       GLU  34   8.726  -4.103   1.478
  238   1HG   GLU  34          HG2       GLU  34   6.543  -4.726   1.224
  239   2HG   GLU  34          HG3       GLU  34   6.858  -4.803   2.953
  240    H    THR  35           H        THR  35   9.119  -2.588   5.590
  241    HA   THR  35           HA       THR  35  11.748  -3.727   5.368
  242    HB   THR  35           HB       THR  35  10.103  -3.762   7.904
  243    HG1  THR  35           HG1      THR  35  10.438  -1.647   8.193
  244   1HG2  THR  35          HG21      THR  35  12.285  -3.462   8.927
  245   2HG2  THR  35          HG22      THR  35  12.458  -4.737   7.703
  246   3HG2  THR  35          HG23      THR  35  13.034  -3.099   7.350
  247    H    LEU  36           H        LEU  36  12.134  -5.835   4.921
  248    HA   LEU  36           HA       LEU  36  10.289  -7.991   5.818
  249   1HB   LEU  36          HB2       LEU  36  11.293  -7.480   2.978
  250   2HB   LEU  36          HB3       LEU  36  10.426  -8.917   3.495
  251    HG   LEU  36           HG       LEU  36   9.234  -6.127   3.553
  252   1HD1  LEU  36          HD11      LEU  36   9.799  -6.805   1.272
  253   2HD1  LEU  36          HD12      LEU  36   8.957  -8.352   1.501
  254   3HD1  LEU  36          HD13      LEU  36   8.043  -6.822   1.509
  255   1HD2  LEU  36          HD21      LEU  36   7.077  -7.320   3.725
  256   2HD2  LEU  36          HD22      LEU  36   7.922  -8.882   3.765
  257   3HD2  LEU  36          HD23      LEU  36   8.109  -7.725   5.099
  258    H    HIS  37           H        HIS  37  11.364 -10.153   5.475
  259    HA   HIS  37           HA       HIS  37  14.326  -9.952   5.501
  260   1HB   HIS  37          HB2       HIS  37  14.316 -12.150   6.571
  261   2HB   HIS  37          HB3       HIS  37  13.405 -10.971   7.497
  262    HD1  HIS  37           HD1      HIS  37  10.744 -11.432   7.757
  263    HD2  HIS  37           HD2      HIS  37  12.951 -14.237   5.521
  264    HE1  HIS  37           HE1      HIS  37   9.224 -13.445   7.432
  265    H    GLY  38           H        GLY  38  12.835  -9.619   3.108
  266   1HA   GLY  38          HA2       GLY  38  12.530 -10.369   0.968
  267   2HA   GLY  38          HA3       GLY  38  14.037 -11.267   1.218
  268    HA   PRO  39           HA       PRO  39  10.956 -14.531   2.704
  269   1HB   PRO  39          HB2       PRO  39   8.223 -14.149   2.713
  270   2HB   PRO  39          HB3       PRO  39   9.297 -13.685   4.064
  271   1HG   PRO  39          HG2       PRO  39   8.268 -11.926   1.817
  272   2HG   PRO  39          HG3       PRO  39   8.262 -11.591   3.579
  273   1HD   PRO  39          HD2       PRO  39  10.211 -10.607   1.970
  274   2HD   PRO  39          HD3       PRO  39  10.592 -11.225   3.613
  275    H    LEU  40           H        LEU  40  10.024 -12.635  -0.134
  276    HA   LEU  40           HA       LEU  40   9.467 -15.112  -1.654
  277   1HB   LEU  40          HB2       LEU  40   8.289 -12.283  -1.704
  278   2HB   LEU  40          HB3       LEU  40   8.044 -13.434  -2.983
  279    HG   LEU  40           HG       LEU  40   7.133 -13.838  -0.108
  280   1HD1  LEU  40          HD11      LEU  40   5.542 -13.143  -2.613
  281   2HD1  LEU  40          HD12      LEU  40   4.872 -13.456  -0.995
  282   3HD1  LEU  40          HD13      LEU  40   5.903 -12.045  -1.264
  283   1HD2  LEU  40          HD21      LEU  40   5.789 -15.721  -1.045
  284   2HD2  LEU  40          HD22      LEU  40   6.611 -15.514  -2.608
  285   3HD2  LEU  40          HD23      LEU  40   7.522 -16.016  -1.165
  286    H    LEU  41           H        LEU  41  11.982 -13.410  -1.045
  287    HA   LEU  41           HA       LEU  41  13.777 -12.499  -1.961
  288   1HB   LEU  41          HB2       LEU  41  13.517 -14.548  -3.497
  289   2HB   LEU  41          HB3       LEU  41  12.840 -13.438  -4.680
  290    HG   LEU  41           HG       LEU  41  15.053 -12.078  -4.424
  291   1HD1  LEU  41          HD11      LEU  41  16.985 -13.441  -3.744
  292   2HD1  LEU  41          HD12      LEU  41  15.901 -13.159  -2.382
  293   3HD1  LEU  41          HD13      LEU  41  15.905 -14.740  -3.199
  294   1HD2  LEU  41          HD21      LEU  41  16.222 -13.597  -6.013
  295   2HD2  LEU  41          HD22      LEU  41  14.986 -14.836  -5.683
  296   3HD2  LEU  41          HD23      LEU  41  14.528 -13.297  -6.431
  297    H    GLU  42           H        GLU  42  10.732 -11.586  -3.436
  298    HA   GLU  42           HA       GLU  42  11.583  -8.808  -3.907
  299   1HB   GLU  42          HB2       GLU  42  11.022  -8.994  -6.356
  300   2HB   GLU  42          HB3       GLU  42  12.533  -9.735  -5.858
  301   1HG   GLU  42          HG2       GLU  42  11.445 -11.991  -5.920
  302   2HG   GLU  42          HG3       GLU  42   9.978 -11.250  -6.542
  303    H    ASP  43           H        ASP  43   9.951  -8.482  -2.304
  304    HA   ASP  43           HA       ASP  43   7.216  -9.330  -2.762
  305   1HB   ASP  43          HB2       ASP  43   7.969  -8.745  -0.536
  306   2HB   ASP  43          HB3       ASP  43   8.330  -7.085  -1.053
  307    H    LEU  44           H        LEU  44   9.110  -6.330  -3.497
  308    HA   LEU  44           HA       LEU  44   6.812  -5.349  -5.110
  309   1HB   LEU  44          HB2       LEU  44   9.548  -4.108  -4.724
  310   2HB   LEU  44          HB3       LEU  44   8.289  -3.417  -5.668
  311    HG   LEU  44           HG       LEU  44   8.153  -3.823  -2.662
  312   1HD1  LEU  44          HD11      LEU  44   8.180  -1.263  -4.323
  313   2HD1  LEU  44          HD12      LEU  44   8.272  -1.405  -2.556
  314   3HD1  LEU  44          HD13      LEU  44   9.619  -1.960  -3.571
  315   1HD2  LEU  44          HD21      LEU  44   5.893  -4.090  -3.524
  316   2HD2  LEU  44          HD22      LEU  44   6.043  -2.495  -2.789
  317   3HD2  LEU  44          HD23      LEU  44   6.074  -2.650  -4.558
  318    HA   PRO  45           HA       PRO  45   8.234  -7.399  -8.681
  319   1HB   PRO  45          HB2       PRO  45   7.490  -5.659 -10.739
  320   2HB   PRO  45          HB3       PRO  45   6.405  -6.699  -9.812
  321   1HG   PRO  45          HG2       PRO  45   7.064  -3.763  -9.424
  322   2HG   PRO  45          HG3       PRO  45   5.458  -4.541  -9.353
  323   1HD   PRO  45          HD2       PRO  45   6.919  -3.908  -7.106
  324   2HD   PRO  45          HD3       PRO  45   5.826  -5.327  -7.180
  325    H    ALA  46           H        ALA  46   9.247  -6.937 -10.875
  326    HA   ALA  46           HA       ALA  46  11.970  -5.987 -10.575
  327   1HB   ALA  46          HB1       ALA  46  12.136  -6.761 -12.952
  328   2HB   ALA  46          HB2       ALA  46  11.404  -7.996 -11.913
  329   3HB   ALA  46          HB3       ALA  46  10.386  -7.007 -12.991
  330    H    SER  47           H        SER  47  10.087  -3.874 -10.151
  331    HA   SER  47           HA       SER  47  11.037  -1.814 -11.882
  332   1HB   SER  47          HB2       SER  47   8.107  -2.551 -12.045
  333   2HB   SER  47          HB3       SER  47   8.795  -1.035 -12.650
  334    HG   SER  47           HG       SER  47  10.085  -3.309 -13.510
  335    H    GLY  48           H        GLY  48  11.459  -0.322 -10.276
  336   1HA   GLY  48          HA2       GLY  48   9.932   1.027  -8.536
  337   2HA   GLY  48          HA3       GLY  48  10.021  -0.546  -7.721
  338    H    ILE  49           H        ILE  49  11.294   0.184  -5.997
  339    HA   ILE  49           HA       ILE  49  14.165   0.615  -6.651
  340    HB   ILE  49           HB       ILE  49  12.713   1.529  -4.171
  341   1HG1  ILE  49          HG12      ILE  49  11.713   2.866  -5.947
  342   2HG1  ILE  49          HG13      ILE  49  12.664   3.824  -4.838
  343   1HG2  ILE  49          HG21      ILE  49  15.122   1.235  -3.874
  344   2HG2  ILE  49          HG22      ILE  49  15.453   2.284  -5.258
  345   3HG2  ILE  49          HG23      ILE  49  14.715   2.952  -3.790
  346   1HD1  ILE  49          HD11      ILE  49  13.747   2.935  -7.536
  347   2HD1  ILE  49          HD12      ILE  49  12.881   4.459  -7.260
  348   3HD1  ILE  49          HD13      ILE  49  14.406   4.164  -6.423
  349    H    TRP  50           H        TRP  50  15.467  -0.948  -5.661
  350    HA   TRP  50           HA       TRP  50  14.224  -2.755  -3.628
  351   1HB   TRP  50          HB2       TRP  50  16.191  -3.289  -5.890
  352   2HB   TRP  50          HB3       TRP  50  16.069  -4.327  -4.505
  353    HD1  TRP  50           HD1      TRP  50  12.705  -3.177  -5.889
  354    HE1  TRP  50           HE1      TRP  50  11.595  -5.053  -7.219
  355    HE3  TRP  50           HE3      TRP  50  16.610  -6.485  -5.970
  356    HZ2  TRP  50           HZ2      TRP  50  12.286  -7.716  -8.112
  357    HZ3  TRP  50           HZ3      TRP  50  16.346  -8.698  -7.056
  358    HH2  TRP  50           HH2      TRP  50  14.189  -9.326  -8.120
  359    H    LEU  51           H        LEU  51  15.542  -3.173  -1.837
  360    HA   LEU  51           HA       LEU  51  18.303  -2.078  -1.807
  361   1HB   LEU  51          HB2       LEU  51  16.134  -1.705   0.304
  362   2HB   LEU  51          HB3       LEU  51  17.850  -1.625   0.685
  363    HG   LEU  51           HG       LEU  51  16.339   0.272  -1.168
  364   1HD1  LEU  51          HD11      LEU  51  16.848   1.928   0.574
  365   2HD1  LEU  51          HD12      LEU  51  15.939   0.576   1.265
  366   3HD1  LEU  51          HD13      LEU  51  17.687   0.696   1.541
  367   1HD2  LEU  51          HD21      LEU  51  18.500   0.173  -2.130
  368   2HD2  LEU  51          HD22      LEU  51  18.611   1.540  -1.026
  369   3HD2  LEU  51          HD23      LEU  51  19.307  -0.023  -0.566
  370    H    VAL  52           H        VAL  52  19.713  -3.496  -0.766
  371    HA   VAL  52           HA       VAL  52  18.526  -5.951   0.420
  372    HB   VAL  52           HB       VAL  52  18.943  -6.562  -1.817
  373   1HG1  VAL  52          HG11      VAL  52  20.512  -4.772  -2.537
  374   2HG1  VAL  52          HG12      VAL  52  21.811  -5.587  -1.629
  375   3HG1  VAL  52          HG13      VAL  52  21.038  -6.381  -3.008
  376   1HG2  VAL  52          HG21      VAL  52  19.616  -8.176  -0.055
  377   2HG2  VAL  52          HG22      VAL  52  20.508  -8.388  -1.570
  378   3HG2  VAL  52          HG23      VAL  52  21.290  -7.603  -0.184
  379    H    ILE  53           H        ILE  53  19.505  -6.562   2.267
  380    HA   ILE  53           HA       ILE  53  21.796  -4.922   3.212
  381    HB   ILE  53           HB       ILE  53  19.407  -5.597   4.969
  382   1HG1  ILE  53          HG12      ILE  53  18.888  -3.025   4.665
  383   2HG1  ILE  53          HG13      ILE  53  19.620  -3.238   3.082
  384   1HG2  ILE  53          HG21      ILE  53  21.508  -3.399   5.136
  385   2HG2  ILE  53          HG22      ILE  53  20.304  -3.827   6.369
  386   3HG2  ILE  53          HG23      ILE  53  21.611  -4.953   5.976
  387   1HD1  ILE  53          HD11      ILE  53  17.853  -5.037   2.617
  388   2HD1  ILE  53          HD12      ILE  53  17.185  -4.690   4.218
  389   3HD1  ILE  53          HD13      ILE  53  17.188  -3.439   2.963
  390    H    SER  54           H        SER  54  23.416  -6.209   3.585
  391    HA   SER  54           HA       SER  54  23.012  -8.885   4.760
  392   1HB   SER  54          HB2       SER  54  24.392  -8.473   2.076
  393   2HB   SER  54          HB3       SER  54  24.044  -9.997   2.855
  394    HG   SER  54           HG       SER  54  21.812  -9.579   2.535
  395    H    SER  55           H        SER  55  25.494  -9.927   4.633
  396    HA   SER  55           HA       SER  55  27.618  -7.943   4.661
  397   1HB   SER  55          HB2       SER  55  26.881  -9.541   7.155
  398   2HB   SER  55          HB3       SER  55  28.430  -8.714   6.914
  399    HG   SER  55           HG       SER  55  26.269  -7.132   6.382
  400    H    THR  56           H        THR  56  29.352  -8.897   3.720
  401    HA   THR  56           HA       THR  56  29.553 -11.870   3.655
  402    HB   THR  56           HB       THR  56  30.107 -11.397   1.167
  403    HG1  THR  56           HG1      THR  56  29.518  -9.540   0.396
  404   1HG2  THR  56          HG21      THR  56  27.823 -11.403   0.496
  405   2HG2  THR  56          HG22      THR  56  27.916 -12.338   2.001
  406   3HG2  THR  56          HG23      THR  56  27.278 -10.677   2.018
  407    H    HIS  57           H        HIS  57  31.416  -9.101   2.365
  408    HA   HIS  57           HA       HIS  57  33.639  -8.597   2.397
  409   1HB   HIS  57          HB2       HIS  57  33.160  -8.051   4.673
  410   2HB   HIS  57          HB3       HIS  57  33.387  -9.713   5.201
  411    HD1  HIS  57           HD1      HIS  57  35.620  -6.774   3.853
  412    HD2  HIS  57           HD2      HIS  57  35.682 -10.301   6.172
  413    HE1  HIS  57           HE1      HIS  57  37.868  -6.846   4.993
  414    H    GLY  58           H        GLY  58  32.838 -11.056   1.145
  415   1HA   GLY  58          HA2       GLY  58  33.550 -13.090   0.414
  416   2HA   GLY  58          HA3       GLY  58  35.178 -12.392   0.536
  417    H    ALA  59           H        ALA  59  33.269 -12.789   3.429
  418    HA   ALA  59           HA       ALA  59  34.616 -15.242   4.341
  419   1HB   ALA  59          HB1       ALA  59  36.269 -13.404   4.692
  420   2HB   ALA  59          HB2       ALA  59  35.047 -12.492   5.607
  421   3HB   ALA  59          HB3       ALA  59  35.664 -14.039   6.231
  422    H    GLY  60           H        GLY  60  31.915 -14.835   3.782
  423   1HA   GLY  60          HA2       GLY  60  30.342 -14.078   6.092
  424   2HA   GLY  60          HA3       GLY  60  29.803 -14.980   4.670
  425    H    ASP  61           H        ASP  61  28.620 -16.036   6.622
  426    HA   ASP  61           HA       ASP  61  29.928 -17.862   8.361
  427   1HB   ASP  61          HB2       ASP  61  27.570 -17.218   8.594
  428   2HB   ASP  61          HB3       ASP  61  27.180 -18.031   7.074
  429    H    ILE  62           H        ILE  62  29.196 -18.051   4.957
  430    HA   ILE  62           HA       ILE  62  30.985 -20.272   4.588
  431    HB   ILE  62           HB       ILE  62  28.791 -21.391   4.920
  432   1HG1  ILE  62          HG12      ILE  62  28.560 -22.624   2.749
  433   2HG1  ILE  62          HG13      ILE  62  29.763 -21.553   2.048
  434   1HG2  ILE  62          HG21      ILE  62  27.271 -19.568   4.209
  435   2HG2  ILE  62          HG22      ILE  62  27.731 -19.869   2.519
  436   3HG2  ILE  62          HG23      ILE  62  26.894 -21.112   3.452
  437   1HD1  ILE  62          HD11      ILE  62  30.125 -23.432   4.438
  438   2HD1  ILE  62          HD12      ILE  62  30.777 -23.664   2.806
  439   3HD1  ILE  62          HD13      ILE  62  31.395 -22.356   3.829
  440    HA   PRO  63           HA       PRO  63  31.815 -17.408   1.147
  441   1HB   PRO  63          HB2       PRO  63  32.354 -19.904  -0.474
  442   2HB   PRO  63          HB3       PRO  63  33.321 -18.398  -0.369
  443   1HG   PRO  63          HG2       PRO  63  34.087 -20.572   1.028
  444   2HG   PRO  63          HG3       PRO  63  34.082 -18.968   1.838
  445   1HD   PRO  63          HD2       PRO  63  31.984 -21.142   1.954
  446   2HD   PRO  63          HD3       PRO  63  32.713 -20.212   3.302
  447    H    ASP  64           H        ASP  64  29.026 -18.741   1.374
  448    HA   ASP  64           HA       ASP  64  27.900 -17.852  -1.171
  449   1HB   ASP  64          HB2       ASP  64  28.399 -20.283  -1.506
  450   2HB   ASP  64          HB3       ASP  64  27.457 -20.665  -0.065
  451    H    ASN  65           H        ASN  65  28.064 -16.757   1.433
  452    HA   ASN  65           HA       ASN  65  26.284 -17.478   3.366
  453   1HB   ASN  65          HB2       ASN  65  28.084 -15.676   3.415
  454   2HB   ASN  65          HB3       ASN  65  26.879 -14.588   2.725
  455   1HD2  ASN  65          HD22      ASN  65  27.051 -13.221   4.741
  456   2HD2  ASN  65          HD21      ASN  65  26.351 -13.821   6.214
  457    H    LEU  66           H        LEU  66  25.605 -15.351   0.632
  458    HA   LEU  66           HA       LEU  66  22.758 -15.013   1.192
  459   1HB   LEU  66          HB2       LEU  66  24.614 -14.261  -1.109
  460   2HB   LEU  66          HB3       LEU  66  22.886 -14.144  -1.267
  461    HG   LEU  66           HG       LEU  66  23.697 -12.012  -0.783
  462   1HD1  LEU  66          HD11      LEU  66  22.341 -11.341   1.050
  463   2HD1  LEU  66          HD12      LEU  66  21.524 -12.653   0.224
  464   3HD1  LEU  66          HD13      LEU  66  22.352 -12.956   1.764
  465   1HD2  LEU  66          HD21      LEU  66  24.880 -12.959   1.841
  466   2HD2  LEU  66          HD22      LEU  66  25.801 -12.649   0.351
  467   3HD2  LEU  66          HD23      LEU  66  24.928 -11.328   1.140
  468    H    SER  67           H        SER  67  22.622 -17.409   1.526
  469    HA   SER  67           HA       SER  67  23.256 -19.271  -0.561
  470   1HB   SER  67          HB2       SER  67  21.701 -19.484   2.055
  471   2HB   SER  67          HB3       SER  67  22.183 -20.870   1.045
  472    HG   SER  67           HG       SER  67  24.339 -19.381   1.440
  473    HA   PRO  68           HA       PRO  68  18.561 -19.392  -1.340
  474   1HB   PRO  68          HB2       PRO  68  16.904 -17.405  -0.442
  475   2HB   PRO  68          HB3       PRO  68  17.325 -18.839   0.538
  476   1HG   PRO  68          HG2       PRO  68  18.546 -16.080   0.712
  477   2HG   PRO  68          HG3       PRO  68  18.016 -17.138   2.047
  478   1HD   PRO  68          HD2       PRO  68  20.558 -16.983   1.321
  479   2HD   PRO  68          HD3       PRO  68  19.850 -18.506   1.911
  480    H    PHE  69           H        PHE  69  19.957 -16.166  -0.948
  481    HA   PHE  69           HA       PHE  69  18.512 -14.905  -3.028
  482   1HB   PHE  69          HB2       PHE  69  20.406 -14.144  -1.101
  483   2HB   PHE  69          HB3       PHE  69  21.200 -13.765  -2.597
  484    HD1  PHE  69           HD1      PHE  69  19.228 -12.298  -0.165
  485    HD2  PHE  69           HD2      PHE  69  19.590 -12.610  -4.454
  486    HE1  PHE  69           HE1      PHE  69  18.166 -10.082  -0.423
  487    HE2  PHE  69           HE2      PHE  69  18.455 -10.420  -4.705
  488    HZ   PHE  69           HZ       PHE  69  17.772  -9.134  -2.691
  489    H    TYR  70           H        TYR  70  21.926 -15.899  -3.054
  490    HA   TYR  70           HA       TYR  70  22.475 -15.112  -5.672
  491   1HB   TYR  70          HB2       TYR  70  24.132 -15.559  -3.908
  492   2HB   TYR  70          HB3       TYR  70  23.755 -17.268  -3.996
  493    HD1  TYR  70           HD1      TYR  70  25.222 -18.640  -5.198
  494    HD2  TYR  70           HD2      TYR  70  24.946 -14.458  -6.227
  495    HE1  TYR  70           HE1      TYR  70  27.132 -18.903  -6.747
  496    HE2  TYR  70           HE2      TYR  70  26.854 -14.712  -7.774
  497    HH   TYR  70           HH       TYR  70  28.447 -16.166  -8.675
  498    H    GLU  71           H        GLU  71  21.496 -18.383  -4.507
  499    HA   GLU  71           HA       GLU  71  21.480 -19.536  -7.119
  500   1HB   GLU  71          HB2       GLU  71  19.966 -20.388  -4.612
  501   2HB   GLU  71          HB3       GLU  71  20.228 -21.356  -6.073
  502   1HG   GLU  71          HG2       GLU  71  22.757 -20.890  -5.628
  503   2HG   GLU  71          HG3       GLU  71  22.265 -20.452  -4.008
  504    H    ALA  72           H        ALA  72  18.788 -18.069  -5.116
  505    HA   ALA  72           HA       ALA  72  16.780 -18.722  -7.025
  506   1HB   ALA  72          HB1       ALA  72  16.283 -18.084  -4.679
  507   2HB   ALA  72          HB2       ALA  72  16.845 -16.422  -5.035
  508   3HB   ALA  72          HB3       ALA  72  15.401 -17.079  -5.843
  509    H    LEU  73           H        LEU  73  19.056 -15.973  -6.972
  510    HA   LEU  73           HA       LEU  73  17.741 -14.471  -9.058
  511   1HB   LEU  73          HB2       LEU  73  20.643 -14.775  -8.152
  512   2HB   LEU  73          HB3       LEU  73  20.163 -13.728  -9.461
  513    HG   LEU  73           HG       LEU  73  19.209 -13.510  -6.568
  514   1HD1  LEU  73          HD11      LEU  73  20.570 -11.519  -6.400
  515   2HD1  LEU  73          HD12      LEU  73  21.587 -12.874  -6.905
  516   3HD1  LEU  73          HD13      LEU  73  21.061 -11.655  -8.095
  517   1HD2  LEU  73          HD21      LEU  73  18.274 -11.309  -7.222
  518   2HD2  LEU  73          HD22      LEU  73  18.642 -11.670  -8.927
  519   3HD2  LEU  73          HD23      LEU  73  17.450 -12.635  -8.021
  520    H    GLN  74           H        GLN  74  20.514 -16.723  -9.283
  521    HA   GLN  74           HA       GLN  74  20.532 -17.064 -12.029
  522   1HB   GLN  74          HB2       GLN  74  21.399 -18.975  -9.810
  523   2HB   GLN  74          HB3       GLN  74  21.864 -19.123 -11.525
  524   1HG   GLN  74          HG2       GLN  74  22.870 -16.906 -11.462
  525   2HG   GLN  74          HG3       GLN  74  22.275 -16.654  -9.828
  526   1HE2  GLN  74          HE22      GLN  74  23.695 -16.856  -8.268
  527   2HE2  GLN  74          HE21      GLN  74  25.163 -17.789  -8.318
  528    H    GLU  75           H        GLU  75  18.453 -18.543  -9.773
  529    HA   GLU  75           HA       GLU  75  17.669 -20.787 -11.307
  530   1HB   GLU  75          HB2       GLU  75  17.293 -20.521  -8.871
  531   2HB   GLU  75          HB3       GLU  75  16.042 -19.324  -9.218
  532   1HG   GLU  75          HG2       GLU  75  14.670 -21.030 -10.325
  533   2HG   GLU  75          HG3       GLU  75  15.968 -22.216 -10.162
  534    H    GLN  76           H        GLN  76  16.562 -17.468 -11.361
  535    HA   GLN  76           HA       GLN  76  14.595 -18.135 -13.524
  536   1HB   GLN  76          HB2       GLN  76  13.346 -16.065 -12.607
  537   2HB   GLN  76          HB3       GLN  76  13.179 -17.608 -11.779
  538   1HG   GLN  76          HG2       GLN  76  14.446 -16.974  -9.960
  539   2HG   GLN  76          HG3       GLN  76  15.308 -15.698 -10.829
  540   1HE2  GLN  76          HE22      GLN  76  14.810 -14.564  -8.741
  541   2HE2  GLN  76          HE21      GLN  76  13.356 -13.568  -8.739
  542    H    LYS  77           H        LYS  77  17.107 -15.904 -12.505
  543    HA   LYS  77           HA       LYS  77  17.570 -13.767 -13.194
  544   1HB   LYS  77          HB2       LYS  77  18.361 -15.409 -15.594
  545   2HB   LYS  77          HB3       LYS  77  18.937 -13.782 -15.195
  546   1HG   LYS  77          HG2       LYS  77  19.529 -14.908 -12.867
  547   2HG   LYS  77          HG3       LYS  77  19.505 -16.399 -13.824
  548   1HD   LYS  77          HD2       LYS  77  21.202 -13.927 -14.298
  549   2HD   LYS  77          HD3       LYS  77  21.771 -15.433 -13.564
  550   1HE   LYS  77          HE2       LYS  77  21.235 -16.589 -15.721
  551   2HE   LYS  77          HE3       LYS  77  20.776 -15.031 -16.420
  552   1HZ   LYS  77          HZ1       LYS  77  23.093 -14.275 -15.929
  553   2HZ   LYS  77          HZ2       LYS  77  23.476 -15.798 -15.470
  554   3HZ   LYS  77          HZ3       LYS  77  23.033 -15.506 -17.009
  555    HA   PRO  78           HA       PRO  78  13.881 -12.572 -15.721
  556   1HB   PRO  78          HB2       PRO  78  13.054 -10.596 -13.902
  557   2HB   PRO  78          HB3       PRO  78  12.377 -12.226 -14.076
  558   1HG   PRO  78          HG2       PRO  78  14.177 -11.160 -11.965
  559   2HG   PRO  78          HG3       PRO  78  13.069 -12.550 -11.900
  560   1HD   PRO  78          HD2       PRO  78  15.900 -12.623 -12.231
  561   2HD   PRO  78          HD3       PRO  78  14.772 -13.984 -12.417
  562    H    ASP  79           H        ASP  79  13.449 -10.124 -16.259
  563    HA   ASP  79           HA       ASP  79  16.053  -8.731 -16.695
  564   1HB   ASP  79          HB2       ASP  79  14.695  -8.818 -18.672
  565   2HB   ASP  79          HB3       ASP  79  13.245  -8.329 -17.782
  566    H    LEU  80           H        LEU  80  16.623  -7.183 -15.278
  567    HA   LEU  80           HA       LEU  80  14.553  -5.946 -13.498
  568   1HB   LEU  80          HB2       LEU  80  17.449  -6.640 -13.005
  569   2HB   LEU  80          HB3       LEU  80  16.516  -5.657 -11.923
  570    HG   LEU  80           HG       LEU  80  16.851  -7.843 -11.033
  571   1HD1  LEU  80          HD11      LEU  80  14.896  -6.677 -10.263
  572   2HD1  LEU  80          HD12      LEU  80  13.953  -7.222 -11.672
  573   3HD1  LEU  80          HD13      LEU  80  14.488  -8.388 -10.453
  574   1HD2  LEU  80          HD21      LEU  80  14.981  -9.051 -13.061
  575   2HD2  LEU  80          HD22      LEU  80  16.735  -9.016 -13.305
  576   3HD2  LEU  80          HD23      LEU  80  16.064  -9.843 -11.890
  577    H    SER  81           H        SER  81  16.057  -5.028 -16.253
  578    HA   SER  81           HA       SER  81  17.655  -2.846 -15.611
  579   1HB   SER  81          HB2       SER  81  15.994  -3.469 -18.089
  580   2HB   SER  81          HB3       SER  81  17.505  -2.584 -17.962
  581    HG   SER  81           HG       SER  81  16.996  -5.307 -17.839
  582    H    ALA  82           H        ALA  82  14.404  -3.184 -15.021
  583    HA   ALA  82           HA       ALA  82  13.718  -0.325 -15.518
  584   1HB   ALA  82          HB1       ALA  82  12.166  -1.922 -16.563
  585   2HB   ALA  82          HB2       ALA  82  11.915  -2.727 -14.998
  586   3HB   ALA  82          HB3       ALA  82  11.373  -1.053 -15.236
  587    H    VAL  83           H        VAL  83  15.140  -2.200 -13.181
  588    HA   VAL  83           HA       VAL  83  14.075  -0.401 -11.085
  589    HB   VAL  83           HB       VAL  83  12.891  -2.341 -10.667
  590   1HG1  VAL  83          HG11      VAL  83  13.845  -4.595 -10.322
  591   2HG1  VAL  83          HG12      VAL  83  14.028  -4.032 -11.984
  592   3HG1  VAL  83          HG13      VAL  83  15.421  -3.989 -10.872
  593   1HG2  VAL  83          HG21      VAL  83  13.449  -3.059  -8.518
  594   2HG2  VAL  83          HG22      VAL  83  15.177  -2.738  -8.730
  595   3HG2  VAL  83          HG23      VAL  83  14.023  -1.400  -8.604
  596    H    ARG  84           H        ARG  84  15.489  -0.099  -9.245
  597    HA   ARG  84           HA       ARG  84  18.385  -0.411  -9.915
  598   1HB   ARG  84          HB2       ARG  84  18.790   1.494  -8.402
  599   2HB   ARG  84          HB3       ARG  84  17.957   1.958  -9.878
  600   1HG   ARG  84          HG2       ARG  84  15.985   2.514  -8.807
  601   2HG   ARG  84          HG3       ARG  84  16.249   1.431  -7.446
  602   1HD   ARG  84          HD2       ARG  84  16.469   3.905  -6.891
  603   2HD   ARG  84          HD3       ARG  84  17.793   2.858  -6.395
  604    HE   ARG  84           HE       ARG  84  19.224   3.861  -7.830
  605   1HH1  ARG  84          HH11      ARG  84  15.969   5.076  -8.643
  606   2HH1  ARG  84          HH12      ARG  84  16.525   6.087  -9.921
  607   1HH2  ARG  84          HH21      ARG  84  19.916   5.056  -9.565
  608   2HH2  ARG  84          HH22      ARG  84  18.873   6.170 -10.406
  609    H    PHE  85           H        PHE  85  19.708  -0.988  -8.136
  610    HA   PHE  85           HA       PHE  85  18.237  -1.824  -5.690
  611   1HB   PHE  85          HB2       PHE  85  19.334  -3.776  -5.380
  612   2HB   PHE  85          HB3       PHE  85  18.911  -3.831  -7.074
  613    HD1  PHE  85           HD1      PHE  85  20.761  -3.348  -8.806
  614    HD2  PHE  85           HD2      PHE  85  21.600  -3.967  -4.626
  615    HE1  PHE  85           HE1      PHE  85  23.042  -4.089  -9.378
  616    HE2  PHE  85           HE2      PHE  85  23.915  -4.647  -5.204
  617    HZ   PHE  85           HZ       PHE  85  24.632  -4.750  -7.572
  618    H    GLY  86           H        GLY  86  19.506  -1.595  -3.762
  619   1HA   GLY  86          HA2       GLY  86  22.102  -0.155  -4.045
  620   2HA   GLY  86          HA3       GLY  86  20.875   0.402  -2.903
  621    H    ALA  87           H        ALA  87  23.593  -1.492  -3.126
  622    HA   ALA  87           HA       ALA  87  22.785  -3.681  -1.318
  623   1HB   ALA  87          HB1       ALA  87  25.262  -4.217  -1.514
  624   2HB   ALA  87          HB2       ALA  87  24.384  -4.248  -3.053
  625   3HB   ALA  87          HB3       ALA  87  25.417  -2.861  -2.629
  626    H    ILE  88           H        ILE  88  23.302  -3.736   0.846
  627    HA   ILE  88           HA       ILE  88  24.590  -1.342   2.051
  628    HB   ILE  88           HB       ILE  88  21.935  -2.602   2.855
  629   1HG1  ILE  88          HG12      ILE  88  22.537  -0.038   1.345
  630   2HG1  ILE  88          HG13      ILE  88  21.522  -1.383   0.838
  631   1HG2  ILE  88          HG21      ILE  88  23.264  -1.698   4.749
  632   2HG2  ILE  88          HG22      ILE  88  23.314  -0.111   3.940
  633   3HG2  ILE  88          HG23      ILE  88  21.786  -0.814   4.492
  634   1HD1  ILE  88          HD11      ILE  88  20.141   0.506   1.437
  635   2HD1  ILE  88          HD12      ILE  88  19.866  -0.813   2.596
  636   3HD1  ILE  88          HD13      ILE  88  20.853   0.608   3.036
  637    H    GLY  89           H        GLY  89  26.155  -1.976   3.448
  638   1HA   GLY  89          HA2       GLY  89  27.132  -3.091   5.237
  639   2HA   GLY  89          HA3       GLY  89  25.768  -4.208   5.293
  640    H    ILE  90           H        ILE  90  26.643  -4.310   2.132
  641    HA   ILE  90           HA       ILE  90  27.671  -6.965   2.463
  642    HB   ILE  90           HB       ILE  90  27.337  -5.503  -0.156
  643   1HG1  ILE  90          HG12      ILE  90  25.237  -6.568   1.718
  644   2HG1  ILE  90          HG13      ILE  90  25.256  -5.081   0.795
  645   1HG2  ILE  90          HG21      ILE  90  28.492  -7.666  -0.141
  646   2HG2  ILE  90          HG22      ILE  90  27.083  -8.417   0.640
  647   3HG2  ILE  90          HG23      ILE  90  26.958  -7.756  -1.016
  648   1HD1  ILE  90          HD11      ILE  90  24.657  -7.863  -0.262
  649   2HD1  ILE  90          HD12      ILE  90  23.555  -6.487  -0.109
  650   3HD1  ILE  90          HD13      ILE  90  24.871  -6.435  -1.300
  651    H    GLY  91           H        GLY  91  29.511  -6.475   3.562
  652   1HA   GLY  91          HA2       GLY  91  31.504  -4.726   3.136
  653   2HA   GLY  91          HA3       GLY  91  31.740  -6.268   3.953
  654    H    SER  92           H        SER  92  31.180  -7.392   0.877
  655    HA   SER  92           HA       SER  92  33.974  -7.581   0.209
  656   1HB   SER  92          HB2       SER  92  31.569  -8.096  -1.534
  657   2HB   SER  92          HB3       SER  92  33.188  -8.798  -1.663
  658    HG   SER  92           HG       SER  92  31.224  -9.870  -0.510
  659    H    ARG  93           H        ARG  93  31.207  -5.613  -0.868
  660    HA   ARG  93           HA       ARG  93  30.935  -3.743  -2.031
  661   1HB   ARG  93          HB2       ARG  93  31.759  -2.829  -0.050
  662   2HB   ARG  93          HB3       ARG  93  33.431  -3.218  -0.431
  663   1HG   ARG  93          HG2       ARG  93  33.567  -1.471  -2.090
  664   2HG   ARG  93          HG3       ARG  93  31.842  -1.103  -1.936
  665   1HD   ARG  93          HD2       ARG  93  32.132  -0.286   0.318
  666   2HD   ARG  93          HD3       ARG  93  33.729  -1.019   0.452
  667    HE   ARG  93           HE       ARG  93  34.713   0.683  -0.730
  668   1HH1  ARG  93          HH11      ARG  93  31.148   1.308  -0.662
  669   2HH1  ARG  93          HH12      ARG  93  31.412   2.889  -1.383
  670   1HH2  ARG  93          HH21      ARG  93  34.835   2.813  -1.577
  671   2HH2  ARG  93          HH22      ARG  93  33.336   3.698  -1.868
  672    H    GLU  94           H        GLU  94  34.411  -4.069  -2.489
  673    HA   GLU  94           HA       GLU  94  34.323  -4.491  -5.289
  674   1HB   GLU  94          HB2       GLU  94  34.958  -1.676  -4.417
  675   2HB   GLU  94          HB3       GLU  94  35.652  -2.374  -5.880
  676   1HG   GLU  94          HG2       GLU  94  33.251  -2.808  -6.656
  677   2HG   GLU  94          HG3       GLU  94  32.743  -1.743  -5.332
  678    H    TYR  95           H        TYR  95  36.109  -3.048  -2.618
  679    HA   TYR  95           HA       TYR  95  38.493  -4.765  -3.100
  680   1HB   TYR  95          HB2       TYR  95  39.900  -2.740  -2.908
  681   2HB   TYR  95          HB3       TYR  95  38.821  -2.642  -4.283
  682    HD1  TYR  95           HD1      TYR  95  39.418  -1.369  -0.813
  683    HD2  TYR  95           HD2      TYR  95  37.155  -0.893  -4.454
  684    HE1  TYR  95           HE1      TYR  95  38.443   0.717   0.075
  685    HE2  TYR  95           HE2      TYR  95  36.151   1.188  -3.563
  686    HH   TYR  95           HH       TYR  95  36.993   2.490  -0.318
  687    H    ASP  96           H        ASP  96  36.179  -4.050  -0.839
  688    HA   ASP  96           HA       ASP  96  37.964  -3.211   1.344
  689   1HB   ASP  96          HB2       ASP  96  35.793  -2.075   0.924
  690   2HB   ASP  96          HB3       ASP  96  34.952  -3.568   1.338
  691    H    THR  97           H        THR  97  38.471  -5.770   0.309
  692    HA   THR  97           HA       THR  97  38.316  -7.450   2.636
  693    HB   THR  97           HB       THR  97  36.147  -8.057   1.733
  694    HG1  THR  97           HG1      THR  97  36.655 -10.042   2.082
  695   1HG2  THR  97          HG21      THR  97  37.537  -8.511  -0.936
  696   2HG2  THR  97          HG22      THR  97  35.871  -9.003  -0.546
  697   3HG2  THR  97          HG23      THR  97  36.301  -7.288  -0.585
  698    H    PHE  98           H        PHE  98  39.548  -9.508   2.086
  699    HA   PHE  98           HA       PHE  98  41.599  -9.118  -0.043
  700   1HB   PHE  98          HB2       PHE  98  42.012 -10.402   2.685
  701   2HB   PHE  98          HB3       PHE  98  43.217 -10.238   1.417
  702    HD1  PHE  98           HD1      PHE  98  41.628  -8.611   4.253
  703    HD2  PHE  98           HD2      PHE  98  43.991  -7.902   0.710
  704    HE1  PHE  98           HE1      PHE  98  42.302  -6.393   5.142
  705    HE2  PHE  98           HE2      PHE  98  44.661  -5.686   1.606
  706    HZ   PHE  98           HZ       PHE  98  43.818  -4.927   3.821
  707    H    CYS  99           H        CYS  99  38.848 -10.701   0.625
  708    HA   CYS  99           HA       CYS  99  39.723 -13.312  -0.495
  709   1HB   CYS  99          HB2       CYS  99  37.708 -12.809   1.751
  710   2HB   CYS  99          HB3       CYS  99  38.142 -14.385   1.081
  711    HG   CYS  99           HG       CYS  99  40.687 -14.277   1.727
  712    H    GLY 100           H        GLY 100  38.483 -10.847  -1.723
  713   1HA   GLY 100          HA2       GLY 100  36.507 -12.038  -3.382
  714   2HA   GLY 100          HA3       GLY 100  35.709 -11.104  -2.105
  715    H    ALA 101           H        ALA 101  34.985  -9.928  -4.085
  716    HA   ALA 101           HA       ALA 101  36.525  -7.481  -4.444
  717   1HB   ALA 101          HB1       ALA 101  35.636  -9.167  -6.842
  718   2HB   ALA 101          HB2       ALA 101  36.339  -7.529  -6.908
  719   3HB   ALA 101          HB3       ALA 101  37.317  -8.886  -6.339
  720    H    ILE 102           H        ILE 102  34.280  -7.219  -6.777
  721    HA   ILE 102           HA       ILE 102  32.169  -6.167  -5.118
  722    HB   ILE 102           HB       ILE 102  32.572  -5.373  -7.380
  723   1HG1  ILE 102          HG12      ILE 102  29.836  -6.686  -7.235
  724   2HG1  ILE 102          HG13      ILE 102  30.316  -5.288  -6.262
  725   1HG2  ILE 102          HG21      ILE 102  33.267  -7.502  -8.489
  726   2HG2  ILE 102          HG22      ILE 102  31.587  -8.069  -8.414
  727   3HG2  ILE 102          HG23      ILE 102  32.018  -6.655  -9.392
  728   1HD1  ILE 102          HD11      ILE 102  30.089  -5.389  -9.288
  729   2HD1  ILE 102          HD12      ILE 102  29.106  -4.466  -8.135
  730   3HD1  ILE 102          HD13      ILE 102  30.804  -4.030  -8.382
  731    H    ASP 103           H        ASP 103  30.188  -7.195  -4.440
  732    HA   ASP 103           HA       ASP 103  30.721  -9.856  -3.686
  733   1HB   ASP 103          HB2       ASP 103  29.271  -8.091  -2.489
  734   2HB   ASP 103          HB3       ASP 103  27.959  -8.817  -3.441
  735    H    LYS 104           H        LYS 104  29.700 -11.841  -3.965
  736    HA   LYS 104           HA       LYS 104  29.020 -12.601  -6.651
  737   1HB   LYS 104          HB2       LYS 104  28.492 -13.854  -3.908
  738   2HB   LYS 104          HB3       LYS 104  28.155 -14.654  -5.439
  739   1HG   LYS 104          HG2       LYS 104  30.510 -14.558  -6.035
  740   2HG   LYS 104          HG3       LYS 104  30.906 -13.659  -4.576
  741   1HD   LYS 104          HD2       LYS 104  31.550 -15.980  -4.331
  742   2HD   LYS 104          HD3       LYS 104  30.295 -15.554  -3.162
  743   1HE   LYS 104          HE2       LYS 104  28.589 -16.697  -4.481
  744   2HE   LYS 104          HE3       LYS 104  29.734 -16.984  -5.800
  745   1HZ   LYS 104          HZ1       LYS 104  29.406 -18.922  -4.321
  746   2HZ   LYS 104          HZ2       LYS 104  30.967 -18.457  -4.390
  747   3HZ   LYS 104          HZ3       LYS 104  30.077 -18.094  -3.068
  748    H    LEU 105           H        LEU 105  27.169 -11.609  -3.765
  749    HA   LEU 105           HA       LEU 105  24.533 -11.820  -4.817
  750   1HB   LEU 105          HB2       LEU 105  25.129 -11.479  -2.448
  751   2HB   LEU 105          HB3       LEU 105  25.780  -9.897  -2.789
  752    HG   LEU 105           HG       LEU 105  23.563  -9.908  -1.686
  753   1HD1  LEU 105          HD11      LEU 105  23.301  -8.538  -4.371
  754   2HD1  LEU 105          HD12      LEU 105  22.641  -8.064  -2.804
  755   3HD1  LEU 105          HD13      LEU 105  24.384  -7.962  -3.086
  756   1HD2  LEU 105          HD21      LEU 105  22.419 -10.817  -4.363
  757   2HD2  LEU 105          HD22      LEU 105  22.575 -11.846  -2.924
  758   3HD2  LEU 105          HD23      LEU 105  21.532 -10.416  -2.881
  759    H    GLU 106           H        GLU 106  26.898  -9.022  -4.758
  760    HA   GLU 106           HA       GLU 106  24.948  -7.299  -6.028
  761   1HB   GLU 106          HB2       GLU 106  27.997  -7.068  -5.944
  762   2HB   GLU 106          HB3       GLU 106  26.902  -5.784  -6.432
  763   1HG   GLU 106          HG2       GLU 106  25.906  -5.679  -4.247
  764   2HG   GLU 106          HG3       GLU 106  26.811  -7.034  -3.653
  765    H    ALA 107           H        ALA 107  27.582  -9.321  -7.263
  766    HA   ALA 107           HA       ALA 107  27.617  -8.414  -9.934
  767   1HB   ALA 107          HB1       ALA 107  29.381  -9.837  -8.974
  768   2HB   ALA 107          HB2       ALA 107  28.236 -11.191  -8.823
  769   3HB   ALA 107          HB3       ALA 107  28.697 -10.588 -10.428
  770    H    GLU 108           H        GLU 108  25.689 -11.169  -8.444
  771    HA   GLU 108           HA       GLU 108  24.478 -11.788 -10.943
  772   1HB   GLU 108          HB2       GLU 108  23.894 -12.448  -8.068
  773   2HB   GLU 108          HB3       GLU 108  22.650 -12.735  -9.275
  774   1HG   GLU 108          HG2       GLU 108  25.434 -13.920  -9.343
  775   2HG   GLU 108          HG3       GLU 108  23.935 -14.745  -8.910
  776    H    LEU 109           H        LEU 109  23.546  -9.375  -8.436
  777    HA   LEU 109           HA       LEU 109  20.954  -8.896  -9.607
  778   1HB   LEU 109          HB2       LEU 109  22.761  -7.154  -7.884
  779   2HB   LEU 109          HB3       LEU 109  21.162  -6.646  -8.418
  780    HG   LEU 109           HG       LEU 109  21.718  -9.105  -6.704
  781   1HD1  LEU 109          HD11      LEU 109  22.092  -6.932  -5.537
  782   2HD1  LEU 109          HD12      LEU 109  20.436  -6.447  -5.951
  783   3HD1  LEU 109          HD13      LEU 109  20.719  -7.841  -4.884
  784   1HD2  LEU 109          HD21      LEU 109  19.103  -7.826  -7.614
  785   2HD2  LEU 109          HD22      LEU 109  19.686  -9.461  -8.004
  786   3HD2  LEU 109          HD23      LEU 109  19.241  -9.063  -6.348
  787    H    LYS 110           H        LYS 110  24.166  -7.412 -10.227
  788    HA   LYS 110           HA       LYS 110  23.186  -5.448 -12.072
  789   1HB   LYS 110          HB2       LYS 110  25.928  -6.768 -11.806
  790   2HB   LYS 110          HB3       LYS 110  25.582  -5.310 -12.753
  791   1HG   LYS 110          HG2       LYS 110  25.024  -4.040 -10.778
  792   2HG   LYS 110          HG3       LYS 110  24.986  -5.458  -9.781
  793   1HD   LYS 110          HD2       LYS 110  26.993  -4.803  -9.108
  794   2HD   LYS 110          HD3       LYS 110  27.555  -5.702 -10.498
  795   1HE   LYS 110          HE2       LYS 110  26.999  -2.690 -10.442
  796   2HE   LYS 110          HE3       LYS 110  28.584  -3.421 -10.217
  797   1HZ   LYS 110          HZ1       LYS 110  28.343  -2.697 -12.469
  798   2HZ   LYS 110          HZ2       LYS 110  28.422  -4.321 -12.480
  799   3HZ   LYS 110          HZ3       LYS 110  26.986  -3.557 -12.707
  800    H    ASN 111           H        ASN 111  24.317  -8.818 -12.426
  801    HA   ASN 111           HA       ASN 111  24.194  -8.934 -15.279
  802   1HB   ASN 111          HB2       ASN 111  25.422 -10.662 -14.599
  803   2HB   ASN 111          HB3       ASN 111  24.804 -10.653 -13.000
  804   1HD2  ASN 111          HD21      ASN 111  22.742 -11.655 -12.491
  805   2HD2  ASN 111          HD22      ASN 111  22.694 -13.273 -13.055
  806    H    SER 112           H        SER 112  21.756  -9.365 -12.719
  807    HA   SER 112           HA       SER 112  19.771 -10.473 -14.493
  808   1HB   SER 112          HB2       SER 112  19.357  -9.145 -11.813
  809   2HB   SER 112          HB3       SER 112  18.270 -10.262 -12.663
  810    HG   SER 112           HG       SER 112  20.805 -10.871 -11.562
  811    H    GLY 113           H        GLY 113  20.820  -7.217 -13.547
  812   1HA   GLY 113          HA2       GLY 113  20.602  -5.772 -15.589
  813   2HA   GLY 113          HA3       GLY 113  18.861  -6.034 -15.476
  814    H    ALA 114           H        ALA 114  19.484  -5.905 -12.281
  815    HA   ALA 114           HA       ALA 114  18.375  -3.277 -12.155
  816   1HB   ALA 114          HB1       ALA 114  17.831  -4.905 -10.395
  817   2HB   ALA 114          HB2       ALA 114  19.543  -4.998  -9.927
  818   3HB   ALA 114          HB3       ALA 114  18.617  -3.484  -9.717
  819    H    LYS 115           H        LYS 115  19.361  -1.313 -11.624
  820    HA   LYS 115           HA       LYS 115  22.267  -1.304 -12.216
  821   1HB   LYS 115          HB2       LYS 115  22.039   1.156 -12.347
  822   2HB   LYS 115          HB3       LYS 115  21.094   0.254 -13.528
  823   1HG   LYS 115          HG2       LYS 115  19.034   0.647 -12.215
  824   2HG   LYS 115          HG3       LYS 115  19.973   1.561 -11.014
  825   1HD   LYS 115          HD2       LYS 115  20.588   3.230 -12.650
  826   2HD   LYS 115          HD3       LYS 115  19.861   2.313 -13.971
  827   1HE   LYS 115          HE2       LYS 115  18.297   3.422 -11.594
  828   2HE   LYS 115          HE3       LYS 115  18.517   4.284 -13.118
  829   1HZ   LYS 115          HZ1       LYS 115  16.421   3.097 -13.091
  830   2HZ   LYS 115          HZ2       LYS 115  17.374   2.502 -14.266
  831   3HZ   LYS 115          HZ3       LYS 115  17.163   1.654 -12.882
  832    H    GLN 116           H        GLN 116  23.762  -1.146 -10.649
  833    HA   GLN 116           HA       GLN 116  22.926  -0.694  -7.880
  834   1HB   GLN 116          HB2       GLN 116  24.742  -2.315  -8.501
  835   2HB   GLN 116          HB3       GLN 116  25.749  -0.943  -8.943
  836   1HG   GLN 116          HG2       GLN 116  25.691  -0.055  -6.693
  837   2HG   GLN 116          HG3       GLN 116  24.384  -1.147  -6.230
  838   1HE2  GLN 116          HE22      GLN 116  26.194  -1.241  -4.440
  839   2HE2  GLN 116          HE21      GLN 116  27.137  -2.716  -4.545
  840    H    THR 117           H        THR 117  22.219   1.396  -7.623
  841    HA   THR 117           HA       THR 117  23.531   3.643  -9.002
  842    HB   THR 117           HB       THR 117  21.472   3.576  -6.767
  843    HG1  THR 117           HG1      THR 117  21.105   2.603  -9.011
  844   1HG2  THR 117          HG21      THR 117  20.849   5.828  -7.535
  845   2HG2  THR 117          HG22      THR 117  22.547   5.829  -7.051
  846   3HG2  THR 117          HG23      THR 117  22.127   5.780  -8.775
  847    H    GLY 118           H        GLY 118  24.841   5.228  -7.933
  848   1HA   GLY 118          HA2       GLY 118  26.317   6.079  -6.404
  849   2HA   GLY 118          HA3       GLY 118  25.410   5.235  -5.146
  850    H    GLU 119           H        GLU 119  26.465   3.675  -4.102
  851    HA   GLU 119           HA       GLU 119  28.255   1.785  -5.324
  852   1HB   GLU 119          HB2       GLU 119  30.256   2.351  -4.058
  853   2HB   GLU 119          HB3       GLU 119  29.777   3.756  -4.998
  854   1HG   GLU 119          HG2       GLU 119  28.584   4.606  -2.875
  855   2HG   GLU 119          HG3       GLU 119  29.498   3.319  -2.072
  856    H    THR 120           H        THR 120  29.008   0.211  -3.464
  857    HA   THR 120           HA       THR 120  26.853  -0.638  -1.924
  858    HB   THR 120           HB       THR 120  29.753  -1.054  -1.173
  859    HG1  THR 120           HG1      THR 120  28.637  -2.753  -3.069
  860   1HG2  THR 120          HG21      THR 120  28.211  -2.165   0.302
  861   2HG2  THR 120          HG22      THR 120  27.305  -2.850  -1.064
  862   3HG2  THR 120          HG23      THR 120  28.966  -3.382  -0.740
  863    H    LEU 121           H        LEU 121  26.005  -0.030  -0.052
  864    HA   LEU 121           HA       LEU 121  27.061   2.255   1.471
  865   1HB   LEU 121          HB2       LEU 121  24.526   1.359   0.686
  866   2HB   LEU 121          HB3       LEU 121  24.607   0.808   2.351
  867    HG   LEU 121           HG       LEU 121  25.024   3.632   1.388
  868   1HD1  LEU 121          HD11      LEU 121  22.803   4.137   2.246
  869   2HD1  LEU 121          HD12      LEU 121  22.713   2.863   1.026
  870   3HD1  LEU 121          HD13      LEU 121  22.584   2.444   2.751
  871   1HD2  LEU 121          HD21      LEU 121  24.617   4.244   3.820
  872   2HD2  LEU 121          HD22      LEU 121  24.759   2.529   4.213
  873   3HD2  LEU 121          HD23      LEU 121  26.143   3.431   3.522
  874    H    LYS 122           H        LYS 122  27.126   1.961   3.915
  875    HA   LYS 122           HA       LYS 122  27.524  -0.796   4.882
  876   1HB   LYS 122          HB2       LYS 122  29.536   1.478   5.212
  877   2HB   LYS 122          HB3       LYS 122  29.546  -0.014   6.149
  878   1HG   LYS 122          HG2       LYS 122  29.822  -1.294   4.027
  879   2HG   LYS 122          HG3       LYS 122  29.862   0.217   3.118
  880   1HD   LYS 122          HD2       LYS 122  32.112  -0.552   3.375
  881   2HD   LYS 122          HD3       LYS 122  31.910   0.905   4.364
  882   1HE   LYS 122          HE2       LYS 122  31.654  -0.485   6.390
  883   2HE   LYS 122          HE3       LYS 122  31.722  -1.958   5.412
  884   1HZ   LYS 122          HZ1       LYS 122  33.960  -0.040   5.645
  885   2HZ   LYS 122          HZ2       LYS 122  33.805  -1.408   6.525
  886   3HZ   LYS 122          HZ3       LYS 122  34.000  -1.507   4.891
  887    H    ILE 123           H        ILE 123  27.063  -0.876   7.206
  888    HA   ILE 123           HA       ILE 123  25.931   1.575   8.386
  889    HB   ILE 123           HB       ILE 123  23.888   0.515   9.053
  890   1HG1  ILE 123          HG12      ILE 123  24.292  -1.798   9.278
  891   2HG1  ILE 123          HG13      ILE 123  23.026  -1.585   8.085
  892   1HG2  ILE 123          HG21      ILE 123  22.669   0.502   6.986
  893   2HG2  ILE 123          HG22      ILE 123  23.881   1.791   6.987
  894   3HG2  ILE 123          HG23      ILE 123  24.170   0.314   6.051
  895   1HD1  ILE 123          HD11      ILE 123  24.381  -3.354   7.310
  896   2HD1  ILE 123          HD12      ILE 123  24.805  -1.965   6.290
  897   3HD1  ILE 123          HD13      ILE 123  25.879  -2.465   7.610
  898    H    ASN 124           H        ASN 124  25.583   1.408  10.706
  899    HA   ASN 124           HA       ASN 124  26.090  -0.944  12.109
  900   1HB   ASN 124          HB2       ASN 124  28.555   0.179  11.464
  901   2HB   ASN 124          HB3       ASN 124  28.220   0.970  13.003
  902   1HD2  ASN 124          HD22      ASN 124  27.839  -2.254  11.444
  903   2HD2  ASN 124          HD21      ASN 124  28.066  -3.187  12.909
  904    H    ILE 125           H        ILE 125  26.208  -0.392  14.596
  905    HA   ILE 125           HA       ILE 125  24.405   1.943  15.090
  906    HB   ILE 125           HB       ILE 125  24.117  -0.895  16.142
  907   1HG1  ILE 125          HG12      ILE 125  23.319  -0.727  13.818
  908   2HG1  ILE 125          HG13      ILE 125  22.037  -1.060  14.958
  909   1HG2  ILE 125          HG21      ILE 125  22.498   1.605  16.778
  910   2HG2  ILE 125          HG22      ILE 125  22.000  -0.051  17.187
  911   3HG2  ILE 125          HG23      ILE 125  23.464   0.628  17.899
  912   1HD1  ILE 125          HD11      ILE 125  21.330   0.527  13.218
  913   2HD1  ILE 125          HD12      ILE 125  21.230   1.261  14.822
  914   3HD1  ILE 125          HD13      ILE 125  22.571   1.682  13.732
  915    H    LEU 126           H        LEU 126  26.294  -0.601  16.893
  916    HA   LEU 126           HA       LEU 126  27.985   1.411  18.090
  917   1HB   LEU 126          HB2       LEU 126  26.019   1.717  19.543
  918   2HB   LEU 126          HB3       LEU 126  25.917  -0.016  19.829
  919    HG   LEU 126           HG       LEU 126  28.091   0.036  21.028
  920   1HD1  LEU 126          HD11      LEU 126  29.094   2.230  21.660
  921   2HD1  LEU 126          HD12      LEU 126  29.222   1.919  19.930
  922   3HD1  LEU 126          HD13      LEU 126  27.987   3.047  20.533
  923   1HD2  LEU 126          HD21      LEU 126  26.094   2.103  22.034
  924   2HD2  LEU 126          HD22      LEU 126  25.983   0.344  22.261
  925   3HD2  LEU 126          HD23      LEU 126  27.307   1.247  23.012
  926    H    ASP 127           H        ASP 127  26.655  -1.902  18.741
  927    HA   ASP 127           HA       ASP 127  29.257  -3.052  19.297
  928   1HB   ASP 127          HB2       ASP 127  27.241  -4.075  20.199
  929   2HB   ASP 127          HB3       ASP 127  26.573  -4.295  18.577
  930    H    HIS 128           H        HIS 128  30.734  -3.778  17.827
  931    HA   HIS 128           HA       HIS 128  30.500  -2.917  15.110
  932   1HB   HIS 128          HB2       HIS 128  32.577  -4.556  16.614
  933   2HB   HIS 128          HB3       HIS 128  32.738  -4.146  14.914
  934    HD1  HIS 128           HD1      HIS 128  34.368  -2.187  14.643
  935    HD2  HIS 128           HD2      HIS 128  31.915  -1.899  18.068
  936    HE1  HIS 128           HE1      HIS 128  34.968   0.004  15.787
  937    H    ASP 129           H        ASP 129  31.040  -4.362  13.220
  938    HA   ASP 129           HA       ASP 129  30.114  -7.101  13.287
  939   1HB   ASP 129          HB2       ASP 129  28.701  -5.062  11.524
  940   2HB   ASP 129          HB3       ASP 129  28.446  -6.795  11.491
  941    H    ILE 130           H        ILE 130  29.928  -7.394  10.523
  942    HA   ILE 130           HA       ILE 130  32.619  -7.351   9.578
  943    HB   ILE 130           HB       ILE 130  29.915  -7.934   8.376
  944   1HG1  ILE 130          HG12      ILE 130  30.947 -10.132   7.899
  945   2HG1  ILE 130          HG13      ILE 130  32.473  -9.586   8.591
  946   1HG2  ILE 130          HG21      ILE 130  32.500  -7.715   6.803
  947   2HG2  ILE 130          HG22      ILE 130  31.048  -8.567   6.221
  948   3HG2  ILE 130          HG23      ILE 130  30.987  -6.830   6.498
  949   1HD1  ILE 130          HD11      ILE 130  31.128 -11.072  10.079
  950   2HD1  ILE 130          HD12      ILE 130  31.477  -9.507  10.821
  951   3HD1  ILE 130          HD13      ILE 130  29.858  -9.835  10.142
  952    HA   PRO 131           HA       PRO 131  31.539  -3.537   6.942
  953   1HB   PRO 131          HB2       PRO 131  29.361  -1.932   7.532
  954   2HB   PRO 131          HB3       PRO 131  29.307  -3.322   6.400
  955   1HG   PRO 131          HG2       PRO 131  28.594  -3.311   9.363
  956   2HG   PRO 131          HG3       PRO 131  27.611  -3.909   8.016
  957   1HD   PRO 131          HD2       PRO 131  29.052  -5.633   9.391
  958   2HD   PRO 131          HD3       PRO 131  29.101  -5.733   7.615
  959    H    GLU 132           H        GLU 132  30.254  -2.987  10.195
  960    HA   GLU 132           HA       GLU 132  30.677  -1.488  11.821
  961   1HB   GLU 132          HB2       GLU 132  32.877  -1.544  12.782
  962   2HB   GLU 132          HB3       GLU 132  32.281  -3.124  12.343
  963   1HG   GLU 132          HG2       GLU 132  33.730  -3.145  10.331
  964   2HG   GLU 132          HG3       GLU 132  34.336  -1.537  10.739
  965    H    ASP 133           H        ASP 133  30.173  -0.058   9.454
  966    HA   ASP 133           HA       ASP 133  31.367   2.507  10.298
  967   1HB   ASP 133          HB2       ASP 133  32.842   1.828   8.496
  968   2HB   ASP 133          HB3       ASP 133  31.468   1.506   7.437
  969    HA   PRO 134           HA       PRO 134  26.846   3.030   9.887
  970   1HB   PRO 134          HB2       PRO 134  27.720   5.833  10.585
  971   2HB   PRO 134          HB3       PRO 134  26.295   4.916  11.170
  972   1HG   PRO 134          HG2       PRO 134  28.504   5.114  12.721
  973   2HG   PRO 134          HG3       PRO 134  27.668   3.533  12.561
  974   1HD   PRO 134          HD2       PRO 134  30.161   4.494  11.140
  975   2HD   PRO 134          HD3       PRO 134  29.823   2.901  11.883
  976    H    ALA 135           H        ALA 135  29.336   4.935   8.247
  977    HA   ALA 135           HA       ALA 135  29.311   6.377   6.491
  978   1HB   ALA 135          HB1       ALA 135  28.045   3.903   5.276
  979   2HB   ALA 135          HB2       ALA 135  29.103   5.066   4.468
  980   3HB   ALA 135          HB3       ALA 135  29.752   4.039   5.754
  981    H    GLU 136           H        GLU 136  27.038   7.257   7.896
  982    HA   GLU 136           HA       GLU 136  24.616   7.024   6.555
  983   1HB   GLU 136          HB2       GLU 136  23.812   8.822   7.967
  984   2HB   GLU 136          HB3       GLU 136  24.821   7.703   8.881
  985   1HG   GLU 136          HG2       GLU 136  26.725   9.303   8.741
  986   2HG   GLU 136          HG3       GLU 136  25.718  10.423   7.820
  987    H    GLU 137           H        GLU 137  27.256   9.153   5.696
  988    HA   GLU 137           HA       GLU 137  25.841  11.187   4.285
  989   1HB   GLU 137          HB2       GLU 137  28.601   9.990   3.720
  990   2HB   GLU 137          HB3       GLU 137  27.965  11.493   3.074
  991   1HG   GLU 137          HG2       GLU 137  29.374  12.165   4.797
  992   2HG   GLU 137          HG3       GLU 137  27.745  12.372   5.427
  993    H    TRP 138           H        TRP 138  26.561   7.822   3.410
  994    HA   TRP 138           HA       TRP 138  26.197   8.056   0.585
  995   1HB   TRP 138          HB2       TRP 138  25.846   5.814   2.581
  996   2HB   TRP 138          HB3       TRP 138  25.325   5.662   0.919
  997    HD1  TRP 138           HD1      TRP 138  26.729   4.151  -0.289
  998    HE1  TRP 138           HE1      TRP 138  29.159   3.556  -0.492
  999    HE3  TRP 138           HE3      TRP 138  28.653   7.582   3.027
 1000    HZ2  TRP 138           HZ2      TRP 138  31.705   4.466   0.636
 1001    HZ3  TRP 138           HZ3      TRP 138  31.086   7.694   3.418
 1002    HH2  TRP 138           HH2      TRP 138  32.626   6.139   2.235
 1003    H    LEU 139           H        LEU 139  23.889   7.679   3.335
 1004    HA   LEU 139           HA       LEU 139  21.697   6.729   1.802
 1005   1HB   LEU 139          HB2       LEU 139  22.258   6.888   4.424
 1006   2HB   LEU 139          HB3       LEU 139  21.458   8.411   4.342
 1007    HG   LEU 139           HG       LEU 139  19.909   6.782   5.117
 1008   1HD1  LEU 139          HD11      LEU 139  19.118   8.566   3.537
 1009   2HD1  LEU 139          HD12      LEU 139  19.152   7.356   2.236
 1010   3HD1  LEU 139          HD13      LEU 139  18.066   7.141   3.625
 1011   1HD2  LEU 139          HD21      LEU 139  19.215   4.804   3.910
 1012   2HD2  LEU 139          HD22      LEU 139  20.291   5.175   2.552
 1013   3HD2  LEU 139          HD23      LEU 139  20.966   4.750   4.141
 1014    H    GLY 140           H        GLY 140  22.447   9.886   3.187
 1015   1HA   GLY 140          HA2       GLY 140  20.458  11.468   1.985
 1016   2HA   GLY 140          HA3       GLY 140  22.055  12.060   2.484
 1017    H    SER 141           H        SER 141  23.839  10.791   0.702
 1018    HA   SER 141           HA       SER 141  23.689  12.375  -1.552
 1019   1HB   SER 141          HB2       SER 141  25.129   9.811  -0.697
 1020   2HB   SER 141          HB3       SER 141  25.487  10.663  -2.153
 1021    HG   SER 141           HG       SER 141  25.891  11.358   0.515
 1022    H    TRP 142           H        TRP 142  23.237   8.819  -1.272
 1023    HA   TRP 142           HA       TRP 142  22.477   8.271  -3.910
 1024   1HB   TRP 142          HB2       TRP 142  23.109   6.541  -2.387
 1025   2HB   TRP 142          HB3       TRP 142  21.813   6.962  -1.281
 1026    HD1  TRP 142           HD1      TRP 142  22.108   5.550  -4.872
 1027    HE1  TRP 142           HE1      TRP 142  20.116   3.980  -5.292
 1028    HE3  TRP 142           HE3      TRP 142  19.731   6.124  -0.394
 1029    HZ2  TRP 142           HZ2      TRP 142  17.787   3.041  -3.806
 1030    HZ3  TRP 142           HZ3      TRP 142  17.696   4.832   0.113
 1031    HH2  TRP 142           HH2      TRP 142  16.671   3.334  -1.597
 1032    H    VAL 143           H        VAL 143  20.367   9.180  -1.123
 1033    HA   VAL 143           HA       VAL 143  17.905   9.103  -2.539
 1034    HB   VAL 143           HB       VAL 143  18.907  10.540  -0.077
 1035   1HG1  VAL 143          HG11      VAL 143  17.300  12.136  -0.999
 1036   2HG1  VAL 143          HG12      VAL 143  16.103  10.829  -1.210
 1037   3HG1  VAL 143          HG13      VAL 143  16.640  11.332   0.416
 1038   1HG2  VAL 143          HG21      VAL 143  17.329   9.051   1.047
 1039   2HG2  VAL 143          HG22      VAL 143  16.715   8.461  -0.516
 1040   3HG2  VAL 143          HG23      VAL 143  18.372   8.097  -0.012
 1041    H    ASN 144           H        ASN 144  20.220  11.881  -2.116
 1042    HA   ASN 144           HA       ASN 144  18.724  13.688  -3.693
 1043   1HB   ASN 144          HB2       ASN 144  21.759  13.557  -3.439
 1044   2HB   ASN 144          HB3       ASN 144  20.837  14.936  -4.002
 1045   1HD2  ASN 144          HD22      ASN 144  22.718  14.605  -1.670
 1046   2HD2  ASN 144          HD21      ASN 144  21.809  15.053  -0.259
 1047    H    LEU 145           H        LEU 145  20.889  11.076  -4.619
 1048    HA   LEU 145           HA       LEU 145  21.275  11.968  -7.345
 1049   1HB   LEU 145          HB2       LEU 145  22.168   9.688  -5.660
 1050   2HB   LEU 145          HB3       LEU 145  21.858   9.251  -7.331
 1051    HG   LEU 145           HG       LEU 145  23.365  11.031  -8.125
 1052   1HD1  LEU 145          HD11      LEU 145  23.229  12.614  -6.206
 1053   2HD1  LEU 145          HD12      LEU 145  24.083  11.440  -5.188
 1054   3HD1  LEU 145          HD13      LEU 145  24.899  12.176  -6.582
 1055   1HD2  LEU 145          HD21      LEU 145  25.462   9.917  -7.446
 1056   2HD2  LEU 145          HD22      LEU 145  24.616   9.123  -6.097
 1057   3HD2  LEU 145          HD23      LEU 145  24.189   8.732  -7.777
 1058    H    LEU 146           H        LEU 146  19.224   9.414  -5.780
 1059    HA   LEU 146           HA       LEU 146  18.095   8.593  -8.268
 1060   1HB   LEU 146          HB2       LEU 146  16.845   7.125  -7.044
 1061   2HB   LEU 146          HB3       LEU 146  18.368   7.218  -6.202
 1062    HG   LEU 146           HG       LEU 146  16.945   8.936  -4.672
 1063   1HD1  LEU 146          HD11      LEU 146  14.634   8.087  -4.356
 1064   2HD1  LEU 146          HD12      LEU 146  14.818   8.783  -5.961
 1065   3HD1  LEU 146          HD13      LEU 146  14.824   7.023  -5.757
 1066   1HD2  LEU 146          HD21      LEU 146  16.452   7.046  -3.166
 1067   2HD2  LEU 146          HD22      LEU 146  16.740   5.906  -4.500
 1068   3HD2  LEU 146          HD23      LEU 146  18.064   6.912  -3.875
 1069    H    LYS 147           H        LYS 147  17.151  10.962  -5.833
 1070    HA   LYS 147           HA       LYS 147  14.544  11.575  -6.744
 1071   1HB   LYS 147          HB2       LYS 147  16.701  13.054  -5.207
 1072   2HB   LYS 147          HB3       LYS 147  15.275  13.929  -5.782
 1073   1HG   LYS 147          HG2       LYS 147  13.778  12.305  -4.667
 1074   2HG   LYS 147          HG3       LYS 147  15.181  11.427  -4.041
 1075   1HD   LYS 147          HD2       LYS 147  15.856  13.410  -2.739
 1076   2HD   LYS 147          HD3       LYS 147  14.505  14.342  -3.422
 1077   1HE   LYS 147          HE2       LYS 147  12.941  12.686  -2.451
 1078   2HE   LYS 147          HE3       LYS 147  14.287  11.807  -1.730
 1079   1HZ   LYS 147          HZ1       LYS 147  14.777  13.852  -0.443
 1080   2HZ   LYS 147          HZ2       LYS 147  13.427  14.557  -1.045
 1081   3HZ   LYS 147          HZ3       LYS 147  13.308  13.213  -0.110
  Start of MODEL   17
    1   1H    MET   1          H1        MET   1   1.996  -2.859   1.587
    2   2H    MET   1          H2        MET   1   3.561  -2.539   2.003
    3   3H    MET   1          H3        MET   1   2.370  -1.518   2.469
    4    HA   MET   1           HA       MET   1   3.187  -2.050  -0.292
    5   1HB   MET   1          HB2       MET   1   0.808  -1.413  -0.131
    6   2HB   MET   1          HB3       MET   1   1.238   0.044   0.777
    7   1HG   MET   1          HG2       MET   1   0.806   0.500  -1.613
    8   2HG   MET   1          HG3       MET   1   2.437   0.949  -1.133
    9   1HE   MET   1          HE1       MET   1   3.079  -0.023  -4.824
   10   2HE   MET   1          HE2       MET   1   1.718   0.885  -4.127
   11   3HE   MET   1          HE3       MET   1   3.373   1.160  -3.531
   12    H    ALA   2           H        ALA   2   4.838  -0.790  -1.115
   13    HA   ALA   2           HA       ALA   2   6.026   1.355   0.493
   14   1HB   ALA   2          HB1       ALA   2   6.939  -0.686   1.546
   15   2HB   ALA   2          HB2       ALA   2   7.365  -1.339  -0.047
   16   3HB   ALA   2          HB3       ALA   2   8.202   0.090   0.573
   17    H    ASP   3           H        ASP   3   7.963   2.206  -0.651
   18    HA   ASP   3           HA       ASP   3   7.843   1.966  -3.600
   19   1HB   ASP   3          HB2       ASP   3   7.697   4.255  -2.455
   20   2HB   ASP   3          HB3       ASP   3   9.319   3.961  -1.856
   21    H    ILE   4           H        ILE   4   9.778   1.294  -0.749
   22    HA   ILE   4           HA       ILE   4  11.977   0.236  -2.456
   23    HB   ILE   4           HB       ILE   4  12.313   1.506   0.282
   24   1HG1  ILE   4          HG12      ILE   4  12.980   2.806  -2.386
   25   2HG1  ILE   4          HG13      ILE   4  11.617   3.268  -1.367
   26   1HG2  ILE   4          HG21      ILE   4  14.714   1.421  -0.286
   27   2HG2  ILE   4          HG22      ILE   4  14.000  -0.181  -0.354
   28   3HG2  ILE   4          HG23      ILE   4  14.320   0.692  -1.861
   29   1HD1  ILE   4          HD11      ILE   4  13.356   4.859  -1.035
   30   2HD1  ILE   4          HD12      ILE   4  13.197   3.905   0.448
   31   3HD1  ILE   4          HD13      ILE   4  14.545   3.607  -0.670
   32    H    THR   5           H        THR   5  12.218  -1.916  -2.164
   33    HA   THR   5           HA       THR   5  11.124  -3.224   0.258
   34    HB   THR   5           HB       THR   5  10.657  -4.292  -1.979
   35    HG1  THR   5           HG1      THR   5  10.762  -5.703  -0.351
   36   1HG2  THR   5          HG21      THR   5  12.356  -5.346  -3.297
   37   2HG2  THR   5          HG22      THR   5  12.632  -3.603  -3.245
   38   3HG2  THR   5          HG23      THR   5  13.644  -4.694  -2.271
   39    H    LEU   6           H        LEU   6  12.536  -3.828   1.924
   40    HA   LEU   6           HA       LEU   6  15.475  -3.418   1.510
   41   1HB   LEU   6          HB2       LEU   6  13.742  -3.028   3.964
   42   2HB   LEU   6          HB3       LEU   6  15.422  -3.441   4.102
   43    HG   LEU   6           HG       LEU   6  15.822  -1.399   2.467
   44   1HD1  LEU   6          HD11      LEU   6  13.171  -0.677   3.774
   45   2HD1  LEU   6          HD12      LEU   6  14.206   0.425   2.827
   46   3HD1  LEU   6          HD13      LEU   6  13.434  -0.967   2.045
   47   1HD2  LEU   6          HD21      LEU   6  16.790  -1.531   4.649
   48   2HD2  LEU   6          HD22      LEU   6  16.048   0.070   4.476
   49   3HD2  LEU   6          HD23      LEU   6  15.240  -1.205   5.425
   50    H    ILE   7           H        ILE   7  16.013  -5.359   0.835
   51    HA   ILE   7           HA       ILE   7  14.733  -7.760   1.991
   52    HB   ILE   7           HB       ILE   7  16.532  -7.320  -0.427
   53   1HG1  ILE   7          HG12      ILE   7  13.543  -7.913  -0.112
   54   2HG1  ILE   7          HG13      ILE   7  14.263  -6.400  -0.662
   55   1HG2  ILE   7          HG21      ILE   7  15.151  -9.885   0.475
   56   2HG2  ILE   7          HG22      ILE   7  16.112  -9.656  -1.008
   57   3HG2  ILE   7          HG23      ILE   7  16.902  -9.591   0.549
   58   1HD1  ILE   7          HD11      ILE   7  13.444  -7.519  -2.591
   59   2HD1  ILE   7          HD12      ILE   7  15.217  -7.628  -2.630
   60   3HD1  ILE   7          HD13      ILE   7  14.238  -9.037  -2.155
   61    H    SER   8           H        SER   8  15.636  -8.307   3.918
   62    HA   SER   8           HA       SER   8  18.583  -8.452   4.159
   63   1HB   SER   8          HB2       SER   8  16.594  -9.353   6.255
   64   2HB   SER   8          HB3       SER   8  18.255  -8.785   6.449
   65    HG   SER   8           HG       SER   8  15.894  -7.351   5.881
   66    H    GLY   9           H        GLY   9  19.170 -10.124   2.719
   67   1HA   GLY   9          HA2       GLY   9  17.565 -12.645   2.821
   68   2HA   GLY   9          HA3       GLY   9  18.430 -12.004   1.423
   69    H    SER  10           H        SER  10  20.508 -11.625   4.057
   70    HA   SER  10           HA       SER  10  22.255 -13.774   3.332
   71   1HB   SER  10          HB2       SER  10  23.131 -13.162   5.784
   72   2HB   SER  10          HB3       SER  10  23.478 -12.184   4.360
   73    HG   SER  10           HG       SER  10  21.199 -11.668   5.964
   74    H    THR  11           H        THR  11  21.694 -15.859   3.568
   75    HA   THR  11           HA       THR  11  20.446 -17.670   4.120
   76    HB   THR  11           HB       THR  11  21.172 -17.001   6.990
   77    HG1  THR  11           HG1      THR  11  22.918 -16.599   5.482
   78   1HG2  THR  11          HG21      THR  11  21.650 -19.429   7.111
   79   2HG2  THR  11          HG22      THR  11  19.973 -19.159   6.621
   80   3HG2  THR  11          HG23      THR  11  21.183 -19.621   5.405
   81    H    LEU  12           H        LEU  12  18.803 -15.557   3.586
   82    HA   LEU  12           HA       LEU  12  16.740 -14.721   3.773
   83   1HB   LEU  12          HB2       LEU  12  16.389 -17.227   3.613
   84   2HB   LEU  12          HB3       LEU  12  15.986 -17.209   5.322
   85    HG   LEU  12           HG       LEU  12  14.155 -15.480   4.733
   86   1HD1  LEU  12          HD11      LEU  12  13.367 -15.511   2.379
   87   2HD1  LEU  12          HD12      LEU  12  14.967 -14.791   2.508
   88   3HD1  LEU  12          HD13      LEU  12  14.794 -16.454   1.905
   89   1HD2  LEU  12          HD21      LEU  12  13.960 -18.268   3.521
   90   2HD2  LEU  12          HD22      LEU  12  13.657 -17.841   5.218
   91   3HD2  LEU  12          HD23      LEU  12  12.594 -17.214   3.951
   92    H    GLY  13           H        GLY  13  18.356 -13.563   5.440
   93   1HA   GLY  13          HA2       GLY  13  16.738 -12.368   7.473
   94   2HA   GLY  13          HA3       GLY  13  17.897 -13.501   8.191
   95    H    GLY  14           H        GLY  14  18.536 -11.207   9.124
   96   1HA   GLY  14          HA2       GLY  14  21.086 -10.568   8.324
   97   2HA   GLY  14          HA3       GLY  14  20.069  -9.450   7.412
   98    H    ALA  15           H        ALA  15  21.256  -7.863   8.753
   99    HA   ALA  15           HA       ALA  15  20.695  -7.574  11.583
  100   1HB   ALA  15          HB1       ALA  15  21.933  -5.440  11.288
  101   2HB   ALA  15          HB2       ALA  15  22.817  -6.820  10.611
  102   3HB   ALA  15          HB3       ALA  15  21.944  -5.711   9.530
  103    H    GLU  16           H        GLU  16  18.264  -7.907  10.702
  104    HA   GLU  16           HA       GLU  16  16.804  -5.887   9.482
  105   1HB   GLU  16          HB2       GLU  16  15.991  -7.902  11.600
  106   2HB   GLU  16          HB3       GLU  16  14.840  -6.854  10.760
  107   1HG   GLU  16          HG2       GLU  16  15.438  -7.808   8.599
  108   2HG   GLU  16          HG3       GLU  16  16.704  -8.797   9.333
  109    H    TYR  17           H        TYR  17  17.841  -6.053  12.874
  110    HA   TYR  17           HA       TYR  17  16.186  -4.104  14.024
  111   1HB   TYR  17          HB2       TYR  17  17.699  -5.566  15.282
  112   2HB   TYR  17          HB3       TYR  17  19.103  -4.789  14.563
  113    HD1  TYR  17           HD1      TYR  17  16.089  -4.086  16.704
  114    HD2  TYR  17           HD2      TYR  17  20.113  -2.929  15.648
  115    HE1  TYR  17           HE1      TYR  17  16.106  -2.451  18.565
  116    HE2  TYR  17           HE2      TYR  17  20.138  -1.294  17.501
  117    HH   TYR  17           HH       TYR  17  18.946  -0.359  19.274
  118    H    VAL  18           H        VAL  18  19.187  -3.651  12.062
  119    HA   VAL  18           HA       VAL  18  18.971  -0.724  12.436
  120    HB   VAL  18           HB       VAL  18  21.056  -2.265  10.873
  121   1HG1  VAL  18          HG11      VAL  18  22.418  -0.168  11.424
  122   2HG1  VAL  18          HG12      VAL  18  21.013   0.150  10.397
  123   3HG1  VAL  18          HG13      VAL  18  20.957   0.530  12.131
  124   1HG2  VAL  18          HG21      VAL  18  21.193  -3.131  13.161
  125   2HG2  VAL  18          HG22      VAL  18  22.546  -2.051  12.857
  126   3HG2  VAL  18          HG23      VAL  18  21.164  -1.475  13.816
  127    H    ALA  19           H        ALA  19  18.413  -3.287   9.985
  128    HA   ALA  19           HA       ALA  19  18.026  -1.578   7.756
  129   1HB   ALA  19          HB1       ALA  19  16.446  -4.100   8.354
  130   2HB   ALA  19          HB2       ALA  19  16.747  -3.365   6.777
  131   3HB   ALA  19          HB3       ALA  19  18.094  -4.098   7.672
  132    H    GLU  20           H        GLU  20  15.780  -2.458  10.443
  133    HA   GLU  20           HA       GLU  20  13.530  -1.075   9.440
  134   1HB   GLU  20          HB2       GLU  20  13.612  -2.700  11.366
  135   2HB   GLU  20          HB3       GLU  20  14.330  -1.423  12.358
  136   1HG   GLU  20          HG2       GLU  20  12.310  -0.017  11.976
  137   2HG   GLU  20          HG3       GLU  20  11.626  -1.275  10.946
  138    H    HIS  21           H        HIS  21  16.364   0.150  11.274
  139    HA   HIS  21           HA       HIS  21  15.267   2.779  11.725
  140   1HB   HIS  21          HB2       HIS  21  17.191   1.661  12.959
  141   2HB   HIS  21          HB3       HIS  21  18.208   2.042  11.569
  142    HD1  HIS  21           HD1      HIS  21  17.345   5.038  11.002
  143    HD2  HIS  21           HD2      HIS  21  17.774   3.318  14.812
  144    HE1  HIS  21           HE1      HIS  21  17.805   6.968  12.607
  145    H    LEU  22           H        LEU  22  17.361   1.326   9.197
  146    HA   LEU  22           HA       LEU  22  17.836   3.673   7.641
  147   1HB   LEU  22          HB2       LEU  22  17.634   0.702   6.981
  148   2HB   LEU  22          HB3       LEU  22  17.924   1.882   5.742
  149    HG   LEU  22           HG       LEU  22  19.719   1.445   8.184
  150   1HD1  LEU  22          HD11      LEU  22  21.250   0.412   6.429
  151   2HD1  LEU  22          HD12      LEU  22  19.802  -0.526   6.816
  152   3HD1  LEU  22          HD13      LEU  22  19.862   0.427   5.322
  153   1HD2  LEU  22          HD21      LEU  22  20.199   3.063   5.644
  154   2HD2  LEU  22          HD22      LEU  22  20.005   3.717   7.291
  155   3HD2  LEU  22          HD23      LEU  22  21.408   2.728   6.898
  156    H    ALA  23           H        ALA  23  15.408   1.113   7.257
  157    HA   ALA  23           HA       ALA  23  13.835   2.134   5.227
  158   1HB   ALA  23          HB1       ALA  23  11.999   0.768   6.247
  159   2HB   ALA  23          HB2       ALA  23  13.525  -0.109   6.200
  160   3HB   ALA  23          HB3       ALA  23  12.955   0.602   7.716
  161    H    GLU  24           H        GLU  24  13.414   2.766   8.765
  162    HA   GLU  24           HA       GLU  24  11.140   4.367   8.595
  163   1HB   GLU  24          HB2       GLU  24  12.295   3.436  10.657
  164   2HB   GLU  24          HB3       GLU  24  13.447   4.745  10.574
  165   1HG   GLU  24          HG2       GLU  24  11.626   6.379  10.802
  166   2HG   GLU  24          HG3       GLU  24  10.425   5.087  10.802
  167    H    LYS  25           H        LYS  25  14.550   5.481   8.833
  168    HA   LYS  25           HA       LYS  25  14.074   8.211   8.394
  169   1HB   LYS  25          HB2       LYS  25  16.416   6.387   7.664
  170   2HB   LYS  25          HB3       LYS  25  16.489   8.124   7.497
  171   1HG   LYS  25          HG2       LYS  25  15.976   6.558  10.081
  172   2HG   LYS  25          HG3       LYS  25  17.460   7.339   9.633
  173   1HD   LYS  25          HD2       LYS  25  14.847   8.553  10.497
  174   2HD   LYS  25          HD3       LYS  25  16.431   8.735  11.247
  175   1HE   LYS  25          HE2       LYS  25  17.189  10.066   9.256
  176   2HE   LYS  25          HE3       LYS  25  15.554   9.918   8.572
  177   1HZ   LYS  25          HZ1       LYS  25  14.675  11.123  10.409
  178   2HZ   LYS  25          HZ2       LYS  25  16.147  11.232  11.152
  179   3HZ   LYS  25          HZ3       LYS  25  15.880  12.012   9.742
  180    H    LEU  26           H        LEU  26  14.493   5.657   5.950
  181    HA   LEU  26           HA       LEU  26  14.411   7.484   3.741
  182   1HB   LEU  26          HB2       LEU  26  14.036   4.509   4.046
  183   2HB   LEU  26          HB3       LEU  26  13.654   5.282   2.506
  184    HG   LEU  26           HG       LEU  26  16.355   5.580   3.876
  185   1HD1  LEU  26          HD11      LEU  26  15.943   3.220   3.347
  186   2HD1  LEU  26          HD12      LEU  26  15.502   3.647   1.681
  187   3HD1  LEU  26          HD13      LEU  26  17.162   3.899   2.265
  188   1HD2  LEU  26          HD21      LEU  26  17.056   6.249   1.542
  189   2HD2  LEU  26          HD22      LEU  26  15.351   6.212   1.057
  190   3HD2  LEU  26          HD23      LEU  26  15.924   7.376   2.268
  191    H    GLU  27           H        GLU  27  11.708   6.153   5.727
  192    HA   GLU  27           HA       GLU  27   9.763   6.923   3.775
  193   1HB   GLU  27          HB2       GLU  27   9.468   6.662   6.801
  194   2HB   GLU  27          HB3       GLU  27   8.206   6.811   5.598
  195   1HG   GLU  27          HG2       GLU  27   9.339   4.688   4.520
  196   2HG   GLU  27          HG3       GLU  27   9.987   4.467   6.150
  197    H    GLU  28           H        GLU  28  11.368   8.589   6.583
  198    HA   GLU  28           HA       GLU  28   9.974  11.020   6.313
  199   1HB   GLU  28          HB2       GLU  28  12.852  10.727   7.257
  200   2HB   GLU  28          HB3       GLU  28  11.652  11.934   7.668
  201   1HG   GLU  28          HG2       GLU  28  10.303   9.892   8.655
  202   2HG   GLU  28          HG3       GLU  28  11.898   9.116   8.652
  203    H    ALA  29           H        ALA  29  12.625   9.643   4.446
  204    HA   ALA  29           HA       ALA  29  13.516  12.085   3.220
  205   1HB   ALA  29          HB1       ALA  29  13.786   9.248   2.148
  206   2HB   ALA  29          HB2       ALA  29  14.754  10.660   1.717
  207   3HB   ALA  29          HB3       ALA  29  14.876   9.987   3.350
  208    H    GLY  30           H        GLY  30  10.601  10.299   2.781
  209   1HA   GLY  30          HA2       GLY  30   8.955  11.661   1.628
  210   2HA   GLY  30          HA3       GLY  30  10.071  11.842   0.273
  211    H    PHE  31           H        PHE  31   9.824   8.663   1.759
  212    HA   PHE  31           HA       PHE  31   8.147   7.708  -0.521
  213   1HB   PHE  31          HB2       PHE  31  10.586   6.212   0.415
  214   2HB   PHE  31          HB3       PHE  31   9.659   6.003  -1.046
  215    HD1  PHE  31           HD1      PHE  31  12.490   7.689   0.465
  216    HD2  PHE  31           HD2      PHE  31   9.824   7.709  -2.924
  217    HE1  PHE  31           HE1      PHE  31  14.118   9.048  -0.805
  218    HE2  PHE  31           HE2      PHE  31  11.472   9.050  -4.207
  219    HZ   PHE  31           HZ       PHE  31  13.631   9.698  -3.161
  220    H    THR  32           H        THR  32   8.270   4.985   0.122
  221    HA   THR  32           HA       THR  32   7.615   4.696   2.966
  222    HB   THR  32           HB       THR  32   5.834   2.995   2.198
  223    HG1  THR  32           HG1      THR  32   5.778   4.765  -0.031
  224   1HG2  THR  32          HG21      THR  32   4.045   4.669   2.287
  225   2HG2  THR  32          HG22      THR  32   5.313   5.005   3.480
  226   3HG2  THR  32          HG23      THR  32   5.224   5.972   1.991
  227    H    THR  33           H        THR  33   8.206   2.585   3.703
  228    HA   THR  33           HA       THR  33   9.858   1.032   1.756
  229    HB   THR  33           HB       THR  33  11.665   1.102   3.357
  230    HG1  THR  33           HG1      THR  33  11.295   2.917   5.022
  231   1HG2  THR  33          HG21      THR  33  10.791   3.991   2.935
  232   2HG2  THR  33          HG22      THR  33  12.436   3.308   2.980
  233   3HG2  THR  33          HG23      THR  33  11.369   2.979   1.613
  234    H    GLU  34           H        GLU  34  10.305  -1.153   2.296
  235    HA   GLU  34           HA       GLU  34   8.531  -2.344   4.342
  236   1HB   GLU  34          HB2       GLU  34   8.437  -2.454   1.595
  237   2HB   GLU  34          HB3       GLU  34   9.412  -3.846   1.938
  238   1HG   GLU  34          HG2       GLU  34   7.236  -4.507   1.886
  239   2HG   GLU  34          HG3       GLU  34   7.690  -4.590   3.579
  240    H    THR  35           H        THR  35  10.039  -2.577   6.074
  241    HA   THR  35           HA       THR  35  12.674  -3.711   5.646
  242    HB   THR  35           HB       THR  35  11.164  -3.815   8.274
  243    HG1  THR  35           HG1      THR  35  10.984  -1.705   7.855
  244   1HG2  THR  35          HG21      THR  35  13.415  -3.669   9.189
  245   2HG2  THR  35          HG22      THR  35  13.411  -4.950   7.968
  246   3HG2  THR  35          HG23      THR  35  14.101  -3.364   7.574
  247    H    LEU  36           H        LEU  36  13.028  -5.821   5.119
  248    HA   LEU  36           HA       LEU  36  11.073  -7.916   5.975
  249   1HB   LEU  36          HB2       LEU  36  12.122  -7.290   3.179
  250   2HB   LEU  36          HB3       LEU  36  11.229  -8.742   3.578
  251    HG   LEU  36           HG       LEU  36  10.059  -5.962   3.915
  252   1HD1  LEU  36          HD11      LEU  36   8.909  -6.414   1.780
  253   2HD1  LEU  36          HD12      LEU  36  10.669  -6.298   1.613
  254   3HD1  LEU  36          HD13      LEU  36   9.891  -7.894   1.584
  255   1HD2  LEU  36          HD21      LEU  36   8.740  -8.713   3.762
  256   2HD2  LEU  36          HD22      LEU  36   8.913  -7.732   5.235
  257   3HD2  LEU  36          HD23      LEU  36   7.901  -7.156   3.907
  258    H    HIS  37           H        HIS  37  11.834 -10.088   5.598
  259    HA   HIS  37           HA       HIS  37  14.775 -10.381   5.476
  260   1HB   HIS  37          HB2       HIS  37  14.541 -12.465   6.650
  261   2HB   HIS  37          HB3       HIS  37  13.834 -11.152   7.573
  262    HD1  HIS  37           HD1      HIS  37  12.618 -14.017   5.275
  263    HD2  HIS  37           HD2      HIS  37  11.439 -11.628   8.527
  264    HE1  HIS  37           HE1      HIS  37  10.413 -15.008   6.135
  265    H    GLY  38           H        GLY  38  13.173  -9.867   3.196
  266   1HA   GLY  38          HA2       GLY  38  12.615 -10.561   1.102
  267   2HA   GLY  38          HA3       GLY  38  13.945 -11.711   1.278
  268    HA   PRO  39           HA       PRO  39  10.541 -14.488   2.936
  269   1HB   PRO  39          HB2       PRO  39   7.923 -13.691   3.301
  270   2HB   PRO  39          HB3       PRO  39   9.204 -13.477   4.526
  271   1HG   PRO  39          HG2       PRO  39   8.205 -11.456   2.500
  272   2HG   PRO  39          HG3       PRO  39   8.469 -11.228   4.259
  273   1HD   PRO  39          HD2       PRO  39  10.328 -10.461   2.433
  274   2HD   PRO  39          HD3       PRO  39  10.808 -11.194   4.000
  275    H    LEU  40           H        LEU  40   9.608 -12.328   0.304
  276    HA   LEU  40           HA       LEU  40   8.207 -14.517  -1.120
  277   1HB   LEU  40          HB2       LEU  40   8.021 -11.465  -1.174
  278   2HB   LEU  40          HB3       LEU  40   7.228 -12.507  -2.324
  279    HG   LEU  40           HG       LEU  40   6.671 -12.486   0.666
  280   1HD1  LEU  40          HD11      LEU  40   5.030 -11.435  -1.677
  281   2HD1  LEU  40          HD12      LEU  40   4.535 -11.442   0.031
  282   3HD1  LEU  40          HD13      LEU  40   5.905 -10.449  -0.485
  283   1HD2  LEU  40          HD21      LEU  40   4.685 -13.879   0.075
  284   2HD2  LEU  40          HD22      LEU  40   5.303 -14.026  -1.586
  285   3HD2  LEU  40          HD23      LEU  40   6.206 -14.719  -0.219
  286    H    LEU  41           H        LEU  41  11.224 -13.579  -0.867
  287    HA   LEU  41           HA       LEU  41  13.051 -13.285  -2.069
  288   1HB   LEU  41          HB2       LEU  41  12.022 -15.230  -3.385
  289   2HB   LEU  41          HB3       LEU  41  11.517 -14.027  -4.564
  290    HG   LEU  41           HG       LEU  41  14.040 -13.358  -4.692
  291   1HD1  LEU  41          HD11      LEU  41  14.750 -14.674  -2.668
  292   2HD1  LEU  41          HD12      LEU  41  14.322 -16.166  -3.524
  293   3HD1  LEU  41          HD13      LEU  41  15.618 -15.115  -4.144
  294   1HD2  LEU  41          HD21      LEU  41  12.810 -14.489  -6.481
  295   2HD2  LEU  41          HD22      LEU  41  14.458 -15.125  -6.342
  296   3HD2  LEU  41          HD23      LEU  41  13.080 -16.060  -5.704
  297    H    GLU  42           H        GLU  42  10.203 -11.570  -3.093
  298    HA   GLU  42           HA       GLU  42  11.538  -9.072  -3.774
  299   1HB   GLU  42          HB2       GLU  42  10.699  -9.164  -6.165
  300   2HB   GLU  42          HB3       GLU  42  12.110 -10.134  -5.807
  301   1HG   GLU  42          HG2       GLU  42  10.672 -12.188  -5.731
  302   2HG   GLU  42          HG3       GLU  42   9.303 -11.210  -6.244
  303    H    ASP  43           H        ASP  43  10.154  -8.438  -2.030
  304    HA   ASP  43           HA       ASP  43   7.293  -8.861  -2.163
  305   1HB   ASP  43          HB2       ASP  43   8.323  -8.296  -0.059
  306   2HB   ASP  43          HB3       ASP  43   8.932  -6.763  -0.717
  307    H    LEU  44           H        LEU  44   9.525  -6.208  -3.243
  308    HA   LEU  44           HA       LEU  44   7.240  -5.141  -4.850
  309   1HB   LEU  44          HB2       LEU  44   9.988  -3.938  -4.479
  310   2HB   LEU  44          HB3       LEU  44   8.702  -3.237  -5.392
  311    HG   LEU  44           HG       LEU  44   8.651  -3.673  -2.385
  312   1HD1  LEU  44          HD11      LEU  44   8.617  -1.094  -4.013
  313   2HD1  LEU  44          HD12      LEU  44   8.762  -1.264  -2.250
  314   3HD1  LEU  44          HD13      LEU  44  10.081  -1.795  -3.314
  315   1HD2  LEU  44          HD21      LEU  44   6.514  -2.467  -4.200
  316   2HD2  LEU  44          HD22      LEU  44   6.364  -3.936  -3.204
  317   3HD2  LEU  44          HD23      LEU  44   6.531  -2.365  -2.427
  318    HA   PRO  45           HA       PRO  45   8.643  -7.347  -8.318
  319   1HB   PRO  45          HB2       PRO  45   7.992  -5.642 -10.446
  320   2HB   PRO  45          HB3       PRO  45   6.870  -6.649  -9.527
  321   1HG   PRO  45          HG2       PRO  45   7.528  -3.710  -9.214
  322   2HG   PRO  45          HG3       PRO  45   5.923  -4.491  -9.122
  323   1HD   PRO  45          HD2       PRO  45   7.398  -3.769  -6.897
  324   2HD   PRO  45          HD3       PRO  45   6.275  -5.168  -6.913
  325    H    ALA  46           H        ALA  46   9.723  -6.975 -10.529
  326    HA   ALA  46           HA       ALA  46  12.443  -6.013 -10.165
  327   1HB   ALA  46          HB1       ALA  46  10.989  -7.128 -12.620
  328   2HB   ALA  46          HB2       ALA  46  12.736  -6.884 -12.484
  329   3HB   ALA  46          HB3       ALA  46  11.935  -8.079 -11.449
  330    H    SER  47           H        SER  47  10.639  -3.886  -9.803
  331    HA   SER  47           HA       SER  47  11.488  -1.901 -11.658
  332   1HB   SER  47          HB2       SER  47   8.544  -2.608 -11.597
  333   2HB   SER  47          HB3       SER  47   9.231  -1.174 -12.376
  334    HG   SER  47           HG       SER  47  10.437  -3.496 -13.156
  335    H    GLY  48           H        GLY  48  11.690  -0.088 -10.330
  336   1HA   GLY  48          HA2       GLY  48  10.397   1.282  -8.545
  337   2HA   GLY  48          HA3       GLY  48  10.396  -0.238  -7.645
  338    H    ILE  49           H        ILE  49  11.735   0.396  -5.995
  339    HA   ILE  49           HA       ILE  49  14.609   0.808  -6.659
  340    HB   ILE  49           HB       ILE  49  13.042   1.928  -4.320
  341   1HG1  ILE  49          HG12      ILE  49  12.253   3.144  -6.290
  342   2HG1  ILE  49          HG13      ILE  49  13.146   4.158  -5.184
  343   1HG2  ILE  49          HG21      ILE  49  15.075   3.346  -3.965
  344   2HG2  ILE  49          HG22      ILE  49  15.388   1.615  -3.777
  345   3HG2  ILE  49          HG23      ILE  49  15.894   2.444  -5.257
  346   1HD1  ILE  49          HD11      ILE  49  15.080   4.207  -6.641
  347   2HD1  ILE  49          HD12      ILE  49  14.343   3.017  -7.742
  348   3HD1  ILE  49          HD13      ILE  49  13.638   4.633  -7.570
  349    H    TRP  50           H        TRP  50  15.972  -0.577  -5.416
  350    HA   TRP  50           HA       TRP  50  14.676  -2.380  -3.415
  351   1HB   TRP  50          HB2       TRP  50  16.394  -2.983  -5.833
  352   2HB   TRP  50          HB3       TRP  50  16.600  -3.939  -4.402
  353    HD1  TRP  50           HD1      TRP  50  13.180  -2.911  -5.969
  354    HE1  TRP  50           HE1      TRP  50  11.994  -4.994  -6.839
  355    HE3  TRP  50           HE3      TRP  50  16.670  -6.409  -4.640
  356    HZ2  TRP  50           HZ2      TRP  50  12.518  -7.828  -6.988
  357    HZ3  TRP  50           HZ3      TRP  50  16.306  -8.800  -5.178
  358    HH2  TRP  50           HH2      TRP  50  14.257  -9.520  -6.375
  359    H    LEU  51           H        LEU  51  15.982  -2.827  -1.650
  360    HA   LEU  51           HA       LEU  51  18.794  -1.874  -1.668
  361   1HB   LEU  51          HB2       LEU  51  16.694  -1.451   0.484
  362   2HB   LEU  51          HB3       LEU  51  18.423  -1.365   0.814
  363    HG   LEU  51           HG       LEU  51  16.868   0.481  -1.061
  364   1HD1  LEU  51          HD11      LEU  51  18.158   0.983   1.659
  365   2HD1  LEU  51          HD12      LEU  51  17.341   2.179   0.632
  366   3HD1  LEU  51          HD13      LEU  51  16.419   0.845   1.341
  367   1HD2  LEU  51          HD21      LEU  51  19.060   0.357  -1.972
  368   2HD2  LEU  51          HD22      LEU  51  19.071   1.807  -0.975
  369   3HD2  LEU  51          HD23      LEU  51  19.836   0.323  -0.376
  370    H    VAL  52           H        VAL  52  20.155  -3.359  -0.750
  371    HA   VAL  52           HA       VAL  52  18.891  -5.914   0.167
  372    HB   VAL  52           HB       VAL  52  21.293  -5.556  -1.676
  373   1HG1  VAL  52          HG11      VAL  52  21.108  -8.012  -1.975
  374   2HG1  VAL  52          HG12      VAL  52  21.442  -7.596  -0.293
  375   3HG1  VAL  52          HG13      VAL  52  19.794  -8.059  -0.776
  376   1HG2  VAL  52          HG21      VAL  52  18.434  -6.445  -2.293
  377   2HG2  VAL  52          HG22      VAL  52  19.258  -5.000  -2.923
  378   3HG2  VAL  52          HG23      VAL  52  19.809  -6.602  -3.407
  379    H    ILE  53           H        ILE  53  19.541  -6.543   2.084
  380    HA   ILE  53           HA       ILE  53  21.940  -5.349   3.349
  381    HB   ILE  53           HB       ILE  53  19.307  -5.822   4.825
  382   1HG1  ILE  53          HG12      ILE  53  19.287  -3.168   4.795
  383   2HG1  ILE  53          HG13      ILE  53  20.081  -3.384   3.240
  384   1HG2  ILE  53          HG21      ILE  53  20.345  -4.326   6.488
  385   2HG2  ILE  53          HG22      ILE  53  21.398  -5.701   6.159
  386   3HG2  ILE  53          HG23      ILE  53  21.767  -4.124   5.442
  387   1HD1  ILE  53          HD11      ILE  53  18.140  -4.739   2.456
  388   2HD1  ILE  53          HD12      ILE  53  17.404  -4.570   4.060
  389   3HD1  ILE  53          HD13      ILE  53  17.653  -3.143   3.023
  390    H    SER  54           H        SER  54  22.561  -7.383   2.205
  391    HA   SER  54           HA       SER  54  21.951  -9.832   3.782
  392   1HB   SER  54          HB2       SER  54  22.525  -9.604   0.818
  393   2HB   SER  54          HB3       SER  54  22.055 -11.064   1.713
  394    HG   SER  54           HG       SER  54  20.329  -9.860   0.577
  395    H    SER  55           H        SER  55  24.000  -8.229   4.624
  396    HA   SER  55           HA       SER  55  26.401  -7.945   3.794
  397   1HB   SER  55          HB2       SER  55  25.858  -9.204   6.495
  398   2HB   SER  55          HB3       SER  55  27.158  -8.067   6.076
  399    HG   SER  55           HG       SER  55  25.308  -7.090   7.103
  400    H    THR  56           H        THR  56  27.636  -9.152   2.409
  401    HA   THR  56           HA       THR  56  27.876 -12.008   2.694
  402    HB   THR  56           HB       THR  56  29.497 -11.645   0.775
  403    HG1  THR  56           HG1      THR  56  29.711  -9.669  -0.024
  404   1HG2  THR  56          HG21      THR  56  27.774 -10.958  -0.831
  405   2HG2  THR  56          HG22      THR  56  27.106 -12.087   0.361
  406   3HG2  THR  56          HG23      THR  56  26.750 -10.357   0.490
  407    H    HIS  57           H        HIS  57  29.601  -9.309   4.109
  408    HA   HIS  57           HA       HIS  57  31.577  -9.103   5.158
  409   1HB   HIS  57          HB2       HIS  57  31.254 -12.015   5.943
  410   2HB   HIS  57          HB3       HIS  57  32.086 -10.751   6.836
  411    HD1  HIS  57           HD1      HIS  57  28.760 -12.401   6.616
  412    HD2  HIS  57           HD2      HIS  57  30.319  -8.665   7.762
  413    HE1  HIS  57           HE1      HIS  57  26.968 -11.283   8.030
  414    H    GLY  58           H        GLY  58  31.666 -10.167   2.311
  415   1HA   GLY  58          HA2       GLY  58  33.378 -10.529   0.814
  416   2HA   GLY  58          HA3       GLY  58  34.512 -10.769   2.152
  417    H    ALA  59           H        ALA  59  33.905 -12.836   3.545
  418    HA   ALA  59           HA       ALA  59  34.188 -15.023   1.611
  419   1HB   ALA  59          HB1       ALA  59  34.504 -14.969   4.645
  420   2HB   ALA  59          HB2       ALA  59  35.025 -16.270   3.556
  421   3HB   ALA  59          HB3       ALA  59  35.804 -14.682   3.460
  422    H    GLY  60           H        GLY  60  31.518 -13.780   3.274
  423   1HA   GLY  60          HA2       GLY  60  29.373 -14.601   3.490
  424   2HA   GLY  60          HA3       GLY  60  29.915 -16.237   3.108
  425    H    ASP  61           H        ASP  61  28.273 -15.167   5.390
  426    HA   ASP  61           HA       ASP  61  29.822 -15.659   7.828
  427   1HB   ASP  61          HB2       ASP  61  27.728 -14.357   7.885
  428   2HB   ASP  61          HB3       ASP  61  26.829 -15.753   7.274
  429    H    ILE  62           H        ILE  62  28.197 -17.470   5.356
  430    HA   ILE  62           HA       ILE  62  29.299 -19.991   6.307
  431    HB   ILE  62           HB       ILE  62  27.258 -21.219   5.596
  432   1HG1  ILE  62          HG12      ILE  62  25.820 -18.528   5.589
  433   2HG1  ILE  62          HG13      ILE  62  26.278 -19.429   4.143
  434   1HG2  ILE  62          HG21      ILE  62  26.637 -19.291   7.865
  435   2HG2  ILE  62          HG22      ILE  62  26.026 -20.944   7.649
  436   3HG2  ILE  62          HG23      ILE  62  27.736 -20.683   7.995
  437   1HD1  ILE  62          HD11      ILE  62  24.293 -20.338   6.252
  438   2HD1  ILE  62          HD12      ILE  62  23.961 -19.841   4.587
  439   3HD1  ILE  62          HD13      ILE  62  24.859 -21.340   4.890
  440    HA   PRO  63           HA       PRO  63  30.815 -20.072   2.211
  441   1HB   PRO  63          HB2       PRO  63  29.598 -22.810   1.801
  442   2HB   PRO  63          HB3       PRO  63  31.267 -22.257   1.451
  443   1HG   PRO  63          HG2       PRO  63  30.757 -23.683   3.693
  444   2HG   PRO  63          HG3       PRO  63  31.822 -22.241   3.779
  445   1HD   PRO  63          HD2       PRO  63  28.902 -22.470   4.525
  446   2HD   PRO  63          HD3       PRO  63  30.237 -21.661   5.399
  447    H    ASP  64           H        ASP  64  27.383 -20.568   2.517
  448    HA   ASP  64           HA       ASP  64  26.904 -19.647  -0.264
  449   1HB   ASP  64          HB2       ASP  64  26.603 -22.100  -0.162
  450   2HB   ASP  64          HB3       ASP  64  25.428 -21.902   1.143
  451    H    ASN  65           H        ASN  65  27.110 -17.824   1.330
  452    HA   ASN  65           HA       ASN  65  25.566 -17.203   3.466
  453   1HB   ASN  65          HB2       ASN  65  27.560 -15.997   2.457
  454   2HB   ASN  65          HB3       ASN  65  26.415 -15.164   1.408
  455   1HD2  ASN  65          HD22      ASN  65  25.567 -13.169   2.290
  456   2HD2  ASN  65          HD21      ASN  65  25.863 -12.725   3.949
  457    H    LEU  66           H        LEU  66  24.315 -17.118   0.209
  458    HA   LEU  66           HA       LEU  66  21.722 -16.015   1.187
  459   1HB   LEU  66          HB2       LEU  66  23.231 -15.213  -1.347
  460   2HB   LEU  66          HB3       LEU  66  21.493 -15.168  -1.242
  461    HG   LEU  66           HG       LEU  66  21.880 -13.723   0.940
  462   1HD1  LEU  66          HD11      LEU  66  24.308 -13.938   1.009
  463   2HD1  LEU  66          HD12      LEU  66  24.461 -13.264  -0.621
  464   3HD1  LEU  66          HD13      LEU  66  23.869 -12.252   0.712
  465   1HD2  LEU  66          HD21      LEU  66  21.876 -11.672  -0.528
  466   2HD2  LEU  66          HD22      LEU  66  22.174 -12.729  -1.912
  467   3HD2  LEU  66          HD23      LEU  66  20.682 -12.894  -0.968
  468    H    SER  67           H        SER  67  21.375 -18.324   1.550
  469    HA   SER  67           HA       SER  67  22.209 -20.222  -0.413
  470   1HB   SER  67          HB2       SER  67  20.277 -20.982   1.744
  471   2HB   SER  67          HB3       SER  67  21.709 -21.815   1.147
  472    HG   SER  67           HG       SER  67  22.922 -20.042   2.175
  473    HA   PRO  68           HA       PRO  68  17.642 -20.543  -1.686
  474   1HB   PRO  68          HB2       PRO  68  15.768 -18.764  -0.779
  475   2HB   PRO  68          HB3       PRO  68  16.247 -20.211   0.154
  476   1HG   PRO  68          HG2       PRO  68  17.177 -17.367   0.569
  477   2HG   PRO  68          HG3       PRO  68  16.726 -18.575   1.807
  478   1HD   PRO  68          HD2       PRO  68  19.264 -18.067   1.168
  479   2HD   PRO  68          HD3       PRO  68  18.689 -19.654   1.741
  480    H    PHE  69           H        PHE  69  18.733 -17.254  -0.996
  481    HA   PHE  69           HA       PHE  69  17.381 -16.034  -3.161
  482   1HB   PHE  69          HB2       PHE  69  19.316 -15.210  -1.106
  483   2HB   PHE  69          HB3       PHE  69  19.566 -14.371  -2.633
  484    HD1  PHE  69           HD1      PHE  69  17.208 -14.929   0.170
  485    HD2  PHE  69           HD2      PHE  69  17.883 -12.870  -3.566
  486    HE1  PHE  69           HE1      PHE  69  15.242 -13.482   0.605
  487    HE2  PHE  69           HE2      PHE  69  15.927 -11.413  -3.110
  488    HZ   PHE  69           HZ       PHE  69  14.597 -11.729  -1.042
  489    H    TYR  70           H        TYR  70  20.860 -17.023  -2.936
  490    HA   TYR  70           HA       TYR  70  21.548 -16.100  -5.490
  491   1HB   TYR  70          HB2       TYR  70  23.149 -16.753  -3.705
  492   2HB   TYR  70          HB3       TYR  70  22.716 -18.427  -3.977
  493    HD1  TYR  70           HD1      TYR  70  23.402 -15.768  -6.603
  494    HD2  TYR  70           HD2      TYR  70  24.757 -19.375  -4.649
  495    HE1  TYR  70           HE1      TYR  70  25.282 -15.918  -8.193
  496    HE2  TYR  70           HE2      TYR  70  26.621 -19.545  -6.257
  497    HH   TYR  70           HH       TYR  70  27.674 -18.599  -8.088
  498    H    GLU  71           H        GLU  71  20.514 -19.453  -4.502
  499    HA   GLU  71           HA       GLU  71  20.706 -20.498  -7.115
  500   1HB   GLU  71          HB2       GLU  71  18.900 -21.383  -4.822
  501   2HB   GLU  71          HB3       GLU  71  19.260 -22.313  -6.288
  502   1HG   GLU  71          HG2       GLU  71  21.745 -21.978  -5.622
  503   2HG   GLU  71          HG3       GLU  71  21.153 -21.535  -4.042
  504    H    ALA  72           H        ALA  72  17.861 -19.027  -5.412
  505    HA   ALA  72           HA       ALA  72  16.078 -19.375  -7.616
  506   1HB   ALA  72          HB1       ALA  72  15.307 -18.769  -5.347
  507   2HB   ALA  72          HB2       ALA  72  16.095 -17.179  -5.499
  508   3HB   ALA  72          HB3       ALA  72  14.738 -17.605  -6.563
  509    H    LEU  73           H        LEU  73  18.427 -16.717  -6.926
  510    HA   LEU  73           HA       LEU  73  17.547 -14.946  -8.943
  511   1HB   LEU  73          HB2       LEU  73  20.205 -15.453  -7.564
  512   2HB   LEU  73          HB3       LEU  73  20.136 -14.359  -8.907
  513    HG   LEU  73           HG       LEU  73  18.505 -14.129  -6.341
  514   1HD1  LEU  73          HD11      LEU  73  20.856 -13.772  -5.928
  515   2HD1  LEU  73          HD12      LEU  73  20.974 -12.624  -7.278
  516   3HD1  LEU  73          HD13      LEU  73  20.016 -12.221  -5.832
  517   1HD2  LEU  73          HD21      LEU  73  17.266 -13.013  -8.128
  518   2HD2  LEU  73          HD22      LEU  73  18.024 -11.790  -7.126
  519   3HD2  LEU  73          HD23      LEU  73  18.742 -12.209  -8.701
  520    H    GLN  74           H        GLN  74  20.194 -17.374  -9.098
  521    HA   GLN  74           HA       GLN  74  20.533 -16.927 -11.902
  522   1HB   GLN  74          HB2       GLN  74  21.396 -19.621 -10.887
  523   2HB   GLN  74          HB3       GLN  74  22.127 -18.510 -11.998
  524   1HG   GLN  74          HG2       GLN  74  22.585 -17.022  -9.902
  525   2HG   GLN  74          HG3       GLN  74  22.099 -18.468  -8.985
  526   1HE2  GLN  74          HE22      GLN  74  24.243 -17.437 -11.611
  527   2HE2  GLN  74          HE21      GLN  74  25.512 -18.614 -11.293
  528    H    GLU  75           H        GLU  75  18.102 -18.762 -10.272
  529    HA   GLU  75           HA       GLU  75  17.553 -20.543 -12.447
  530   1HB   GLU  75          HB2       GLU  75  16.939 -20.933 -10.041
  531   2HB   GLU  75          HB3       GLU  75  15.685 -19.704 -10.221
  532   1HG   GLU  75          HG2       GLU  75  14.560 -21.051 -11.936
  533   2HG   GLU  75          HG3       GLU  75  15.875 -22.231 -11.905
  534    H    GLN  76           H        GLN  76  16.412 -17.281 -11.590
  535    HA   GLN  76           HA       GLN  76  14.659 -17.334 -14.014
  536   1HB   GLN  76          HB2       GLN  76  13.211 -15.700 -12.818
  537   2HB   GLN  76          HB3       GLN  76  13.176 -17.351 -12.223
  538   1HG   GLN  76          HG2       GLN  76  14.168 -16.843 -10.214
  539   2HG   GLN  76          HG3       GLN  76  15.058 -15.460 -10.844
  540   1HE2  GLN  76          HE22      GLN  76  14.281 -14.449  -8.772
  541   2HE2  GLN  76          HE21      GLN  76  12.723 -13.639  -8.797
  542    H    LYS  77           H        LYS  77  17.223 -15.547 -12.510
  543    HA   LYS  77           HA       LYS  77  17.968 -13.393 -12.759
  544   1HB   LYS  77          HB2       LYS  77  18.167 -14.345 -15.611
  545   2HB   LYS  77          HB3       LYS  77  19.156 -13.122 -14.805
  546   1HG   LYS  77          HG2       LYS  77  19.777 -15.051 -13.163
  547   2HG   LYS  77          HG3       LYS  77  19.105 -16.123 -14.405
  548   1HD   LYS  77          HD2       LYS  77  20.711 -14.755 -16.019
  549   2HD   LYS  77          HD3       LYS  77  21.499 -14.308 -14.494
  550   1HE   LYS  77          HE2       LYS  77  21.543 -16.819 -13.976
  551   2HE   LYS  77          HE3       LYS  77  21.107 -17.094 -15.670
  552   1HZ   LYS  77          HZ1       LYS  77  23.485 -17.188 -15.352
  553   2HZ   LYS  77          HZ2       LYS  77  23.172 -15.848 -16.241
  554   3HZ   LYS  77          HZ3       LYS  77  23.512 -15.731 -14.616
  555    HA   PRO  78           HA       PRO  78  13.927 -11.803 -14.388
  556   1HB   PRO  78          HB2       PRO  78  13.386  -9.956 -12.349
  557   2HB   PRO  78          HB3       PRO  78  12.832 -11.640 -12.440
  558   1HG   PRO  78          HG2       PRO  78  15.178 -10.489 -10.944
  559   2HG   PRO  78          HG3       PRO  78  14.052 -11.764 -10.404
  560   1HD   PRO  78          HD2       PRO  78  16.560 -12.306 -11.364
  561   2HD   PRO  78          HD3       PRO  78  15.178 -13.401 -11.658
  562    H    ASP  79           H        ASP  79  13.162  -9.626 -14.941
  563    HA   ASP  79           HA       ASP  79  15.370  -8.234 -16.252
  564   1HB   ASP  79          HB2       ASP  79  13.350  -8.837 -17.505
  565   2HB   ASP  79          HB3       ASP  79  12.357  -7.843 -16.431
  566    H    LEU  80           H        LEU  80  16.148  -7.663 -14.035
  567    HA   LEU  80           HA       LEU  80  14.839  -5.582 -12.543
  568   1HB   LEU  80          HB2       LEU  80  17.744  -6.440 -12.550
  569   2HB   LEU  80          HB3       LEU  80  17.072  -5.302 -11.445
  570    HG   LEU  80           HG       LEU  80  16.879  -6.800  -9.961
  571   1HD1  LEU  80          HD11      LEU  80  14.524  -6.644 -10.494
  572   2HD1  LEU  80          HD12      LEU  80  14.665  -8.036 -11.606
  573   3HD1  LEU  80          HD13      LEU  80  14.939  -8.234  -9.860
  574   1HD2  LEU  80          HD21      LEU  80  18.429  -8.258 -11.075
  575   2HD2  LEU  80          HD22      LEU  80  17.189  -9.183 -10.225
  576   3HD2  LEU  80          HD23      LEU  80  17.101  -9.018 -11.989
  577    H    SER  81           H        SER  81  15.946  -5.146 -15.593
  578    HA   SER  81           HA       SER  81  17.671  -2.994 -15.636
  579   1HB   SER  81          HB2       SER  81  15.499  -3.697 -17.639
  580   2HB   SER  81          HB3       SER  81  17.153  -3.149 -17.909
  581    HG   SER  81           HG       SER  81  16.170  -5.627 -17.746
  582    H    ALA  82           H        ALA  82  14.526  -3.084 -14.465
  583    HA   ALA  82           HA       ALA  82  13.971  -0.217 -15.093
  584   1HB   ALA  82          HB1       ALA  82  11.585  -0.787 -14.768
  585   2HB   ALA  82          HB2       ALA  82  12.307  -1.724 -16.088
  586   3HB   ALA  82          HB3       ALA  82  12.030  -2.487 -14.509
  587    H    VAL  83           H        VAL  83  15.417  -1.998 -12.762
  588    HA   VAL  83           HA       VAL  83  14.430  -0.104 -10.710
  589    HB   VAL  83           HB       VAL  83  13.299  -1.992 -10.055
  590   1HG1  VAL  83          HG11      VAL  83  15.738  -3.717 -10.535
  591   2HG1  VAL  83          HG12      VAL  83  14.214  -4.274  -9.814
  592   3HG1  VAL  83          HG13      VAL  83  14.235  -3.715 -11.487
  593   1HG2  VAL  83          HG21      VAL  83  14.657  -1.080  -8.145
  594   2HG2  VAL  83          HG22      VAL  83  14.188  -2.769  -8.005
  595   3HG2  VAL  83          HG23      VAL  83  15.846  -2.359  -8.448
  596    H    ARG  84           H        ARG  84  15.923   0.452  -9.054
  597    HA   ARG  84           HA       ARG  84  18.778   0.061  -9.826
  598   1HB   ARG  84          HB2       ARG  84  19.328   2.146  -9.022
  599   2HB   ARG  84          HB3       ARG  84  17.815   2.463  -9.863
  600   1HG   ARG  84          HG2       ARG  84  16.653   2.261  -7.572
  601   2HG   ARG  84          HG3       ARG  84  18.268   2.228  -6.847
  602   1HD   ARG  84          HD2       ARG  84  16.954   4.471  -8.381
  603   2HD   ARG  84          HD3       ARG  84  17.477   4.468  -6.693
  604    HE   ARG  84           HE       ARG  84  19.840   4.209  -7.578
  605   1HH1  ARG  84          HH11      ARG  84  17.367   5.926  -9.523
  606   2HH1  ARG  84          HH12      ARG  84  18.518   6.633 -10.591
  607   1HH2  ARG  84          HH21      ARG  84  21.279   4.987  -9.099
  608   2HH2  ARG  84          HH22      ARG  84  20.826   6.182 -10.288
  609    H    PHE  85           H        PHE  85  20.240  -0.351  -8.025
  610    HA   PHE  85           HA       PHE  85  18.876  -1.570  -5.657
  611   1HB   PHE  85          HB2       PHE  85  21.080  -2.520  -7.496
  612   2HB   PHE  85          HB3       PHE  85  21.158  -2.913  -5.801
  613    HD1  PHE  85           HD1      PHE  85  20.629  -5.144  -5.463
  614    HD2  PHE  85           HD2      PHE  85  18.245  -2.868  -8.249
  615    HE1  PHE  85           HE1      PHE  85  19.178  -7.114  -5.862
  616    HE2  PHE  85           HE2      PHE  85  16.810  -4.831  -8.629
  617    HZ   PHE  85           HZ       PHE  85  17.302  -6.977  -7.481
  618    H    GLY  86           H        GLY  86  20.067  -1.374  -3.699
  619   1HA   GLY  86          HA2       GLY  86  22.563   0.238  -3.732
  620   2HA   GLY  86          HA3       GLY  86  21.265   0.664  -2.608
  621    H    ALA  87           H        ALA  87  24.095  -0.876  -2.577
  622    HA   ALA  87           HA       ALA  87  23.286  -3.425  -1.285
  623   1HB   ALA  87          HB1       ALA  87  25.001  -3.510  -3.076
  624   2HB   ALA  87          HB2       ALA  87  26.002  -2.343  -2.177
  625   3HB   ALA  87          HB3       ALA  87  25.703  -3.947  -1.509
  626    H    ILE  88           H        ILE  88  23.610  -3.747   0.903
  627    HA   ILE  88           HA       ILE  88  24.824  -1.564   2.523
  628    HB   ILE  88           HB       ILE  88  22.170  -2.984   2.927
  629   1HG1  ILE  88          HG12      ILE  88  22.768  -0.252   1.778
  630   2HG1  ILE  88          HG13      ILE  88  21.776  -1.537   1.106
  631   1HG2  ILE  88          HG21      ILE  88  23.233  -0.634   4.533
  632   2HG2  ILE  88          HG22      ILE  88  21.767  -1.588   4.819
  633   3HG2  ILE  88          HG23      ILE  88  23.341  -2.329   5.023
  634   1HD1  ILE  88          HD11      ILE  88  21.062   0.246   3.450
  635   2HD1  ILE  88          HD12      ILE  88  20.389   0.291   1.829
  636   3HD1  ILE  88          HD13      ILE  88  20.062  -1.110   2.868
  637    H    GLY  89           H        GLY  89  26.309  -2.426   3.896
  638   1HA   GLY  89          HA2       GLY  89  27.322  -3.865   5.379
  639   2HA   GLY  89          HA3       GLY  89  25.884  -4.893   5.339
  640    H    ILE  90           H        ILE  90  26.427  -4.854   2.203
  641    HA   ILE  90           HA       ILE  90  27.711  -7.346   1.891
  642    HB   ILE  90           HB       ILE  90  27.436  -5.017  -0.047
  643   1HG1  ILE  90          HG12      ILE  90  25.224  -5.620   0.761
  644   2HG1  ILE  90          HG13      ILE  90  25.418  -6.105  -0.906
  645   1HG2  ILE  90          HG21      ILE  90  27.937  -7.955  -0.654
  646   2HG2  ILE  90          HG22      ILE  90  27.519  -6.712  -1.846
  647   3HG2  ILE  90          HG23      ILE  90  29.034  -6.586  -0.956
  648   1HD1  ILE  90          HD11      ILE  90  25.601  -8.005   1.457
  649   2HD1  ILE  90          HD12      ILE  90  24.188  -7.766   0.418
  650   3HD1  ILE  90          HD13      ILE  90  25.670  -8.446  -0.268
  651    H    GLY  91           H        GLY  91  29.840  -7.945   1.743
  652   1HA   GLY  91          HA2       GLY  91  31.911  -5.869   2.339
  653   2HA   GLY  91          HA3       GLY  91  32.066  -7.613   2.564
  654    H    SER  92           H        SER  92  30.767  -8.032  -0.168
  655    HA   SER  92           HA       SER  92  33.052  -8.714  -1.459
  656   1HB   SER  92          HB2       SER  92  30.348  -8.193  -2.699
  657   2HB   SER  92          HB3       SER  92  31.586  -9.335  -3.275
  658    HG   SER  92           HG       SER  92  30.073 -10.458  -2.065
  659    H    ARG  93           H        ARG  93  31.452  -5.595  -1.754
  660    HA   ARG  93           HA       ARG  93  32.731  -4.816  -4.212
  661   1HB   ARG  93          HB2       ARG  93  30.596  -3.944  -3.051
  662   2HB   ARG  93          HB3       ARG  93  31.646  -2.995  -2.013
  663   1HG   ARG  93          HG2       ARG  93  31.609  -2.790  -5.056
  664   2HG   ARG  93          HG3       ARG  93  30.495  -1.907  -4.043
  665   1HD   ARG  93          HD2       ARG  93  33.498  -1.489  -4.158
  666   2HD   ARG  93          HD3       ARG  93  32.222  -0.455  -4.766
  667    HE   ARG  93           HE       ARG  93  32.128  -0.998  -1.871
  668   1HH1  ARG  93          HH21      ARG  93  33.225   1.260  -4.407
  669   2HH1  ARG  93          HH22      ARG  93  33.357   2.595  -3.319
  670   1HH2  ARG  93          HH11      ARG  93  32.456   0.729  -0.455
  671   2HH2  ARG  93          HH12      ARG  93  32.724   2.357  -1.079
  672    H    GLU  94           H        GLU  94  33.900  -5.002  -0.910
  673    HA   GLU  94           HA       GLU  94  36.289  -3.398  -1.638
  674   1HB   GLU  94          HB2       GLU  94  35.924  -2.126   0.557
  675   2HB   GLU  94          HB3       GLU  94  34.983  -1.657  -0.863
  676   1HG   GLU  94          HG2       GLU  94  33.015  -2.934   0.058
  677   2HG   GLU  94          HG3       GLU  94  33.956  -3.289   1.505
  678    H    TYR  95           H        TYR  95  34.825  -4.861   1.220
  679    HA   TYR  95           HA       TYR  95  37.103  -5.130   2.722
  680   1HB   TYR  95          HB2       TYR  95  34.803  -5.394   3.568
  681   2HB   TYR  95          HB3       TYR  95  34.668  -6.953   2.758
  682    HD1  TYR  95           HD1      TYR  95  36.588  -5.100   5.397
  683    HD2  TYR  95           HD2      TYR  95  35.449  -8.956   3.822
  684    HE1  TYR  95           HE1      TYR  95  37.651  -6.207   7.340
  685    HE2  TYR  95           HE2      TYR  95  36.501 -10.068   5.756
  686    HH   TYR  95           HH       TYR  95  37.743  -9.781   7.715
  687    H    ASP  96           H        ASP  96  35.890  -7.575   0.392
  688    HA   ASP  96           HA       ASP  96  38.571  -8.870   0.555
  689   1HB   ASP  96          HB2       ASP  96  36.843 -10.099   1.922
  690   2HB   ASP  96          HB3       ASP  96  35.972 -10.415   0.426
  691    H    THR  97           H        THR  97  37.045  -7.038  -1.277
  692    HA   THR  97           HA       THR  97  36.912  -6.456  -3.389
  693    HB   THR  97           HB       THR  97  38.815  -7.037  -4.808
  694    HG1  THR  97           HG1      THR  97  38.960  -9.167  -3.060
  695   1HG2  THR  97          HG21      THR  97  39.103  -5.379  -2.982
  696   2HG2  THR  97          HG22      THR  97  39.676  -6.668  -1.904
  697   3HG2  THR  97          HG23      THR  97  40.597  -6.249  -3.362
  698    H    PHE  98           H        PHE  98  36.511  -6.837  -5.643
  699    HA   PHE  98           HA       PHE  98  34.412  -8.595  -6.132
  700   1HB   PHE  98          HB2       PHE  98  36.316  -7.424  -8.197
  701   2HB   PHE  98          HB3       PHE  98  34.657  -7.924  -8.463
  702    HD1  PHE  98           HD1      PHE  98  36.834  -5.192  -7.465
  703    HD2  PHE  98           HD2      PHE  98  32.761  -6.615  -7.350
  704    HE1  PHE  98           HE1      PHE  98  36.038  -2.891  -6.991
  705    HE2  PHE  98           HE2      PHE  98  31.970  -4.312  -6.902
  706    HZ   PHE  98           HZ       PHE  98  33.608  -2.441  -6.717
  707    H    CYS  99           H        CYS  99  37.829  -9.276  -6.231
  708    HA   CYS  99           HA       CYS  99  37.432 -11.753  -7.815
  709   1HB   CYS  99          HB2       CYS  99  39.881 -11.425  -8.367
  710   2HB   CYS  99          HB3       CYS  99  38.787 -10.200  -9.014
  711    HG   CYS  99           HG       CYS  99  40.649 -10.043  -6.268
  712    H    GLY 100           H        GLY 100  37.078 -11.353  -4.851
  713   1HA   GLY 100          HA2       GLY 100  38.629 -13.751  -4.070
  714   2HA   GLY 100          HA3       GLY 100  38.832 -12.290  -3.085
  715    H    ALA 101           H        ALA 101  36.239 -11.229  -3.091
  716    HA   ALA 101           HA       ALA 101  34.878 -12.791  -1.167
  717   1HB   ALA 101          HB1       ALA 101  33.836 -10.544  -2.952
  718   2HB   ALA 101          HB2       ALA 101  33.132 -11.065  -1.413
  719   3HB   ALA 101          HB3       ALA 101  34.737 -10.302  -1.444
  720    H    ILE 102           H        ILE 102  32.523 -13.342  -1.357
  721    HA   ILE 102           HA       ILE 102  31.870 -15.029  -3.629
  722    HB   ILE 102           HB       ILE 102  29.802 -15.483  -2.414
  723   1HG1  ILE 102          HG12      ILE 102  30.756 -13.491  -0.302
  724   2HG1  ILE 102          HG13      ILE 102  29.396 -13.242  -1.387
  725   1HG2  ILE 102          HG21      ILE 102  31.989 -16.650  -1.936
  726   2HG2  ILE 102          HG22      ILE 102  32.193 -15.591  -0.524
  727   3HG2  ILE 102          HG23      ILE 102  30.826 -16.720  -0.618
  728   1HD1  ILE 102          HD11      ILE 102  28.255 -15.225  -0.408
  729   2HD1  ILE 102          HD12      ILE 102  29.597 -15.399   0.750
  730   3HD1  ILE 102          HD13      ILE 102  28.590 -13.951   0.784
  731    H    ASP 103           H        ASP 103  32.407 -12.466  -4.520
  732    HA   ASP 103           HA       ASP 103  30.286 -10.623  -4.711
  733   1HB   ASP 103          HB2       ASP 103  32.709 -10.176  -5.110
  734   2HB   ASP 103          HB3       ASP 103  32.615 -11.102  -6.607
  735    H    LYS 104           H        LYS 104  30.650 -13.623  -6.395
  736    HA   LYS 104           HA       LYS 104  29.405 -13.130  -8.851
  737   1HB   LYS 104          HB2       LYS 104  29.196 -15.601  -7.093
  738   2HB   LYS 104          HB3       LYS 104  28.703 -15.501  -8.787
  739   1HG   LYS 104          HG2       LYS 104  31.045 -14.884  -9.369
  740   2HG   LYS 104          HG3       LYS 104  31.516 -15.091  -7.682
  741   1HD   LYS 104          HD2       LYS 104  32.150 -17.071  -8.864
  742   2HD   LYS 104          HD3       LYS 104  30.795 -17.488  -7.803
  743   1HE   LYS 104          HE2       LYS 104  29.238 -17.353  -9.733
  744   2HE   LYS 104          HE3       LYS 104  30.568 -16.853 -10.786
  745   1HZ   LYS 104          HZ1       LYS 104  30.386 -19.477  -9.419
  746   2HZ   LYS 104          HZ2       LYS 104  30.101 -19.210 -11.001
  747   3HZ   LYS 104          HZ3       LYS 104  31.603 -19.009 -10.406
  748    H    LEU 105           H        LEU 105  27.916 -13.214  -5.643
  749    HA   LEU 105           HA       LEU 105  25.213 -13.541  -6.477
  750   1HB   LEU 105          HB2       LEU 105  26.124 -13.698  -4.136
  751   2HB   LEU 105          HB3       LEU 105  26.335 -11.959  -4.108
  752    HG   LEU 105           HG       LEU 105  24.368 -12.742  -2.893
  753   1HD1  LEU 105          HD11      LEU 105  23.323 -11.167  -5.262
  754   2HD1  LEU 105          HD12      LEU 105  22.747 -11.155  -3.597
  755   3HD1  LEU 105          HD13      LEU 105  24.329 -10.459  -3.974
  756   1HD2  LEU 105          HD21      LEU 105  23.857 -14.691  -4.329
  757   2HD2  LEU 105          HD22      LEU 105  22.423 -13.716  -3.976
  758   3HD2  LEU 105          HD23      LEU 105  23.197 -13.595  -5.566
  759    H    GLU 106           H        GLU 106  27.093 -10.522  -5.774
  760    HA   GLU 106           HA       GLU 106  25.117  -8.716  -6.774
  761   1HB   GLU 106          HB2       GLU 106  28.076  -8.365  -6.394
  762   2HB   GLU 106          HB3       GLU 106  26.981  -7.106  -6.939
  763   1HG   GLU 106          HG2       GLU 106  26.777  -8.604  -4.294
  764   2HG   GLU 106          HG3       GLU 106  27.317  -6.956  -4.571
  765    H    ALA 107           H        ALA 107  27.835 -10.503  -8.309
  766    HA   ALA 107           HA       ALA 107  27.868  -9.066 -10.735
  767   1HB   ALA 107          HB1       ALA 107  29.601 -10.749 -10.002
  768   2HB   ALA 107          HB2       ALA 107  28.448 -12.038 -10.449
  769   3HB   ALA 107          HB3       ALA 107  29.055 -10.931 -11.682
  770    H    GLU 108           H        GLU 108  26.011 -12.076  -9.860
  771    HA   GLU 108           HA       GLU 108  24.642 -12.294 -12.346
  772   1HB   GLU 108          HB2       GLU 108  24.156 -13.233  -9.523
  773   2HB   GLU 108          HB3       GLU 108  22.863 -13.394 -10.691
  774   1HG   GLU 108          HG2       GLU 108  25.629 -14.598 -11.145
  775   2HG   GLU 108          HG3       GLU 108  24.285 -15.404 -10.347
  776    H    LEU 109           H        LEU 109  23.812 -10.471  -9.349
  777    HA   LEU 109           HA       LEU 109  21.216  -9.665 -10.191
  778   1HB   LEU 109          HB2       LEU 109  23.281  -8.558  -8.255
  779   2HB   LEU 109          HB3       LEU 109  21.829  -7.624  -8.605
  780    HG   LEU 109           HG       LEU 109  21.816 -10.472  -7.532
  781   1HD1  LEU 109          HD11      LEU 109  21.174  -9.414  -5.385
  782   2HD1  LEU 109          HD12      LEU 109  22.783  -8.903  -5.915
  783   3HD1  LEU 109          HD13      LEU 109  21.410  -7.806  -6.112
  784   1HD2  LEU 109          HD21      LEU 109  19.411  -9.867  -6.967
  785   2HD2  LEU 109          HD22      LEU 109  19.597  -8.422  -7.979
  786   3HD2  LEU 109          HD23      LEU 109  19.724 -10.038  -8.693
  787    H    LYS 110           H        LYS 110  24.381  -7.995 -10.601
  788    HA   LYS 110           HA       LYS 110  23.248  -5.733 -11.933
  789   1HB   LYS 110          HB2       LYS 110  26.073  -6.874 -11.892
  790   2HB   LYS 110          HB3       LYS 110  25.650  -5.270 -12.509
  791   1HG   LYS 110          HG2       LYS 110  24.913  -4.525 -10.318
  792   2HG   LYS 110          HG3       LYS 110  24.996  -6.122  -9.649
  793   1HD   LYS 110          HD2       LYS 110  26.948  -5.349  -8.794
  794   2HD   LYS 110          HD3       LYS 110  27.559  -6.020 -10.304
  795   1HE   LYS 110          HE2       LYS 110  27.295  -3.690 -11.335
  796   2HE   LYS 110          HE3       LYS 110  26.866  -3.099  -9.732
  797   1HZ   LYS 110          HZ1       LYS 110  29.057  -3.805  -8.954
  798   2HZ   LYS 110          HZ2       LYS 110  29.456  -4.353 -10.443
  799   3HZ   LYS 110          HZ3       LYS 110  29.208  -2.764 -10.199
  800    H    ASN 111           H        ASN 111  24.538  -8.849 -13.062
  801    HA   ASN 111           HA       ASN 111  24.384  -8.316 -15.880
  802   1HB   ASN 111          HB2       ASN 111  25.681 -10.131 -15.558
  803   2HB   ASN 111          HB3       ASN 111  24.952 -10.551 -14.053
  804   1HD2  ASN 111          HD22      ASN 111  22.972 -11.695 -13.920
  805   2HD2  ASN 111          HD21      ASN 111  23.164 -13.124 -14.837
  806    H    SER 112           H        SER 112  22.002  -9.387 -13.464
  807    HA   SER 112           HA       SER 112  20.083 -10.336 -15.347
  808   1HB   SER 112          HB2       SER 112  19.698  -9.371 -12.515
  809   2HB   SER 112          HB3       SER 112  18.501 -10.251 -13.477
  810    HG   SER 112           HG       SER 112  21.053 -11.160 -12.624
  811    H    GLY 113           H        GLY 113  20.757  -7.065 -14.007
  812   1HA   GLY 113          HA2       GLY 113  19.960  -5.745 -16.241
  813   2HA   GLY 113          HA3       GLY 113  18.442  -5.890 -15.364
  814    H    ALA 114           H        ALA 114  19.543  -5.502 -12.658
  815    HA   ALA 114           HA       ALA 114  19.286  -2.650 -12.674
  816   1HB   ALA 114          HB1       ALA 114  19.769  -4.698 -10.480
  817   2HB   ALA 114          HB2       ALA 114  19.711  -2.957 -10.154
  818   3HB   ALA 114          HB3       ALA 114  18.304  -3.732 -10.830
  819    H    LYS 115           H        LYS 115  20.807  -1.324 -11.154
  820    HA   LYS 115           HA       LYS 115  23.637  -2.118 -11.367
  821   1HB   LYS 115          HB2       LYS 115  24.268   0.227 -11.865
  822   2HB   LYS 115          HB3       LYS 115  23.408  -0.557 -13.188
  823   1HG   LYS 115          HG2       LYS 115  21.332   0.640 -12.606
  824   2HG   LYS 115          HG3       LYS 115  22.124   1.380 -11.204
  825   1HD   LYS 115          HD2       LYS 115  23.728   2.523 -12.710
  826   2HD   LYS 115          HD3       LYS 115  22.958   1.754 -14.116
  827   1HE   LYS 115          HE2       LYS 115  20.806   2.863 -13.529
  828   2HE   LYS 115          HE3       LYS 115  21.588   3.647 -12.150
  829   1HZ   LYS 115          HZ1       LYS 115  23.045   4.797 -13.721
  830   2HZ   LYS 115          HZ2       LYS 115  22.324   4.067 -14.992
  831   3HZ   LYS 115          HZ3       LYS 115  21.485   5.113 -14.070
  832    H    GLN 116           H        GLN 116  24.841  -1.432  -9.593
  833    HA   GLN 116           HA       GLN 116  23.366  -0.741  -7.160
  834   1HB   GLN 116          HB2       GLN 116  25.208  -2.313  -6.997
  835   2HB   GLN 116          HB3       GLN 116  26.311  -1.146  -7.741
  836   1HG   GLN 116          HG2       GLN 116  25.977   0.394  -5.817
  837   2HG   GLN 116          HG3       GLN 116  24.837  -0.741  -5.092
  838   1HE2  GLN 116          HE22      GLN 116  26.859   0.138  -3.559
  839   2HE2  GLN 116          HE21      GLN 116  28.029  -1.133  -3.276
  840    H    THR 117           H        THR 117  22.972   1.357  -6.609
  841    HA   THR 117           HA       THR 117  24.339   3.564  -8.062
  842    HB   THR 117           HB       THR 117  22.116   3.564  -5.986
  843    HG1  THR 117           HG1      THR 117  21.739   2.512  -8.060
  844   1HG2  THR 117          HG21      THR 117  21.592   5.824  -6.864
  845   2HG2  THR 117          HG22      THR 117  23.205   5.800  -6.158
  846   3HG2  THR 117          HG23      THR 117  23.028   5.746  -7.921
  847    H    GLY 118           H        GLY 118  25.456   5.248  -6.848
  848   1HA   GLY 118          HA2       GLY 118  26.589   6.234  -5.134
  849   2HA   GLY 118          HA3       GLY 118  25.651   5.235  -4.023
  850    H    GLU 119           H        GLU 119  27.037   4.304  -2.712
  851    HA   GLU 119           HA       GLU 119  28.819   2.287  -3.767
  852   1HB   GLU 119          HB2       GLU 119  30.788   2.850  -2.679
  853   2HB   GLU 119          HB3       GLU 119  30.310   4.328  -3.494
  854   1HG   GLU 119          HG2       GLU 119  29.459   5.239  -1.348
  855   2HG   GLU 119          HG3       GLU 119  29.935   3.748  -0.524
  856    H    THR 120           H        THR 120  29.427   0.738  -1.979
  857    HA   THR 120           HA       THR 120  27.110  -0.093  -0.806
  858    HB   THR 120           HB       THR 120  29.923  -0.858   0.042
  859    HG1  THR 120           HG1      THR 120  29.620  -2.357  -1.733
  860   1HG2  THR 120          HG21      THR 120  27.280  -2.382  -0.063
  861   2HG2  THR 120          HG22      THR 120  28.870  -3.124   0.193
  862   3HG2  THR 120          HG23      THR 120  28.228  -1.988   1.389
  863    H    LEU 121           H        LEU 121  26.027   0.268   0.939
  864    HA   LEU 121           HA       LEU 121  26.815   2.276   2.919
  865   1HB   LEU 121          HB2       LEU 121  24.415   1.430   1.705
  866   2HB   LEU 121          HB3       LEU 121  24.324   0.712   3.300
  867    HG   LEU 121           HG       LEU 121  24.686   3.620   2.613
  868   1HD1  LEU 121          HD11      LEU 121  22.419   3.916   3.470
  869   2HD1  LEU 121          HD12      LEU 121  22.427   2.706   2.176
  870   3HD1  LEU 121          HD13      LEU 121  22.318   2.187   3.873
  871   1HD2  LEU 121          HD21      LEU 121  25.800   3.274   4.770
  872   2HD2  LEU 121          HD22      LEU 121  24.282   4.119   5.025
  873   3HD2  LEU 121          HD23      LEU 121  24.366   2.390   5.385
  874    H    LYS 122           H        LYS 122  26.204   1.527   5.328
  875    HA   LYS 122           HA       LYS 122  26.977  -1.288   5.829
  876   1HB   LYS 122          HB2       LYS 122  28.431   1.185   6.904
  877   2HB   LYS 122          HB3       LYS 122  28.422  -0.353   7.743
  878   1HG   LYS 122          HG2       LYS 122  30.354  -0.625   6.581
  879   2HG   LYS 122          HG3       LYS 122  29.230  -1.360   5.441
  880   1HD   LYS 122          HD2       LYS 122  29.140   0.962   4.273
  881   2HD   LYS 122          HD3       LYS 122  30.457   1.432   5.327
  882   1HE   LYS 122          HE2       LYS 122  31.791  -0.516   4.442
  883   2HE   LYS 122          HE3       LYS 122  30.436  -0.921   3.372
  884   1HZ   LYS 122          HZ1       LYS 122  30.714   1.247   2.334
  885   2HZ   LYS 122          HZ2       LYS 122  32.032   1.559   3.335
  886   3HZ   LYS 122          HZ3       LYS 122  32.091   0.339   2.234
  887    H    ILE 123           H        ILE 123  26.377  -1.998   7.895
  888    HA   ILE 123           HA       ILE 123  24.831  -0.181   9.610
  889    HB   ILE 123           HB       ILE 123  23.126  -1.774  10.041
  890   1HG1  ILE 123          HG12      ILE 123  24.006  -3.934   9.736
  891   2HG1  ILE 123          HG13      ILE 123  22.592  -3.724   8.722
  892   1HG2  ILE 123          HG21      ILE 123  22.707  -0.110   8.341
  893   2HG2  ILE 123          HG22      ILE 123  23.249  -1.223   7.079
  894   3HG2  ILE 123          HG23      ILE 123  21.795  -1.595   8.023
  895   1HD1  ILE 123          HD11      ILE 123  24.183  -5.015   7.509
  896   2HD1  ILE 123          HD12      ILE 123  24.117  -3.429   6.735
  897   3HD1  ILE 123          HD13      ILE 123  25.483  -3.852   7.793
  898    H    ASN 124           H        ASN 124  25.289  -0.534  11.772
  899    HA   ASN 124           HA       ASN 124  25.972  -2.996  12.876
  900   1HB   ASN 124          HB2       ASN 124  28.309  -1.765  11.732
  901   2HB   ASN 124          HB3       ASN 124  28.414  -1.478  13.457
  902   1HD2  ASN 124          HD21      ASN 124  27.864  -4.011  11.011
  903   2HD2  ASN 124          HD22      ASN 124  28.610  -5.325  11.939
  904    H    ILE 125           H        ILE 125  26.845  -2.547  15.258
  905    HA   ILE 125           HA       ILE 125  26.069   0.067  16.310
  906    HB   ILE 125           HB       ILE 125  24.659  -0.938  18.080
  907   1HG1  ILE 125          HG12      ILE 125  24.665  -3.490  16.404
  908   2HG1  ILE 125          HG13      ILE 125  25.476  -3.280  17.958
  909   1HG2  ILE 125          HG21      ILE 125  23.687   0.131  16.024
  910   2HG2  ILE 125          HG22      ILE 125  23.456  -1.496  15.344
  911   3HG2  ILE 125          HG23      ILE 125  22.615  -1.012  16.830
  912   1HD1  ILE 125          HD11      ILE 125  22.474  -3.226  17.473
  913   2HD1  ILE 125          HD12      ILE 125  23.418  -4.449  18.336
  914   3HD1  ILE 125          HD13      ILE 125  23.255  -2.821  19.025
  915    H    LEU 126           H        LEU 126  26.839   0.358  18.441
  916    HA   LEU 126           HA       LEU 126  28.107   0.313  20.206
  917   1HB   LEU 126          HB2       LEU 126  26.837  -1.732  20.666
  918   2HB   LEU 126          HB3       LEU 126  28.082  -2.697  19.872
  919    HG   LEU 126           HG       LEU 126  29.735  -2.024  21.597
  920   1HD1  LEU 126          HD11      LEU 126  28.855   0.161  22.313
  921   2HD1  LEU 126          HD12      LEU 126  27.366  -0.607  22.911
  922   3HD1  LEU 126          HD13      LEU 126  28.930  -0.933  23.692
  923   1HD2  LEU 126          HD21      LEU 126  27.152  -3.181  22.721
  924   2HD2  LEU 126          HD22      LEU 126  28.412  -4.082  21.850
  925   3HD2  LEU 126          HD23      LEU 126  28.778  -3.357  23.422
  926    H    ASP 127           H        ASP 127  29.692  -1.832  17.744
  927    HA   ASP 127           HA       ASP 127  32.310  -0.622  18.388
  928   1HB   ASP 127          HB2       ASP 127  31.895  -2.417  20.107
  929   2HB   ASP 127          HB3       ASP 127  31.718  -3.585  18.800
  930    H    HIS 128           H        HIS 128  34.042  -1.772  17.032
  931    HA   HIS 128           HA       HIS 128  33.408  -1.904  14.234
  932   1HB   HIS 128          HB2       HIS 128  35.621  -1.281  15.150
  933   2HB   HIS 128          HB3       HIS 128  35.803  -2.892  15.844
  934    HD1  HIS 128           HD1      HIS 128  36.720  -4.778  14.197
  935    HD2  HIS 128           HD2      HIS 128  35.724  -1.108  12.380
  936    HE1  HIS 128           HE1      HIS 128  37.563  -4.914  11.802
  937    H    ASP 129           H        ASP 129  33.790  -3.912  12.896
  938    HA   ASP 129           HA       ASP 129  32.991  -6.445  14.126
  939   1HB   ASP 129          HB2       ASP 129  30.921  -5.099  13.766
  940   2HB   ASP 129          HB3       ASP 129  31.210  -4.872  12.154
  941    H    ILE 130           H        ILE 130  32.160  -5.513  11.092
  942    HA   ILE 130           HA       ILE 130  34.632  -6.309   9.632
  943    HB   ILE 130           HB       ILE 130  31.842  -7.342   9.008
  944   1HG1  ILE 130          HG12      ILE 130  33.072  -8.706  10.621
  945   2HG1  ILE 130          HG13      ILE 130  32.709  -9.534   9.124
  946   1HG2  ILE 130          HG21      ILE 130  32.722  -6.613   6.884
  947   2HG2  ILE 130          HG22      ILE 130  34.301  -7.346   7.220
  948   3HG2  ILE 130          HG23      ILE 130  32.879  -8.372   6.960
  949   1HD1  ILE 130          HD11      ILE 130  35.024  -9.336   8.369
  950   2HD1  ILE 130          HD12      ILE 130  35.446  -8.376   9.809
  951   3HD1  ILE 130          HD13      ILE 130  34.961 -10.071   9.975
  952    HA   PRO 131           HA       PRO 131  31.855  -2.770   7.504
  953   1HB   PRO 131          HB2       PRO 131  30.385  -2.492  10.143
  954   2HB   PRO 131          HB3       PRO 131  29.962  -1.689   8.606
  955   1HG   PRO 131          HG2       PRO 131  28.789  -4.008   9.001
  956   2HG   PRO 131          HG3       PRO 131  29.742  -3.683   7.491
  957   1HD   PRO 131          HD2       PRO 131  30.582  -5.255   9.976
  958   2HD   PRO 131          HD3       PRO 131  30.787  -5.686   8.250
  959    H    GLU 132           H        GLU 132  31.466  -0.603   8.200
  960    HA   GLU 132           HA       GLU 132  33.472   0.610  10.008
  961   1HB   GLU 132          HB2       GLU 132  34.025   2.380   8.441
  962   2HB   GLU 132          HB3       GLU 132  34.480   0.808   7.773
  963   1HG   GLU 132          HG2       GLU 132  32.432   0.801   6.385
  964   2HG   GLU 132          HG3       GLU 132  31.968   2.378   7.034
  965    H    ASP 133           H        ASP 133  32.780   2.920  10.492
  966    HA   ASP 133           HA       ASP 133  30.291   2.851  11.711
  967   1HB   ASP 133          HB2       ASP 133  32.098   4.244  12.466
  968   2HB   ASP 133          HB3       ASP 133  32.054   5.200  10.983
  969    HA   PRO 134           HA       PRO 134  27.611   3.801   8.123
  970   1HB   PRO 134          HB2       PRO 134  25.604   4.067  10.359
  971   2HB   PRO 134          HB3       PRO 134  25.440   3.213   8.796
  972   1HG   PRO 134          HG2       PRO 134  25.887   1.822  11.084
  973   2HG   PRO 134          HG3       PRO 134  26.767   1.379   9.583
  974   1HD   PRO 134          HD2       PRO 134  27.758   3.044  11.900
  975   2HD   PRO 134          HD3       PRO 134  28.574   1.717  11.020
  976    H    ALA 135           H        ALA 135  26.266   5.702   7.470
  977    HA   ALA 135           HA       ALA 135  26.200   8.027   9.231
  978   1HB   ALA 135          HB1       ALA 135  27.309   9.516   7.600
  979   2HB   ALA 135          HB2       ALA 135  28.437   8.269   8.159
  980   3HB   ALA 135          HB3       ALA 135  27.682   8.132   6.554
  981    H    GLU 136           H        GLU 136  24.519   9.370   8.689
  982    HA   GLU 136           HA       GLU 136  22.419   8.477   6.978
  983   1HB   GLU 136          HB2       GLU 136  22.088   9.868   8.963
  984   2HB   GLU 136          HB3       GLU 136  23.042  11.177   8.255
  985   1HG   GLU 136          HG2       GLU 136  21.370  11.511   6.505
  986   2HG   GLU 136          HG3       GLU 136  20.432  10.125   7.085
  987    H    GLU 137           H        GLU 137  25.248  10.481   6.402
  988    HA   GLU 137           HA       GLU 137  24.517  11.903   4.129
  989   1HB   GLU 137          HB2       GLU 137  27.209  10.642   4.812
  990   2HB   GLU 137          HB3       GLU 137  26.948  11.859   3.555
  991   1HG   GLU 137          HG2       GLU 137  26.064  13.434   5.287
  992   2HG   GLU 137          HG3       GLU 137  26.435  12.243   6.536
  993    H    TRP 138           H        TRP 138  25.320   8.418   4.323
  994    HA   TRP 138           HA       TRP 138  25.585   7.945   1.519
  995   1HB   TRP 138          HB2       TRP 138  24.977   6.295   3.943
  996   2HB   TRP 138          HB3       TRP 138  24.368   5.704   2.425
  997    HD1  TRP 138           HD1      TRP 138  26.174   5.248   0.435
  998    HE1  TRP 138           HE1      TRP 138  28.432   4.105   0.601
  999    HE3  TRP 138           HE3      TRP 138  27.081   6.049   5.400
 1000    HZ2  TRP 138           HZ2      TRP 138  30.473   3.675   2.638
 1001    HZ3  TRP 138           HZ3      TRP 138  29.177   5.214   6.447
 1002    HH2  TRP 138           HH2      TRP 138  30.876   4.033   5.075
 1003    H    LEU 139           H        LEU 139  22.714   7.928   3.707
 1004    HA   LEU 139           HA       LEU 139  20.838   7.101   1.672
 1005   1HB   LEU 139          HB2       LEU 139  20.553   8.498   4.385
 1006   2HB   LEU 139          HB3       LEU 139  19.211   8.107   3.357
 1007    HG   LEU 139           HG       LEU 139  21.117   6.130   4.679
 1008   1HD1  LEU 139          HD11      LEU 139  18.152   6.727   5.101
 1009   2HD1  LEU 139          HD12      LEU 139  19.078   5.466   5.934
 1010   3HD1  LEU 139          HD13      LEU 139  19.480   7.170   6.194
 1011   1HD2  LEU 139          HD21      LEU 139  20.484   5.132   2.557
 1012   2HD2  LEU 139          HD22      LEU 139  19.533   4.362   3.824
 1013   3HD2  LEU 139          HD23      LEU 139  18.789   5.598   2.795
 1014    H    GLY 140           H        GLY 140  21.602  10.264   3.203
 1015   1HA   GLY 140          HA2       GLY 140  19.909  11.893   1.706
 1016   2HA   GLY 140          HA3       GLY 140  21.484  12.404   2.343
 1017    H    SER 141           H        SER 141  23.298  10.938   0.848
 1018    HA   SER 141           HA       SER 141  23.381  12.324  -1.619
 1019   1HB   SER 141          HB2       SER 141  25.332  11.431  -0.346
 1020   2HB   SER 141          HB3       SER 141  24.866   9.786  -0.817
 1021    HG   SER 141           HG       SER 141  26.463  10.743  -2.187
 1022    H    TRP 142           H        TRP 142  22.719   8.810  -0.964
 1023    HA   TRP 142           HA       TRP 142  22.257   8.068  -3.617
 1024   1HB   TRP 142          HB2       TRP 142  22.708   6.522  -1.827
 1025   2HB   TRP 142          HB3       TRP 142  21.233   6.992  -0.992
 1026    HD1  TRP 142           HD1      TRP 142  22.268   5.257  -4.262
 1027    HE1  TRP 142           HE1      TRP 142  20.412   3.620  -4.980
 1028    HE3  TRP 142           HE3      TRP 142  18.958   6.197  -0.508
 1029    HZ2  TRP 142           HZ2      TRP 142  17.924   2.627  -3.847
 1030    HZ3  TRP 142           HZ3      TRP 142  16.860   4.850  -0.318
 1031    HH2  TRP 142           HH2      TRP 142  16.360   3.064  -1.957
 1032    H    VAL 143           H        VAL 143  19.886   9.197  -1.181
 1033    HA   VAL 143           HA       VAL 143  17.551   8.987  -2.759
 1034    HB   VAL 143           HB       VAL 143  18.383  10.667  -0.377
 1035   1HG1  VAL 143          HG11      VAL 143  16.807  12.103  -1.487
 1036   2HG1  VAL 143          HG12      VAL 143  15.692  10.736  -1.767
 1037   3HG1  VAL 143          HG13      VAL 143  16.000  11.344  -0.117
 1038   1HG2  VAL 143          HG21      VAL 143  16.753   9.229   0.787
 1039   2HG2  VAL 143          HG22      VAL 143  16.364   8.406  -0.745
 1040   3HG2  VAL 143          HG23      VAL 143  17.974   8.251  -0.028
 1041    H    ASN 144           H        ASN 144  19.687  11.927  -2.253
 1042    HA   ASN 144           HA       ASN 144  18.077  13.352  -4.119
 1043   1HB   ASN 144          HB2       ASN 144  19.168  15.189  -3.576
 1044   2HB   ASN 144          HB3       ASN 144  19.773  14.226  -2.238
 1045   1HD2  ASN 144          HD22      ASN 144  21.840  12.778  -3.178
 1046   2HD2  ASN 144          HD21      ASN 144  23.055  13.809  -3.902
 1047    H    LEU 145           H        LEU 145  20.502  11.017  -4.702
 1048    HA   LEU 145           HA       LEU 145  21.062  11.863  -7.459
 1049   1HB   LEU 145          HB2       LEU 145  21.918   9.638  -5.639
 1050   2HB   LEU 145          HB3       LEU 145  21.747   9.206  -7.331
 1051    HG   LEU 145           HG       LEU 145  23.280  10.977  -8.021
 1052   1HD1  LEU 145          HD11      LEU 145  22.935  12.626  -6.204
 1053   2HD1  LEU 145          HD12      LEU 145  23.699  11.513  -5.051
 1054   3HD1  LEU 145          HD13      LEU 145  24.644  12.212  -6.382
 1055   1HD2  LEU 145          HD21      LEU 145  24.129   8.714  -7.508
 1056   2HD2  LEU 145          HD22      LEU 145  25.336   9.950  -7.122
 1057   3HD2  LEU 145          HD23      LEU 145  24.400   9.188  -5.817
 1058    H    LEU 146           H        LEU 146  19.046   9.274  -5.849
 1059    HA   LEU 146           HA       LEU 146  18.085   8.362  -8.364
 1060   1HB   LEU 146          HB2       LEU 146  16.837   6.867  -7.202
 1061   2HB   LEU 146          HB3       LEU 146  18.282   7.053  -6.245
 1062    HG   LEU 146           HG       LEU 146  16.659   8.698  -4.848
 1063   1HD1  LEU 146          HD11      LEU 146  14.711   6.707  -6.093
 1064   2HD1  LEU 146          HD12      LEU 146  14.370   7.753  -4.705
 1065   3HD1  LEU 146          HD13      LEU 146  14.650   8.466  -6.289
 1066   1HD2  LEU 146          HD21      LEU 146  16.144   6.806  -3.369
 1067   2HD2  LEU 146          HD22      LEU 146  16.553   5.663  -4.667
 1068   3HD2  LEU 146          HD23      LEU 146  17.802   6.711  -3.966
 1069    H    LYS 147           H        LYS 147  16.907  10.750  -6.094
 1070    HA   LYS 147           HA       LYS 147  14.311  11.214  -7.138
 1071   1HB   LYS 147          HB2       LYS 147  16.333  12.868  -5.589
 1072   2HB   LYS 147          HB3       LYS 147  14.867  13.614  -6.228
 1073   1HG   LYS 147          HG2       LYS 147  13.473  11.909  -5.056
 1074   2HG   LYS 147          HG3       LYS 147  14.942  11.232  -4.334
 1075   1HD   LYS 147          HD2       LYS 147  15.375  13.365  -3.179
 1076   2HD   LYS 147          HD3       LYS 147  13.968  14.106  -3.967
 1077   1HE   LYS 147          HE2       LYS 147  12.512  12.463  -2.866
 1078   2HE   LYS 147          HE3       LYS 147  13.895  11.700  -2.088
 1079   1HZ   LYS 147          HZ1       LYS 147  12.879  13.149  -0.539
 1080   2HZ   LYS 147          HZ2       LYS 147  14.285  13.864  -0.955
 1081   3HZ   LYS 147          HZ3       LYS 147  12.876  14.427  -1.569
  Start of MODEL   18
    1   1H    MET   1          H1        MET   1   1.645  -2.447   0.439
    2   2H    MET   1          H2        MET   1   3.246  -2.291   0.812
    3   3H    MET   1          H3        MET   1   2.148  -1.294   1.501
    4    HA   MET   1           HA       MET   1   2.773  -1.404  -1.360
    5   1HB   MET   1          HB2       MET   1   0.452  -0.652  -0.858
    6   2HB   MET   1          HB3       MET   1   1.092   0.636   0.174
    7   1HG   MET   1          HG2       MET   1   2.255   1.619  -1.781
    8   2HG   MET   1          HG3       MET   1   1.663   0.301  -2.801
    9   1HE   MET   1          HE1       MET   1  -0.278   3.426  -4.147
   10   2HE   MET   1          HE2       MET   1   1.385   3.386  -3.522
   11   3HE   MET   1          HE3       MET   1   0.791   2.066  -4.556
   12    H    ALA   2           H        ALA   2   4.653  -0.403  -1.947
   13    HA   ALA   2           HA       ALA   2   5.946   1.572  -0.196
   14   1HB   ALA   2          HB1       ALA   2   7.998   0.130  -0.095
   15   2HB   ALA   2          HB2       ALA   2   6.638  -0.586   0.789
   16   3HB   ALA   2          HB3       ALA   2   7.078  -1.196  -0.818
   17    H    ASP   3           H        ASP   3   7.919   2.399  -1.220
   18    HA   ASP   3           HA       ASP   3   7.901   2.352  -4.172
   19   1HB   ASP   3          HB2       ASP   3   7.931   4.525  -2.881
   20   2HB   ASP   3          HB3       ASP   3   9.467   4.054  -2.189
   21    H    ILE   4           H        ILE   4   9.632   1.245  -1.335
   22    HA   ILE   4           HA       ILE   4  11.811   0.106  -3.012
   23    HB   ILE   4           HB       ILE   4  12.170   1.252  -0.226
   24   1HG1  ILE   4          HG12      ILE   4  12.864   2.737  -2.791
   25   2HG1  ILE   4          HG13      ILE   4  11.545   3.163  -1.696
   26   1HG2  ILE   4          HG21      ILE   4  14.195   0.683  -2.441
   27   2HG2  ILE   4          HG22      ILE   4  14.540   1.077  -0.745
   28   3HG2  ILE   4          HG23      ILE   4  13.808  -0.464  -1.161
   29   1HD1  ILE   4          HD11      ILE   4  14.495   3.284  -1.030
   30   2HD1  ILE   4          HD12      ILE   4  13.378   4.633  -1.274
   31   3HD1  ILE   4          HD13      ILE   4  13.175   3.566   0.127
   32    H    THR   5           H        THR   5  12.143  -2.056  -2.610
   33    HA   THR   5           HA       THR   5  10.825  -3.323  -0.271
   34    HB   THR   5           HB       THR   5  10.455  -4.322  -2.516
   35    HG1  THR   5           HG1      THR   5  10.341  -5.710  -0.830
   36   1HG2  THR   5          HG21      THR   5  13.409  -4.986  -2.577
   37   2HG2  THR   5          HG22      THR   5  12.158  -5.572  -3.685
   38   3HG2  THR   5          HG23      THR   5  12.548  -3.850  -3.652
   39    H    LEU   6           H        LEU   6  12.069  -3.855   1.517
   40    HA   LEU   6           HA       LEU   6  15.017  -3.308   1.410
   41   1HB   LEU   6          HB2       LEU   6  12.901  -2.985   3.540
   42   2HB   LEU   6          HB3       LEU   6  14.553  -3.199   4.000
   43    HG   LEU   6           HG       LEU   6  13.610  -0.836   3.938
   44   1HD1  LEU   6          HD11      LEU   6  15.961  -1.293   4.297
   45   2HD1  LEU   6          HD12      LEU   6  16.244  -1.436   2.550
   46   3HD1  LEU   6          HD13      LEU   6  15.783   0.128   3.265
   47   1HD2  LEU   6          HD21      LEU   6  13.724   0.442   1.902
   48   2HD2  LEU   6          HD22      LEU   6  14.212  -0.998   0.985
   49   3HD2  LEU   6          HD23      LEU   6  12.584  -0.901   1.693
   50    H    ILE   7           H        ILE   7  15.668  -5.338   0.849
   51    HA   ILE   7           HA       ILE   7  14.632  -7.728   2.173
   52    HB   ILE   7           HB       ILE   7  17.192  -7.554   0.552
   53   1HG1  ILE   7          HG12      ILE   7  15.578  -6.595  -0.953
   54   2HG1  ILE   7          HG13      ILE   7  15.958  -8.225  -1.454
   55   1HG2  ILE   7          HG21      ILE   7  15.199  -9.783   1.119
   56   2HG2  ILE   7          HG22      ILE   7  16.699  -9.933   0.169
   57   3HG2  ILE   7          HG23      ILE   7  16.785  -9.573   1.893
   58   1HD1  ILE   7          HD11      ILE   7  13.410  -7.385   0.005
   59   2HD1  ILE   7          HD12      ILE   7  13.577  -7.709  -1.728
   60   3HD1  ILE   7          HD13      ILE   7  13.789  -9.030  -0.565
   61    H    SER   8           H        SER   8  14.947  -7.672   4.280
   62    HA   SER   8           HA       SER   8  17.102  -6.164   5.513
   63   1HB   SER   8          HB2       SER   8  14.694  -7.642   6.650
   64   2HB   SER   8          HB3       SER   8  15.691  -6.474   7.513
   65    HG   SER   8           HG       SER   8  14.306  -5.887   5.089
   66    H    GLY   9           H        GLY   9  17.561  -9.090   4.303
   67   1HA   GLY   9          HA2       GLY   9  19.341  -9.910   6.413
   68   2HA   GLY   9          HA3       GLY   9  17.903 -10.948   6.294
   69    H    SER  10           H        SER  10  20.584 -11.784   5.893
   70    HA   SER  10           HA       SER  10  20.952 -12.190   3.011
   71   1HB   SER  10          HB2       SER  10  23.054 -13.359   3.994
   72   2HB   SER  10          HB3       SER  10  22.933 -11.607   4.187
   73    HG   SER  10           HG       SER  10  23.529 -12.674   6.138
   74    H    THR  11           H        THR  11  19.959 -13.944   5.945
   75    HA   THR  11           HA       THR  11  19.810 -16.470   4.371
   76    HB   THR  11           HB       THR  11  21.728 -16.265   5.852
   77    HG1  THR  11           HG1      THR  11  21.087 -18.225   5.446
   78   1HG2  THR  11          HG21      THR  11  20.918 -14.886   7.680
   79   2HG2  THR  11          HG22      THR  11  19.803 -16.164   8.203
   80   3HG2  THR  11          HG23      THR  11  21.557 -16.416   8.283
   81    H    LEU  12           H        LEU  12  17.723 -14.926   4.112
   82    HA   LEU  12           HA       LEU  12  15.562 -14.511   4.436
   83   1HB   LEU  12          HB2       LEU  12  15.633 -17.162   4.248
   84   2HB   LEU  12          HB3       LEU  12  15.193 -17.101   5.946
   85    HG   LEU  12           HG       LEU  12  13.216 -15.568   5.197
   86   1HD1  LEU  12          HD11      LEU  12  14.037 -15.043   2.921
   87   2HD1  LEU  12          HD12      LEU  12  13.999 -16.767   2.496
   88   3HD1  LEU  12          HD13      LEU  12  12.496 -15.896   2.846
   89   1HD2  LEU  12          HD21      LEU  12  12.921 -17.903   5.917
   90   2HD2  LEU  12          HD22      LEU  12  11.836 -17.511   4.575
   91   3HD2  LEU  12          HD23      LEU  12  13.303 -18.473   4.277
   92    H    GLY  13           H        GLY  13  17.492 -13.669   6.390
   93   1HA   GLY  13          HA2       GLY  13  16.101 -12.334   8.390
   94   2HA   GLY  13          HA3       GLY  13  16.689 -13.868   9.080
   95    H    GLY  14           H        GLY  14  17.836 -11.436   9.986
   96   1HA   GLY  14          HA2       GLY  14  20.583 -11.647   9.719
   97   2HA   GLY  14          HA3       GLY  14  20.083 -10.645   8.355
   98    H    ALA  15           H        ALA  15  20.980  -8.752   9.097
   99    HA   ALA  15           HA       ALA  15  20.632  -7.663  11.738
  100   1HB   ALA  15          HB1       ALA  15  21.907  -5.791  10.845
  101   2HB   ALA  15          HB2       ALA  15  22.650  -7.307  10.324
  102   3HB   ALA  15          HB3       ALA  15  21.665  -6.361   9.180
  103    H    GLU  16           H        GLU  16  18.114  -8.186  11.062
  104    HA   GLU  16           HA       GLU  16  16.671  -6.411   9.472
  105   1HB   GLU  16          HB2       GLU  16  15.850  -8.006  11.925
  106   2HB   GLU  16          HB3       GLU  16  14.702  -7.153  10.879
  107   1HG   GLU  16          HG2       GLU  16  15.232  -8.539   8.987
  108   2HG   GLU  16          HG3       GLU  16  16.631  -9.245   9.795
  109    H    TYR  17           H        TYR  17  17.782  -5.927  12.815
  110    HA   TYR  17           HA       TYR  17  16.027  -3.832  13.550
  111   1HB   TYR  17          HB2       TYR  17  17.445  -4.956  15.168
  112   2HB   TYR  17          HB3       TYR  17  18.905  -4.417  14.347
  113    HD1  TYR  17           HD1      TYR  17  15.909  -3.193  16.245
  114    HD2  TYR  17           HD2      TYR  17  19.897  -2.294  14.853
  115    HE1  TYR  17           HE1      TYR  17  15.922  -1.131  17.619
  116    HE2  TYR  17           HE2      TYR  17  19.920  -0.235  16.218
  117    HH   TYR  17           HH       TYR  17  18.735   1.111  17.712
  118    H    VAL  18           H        VAL  18  19.275  -3.632  11.907
  119    HA   VAL  18           HA       VAL  18  18.970  -0.729  11.785
  120    HB   VAL  18           HB       VAL  18  21.145  -1.848  12.197
  121   1HG1  VAL  18          HG11      VAL  18  21.054  -3.659  10.518
  122   2HG1  VAL  18          HG12      VAL  18  21.162  -2.461   9.211
  123   3HG1  VAL  18          HG13      VAL  18  22.503  -2.667  10.356
  124   1HG2  VAL  18          HG21      VAL  18  20.928   0.520  11.492
  125   2HG2  VAL  18          HG22      VAL  18  22.444  -0.228  10.982
  126   3HG2  VAL  18          HG23      VAL  18  21.137   0.021   9.799
  127    H    ALA  19           H        ALA  19  18.346  -3.514   9.684
  128    HA   ALA  19           HA       ALA  19  17.934  -2.059   7.260
  129   1HB   ALA  19          HB1       ALA  19  16.430  -4.509   8.238
  130   2HB   ALA  19          HB2       ALA  19  16.601  -3.955   6.565
  131   3HB   ALA  19          HB3       ALA  19  18.023  -4.563   7.446
  132    H    GLU  20           H        GLU  20  15.664  -2.838   9.982
  133    HA   GLU  20           HA       GLU  20  13.443  -1.429   8.898
  134   1HB   GLU  20          HB2       GLU  20  13.425  -3.127  10.765
  135   2HB   GLU  20          HB3       GLU  20  14.118  -1.901  11.833
  136   1HG   GLU  20          HG2       GLU  20  12.140  -0.446  11.423
  137   2HG   GLU  20          HG3       GLU  20  11.476  -1.655  10.323
  138    H    HIS  21           H        HIS  21  16.141  -0.341  11.051
  139    HA   HIS  21           HA       HIS  21  15.131   2.269  11.506
  140   1HB   HIS  21          HB2       HIS  21  17.063   1.083  12.659
  141   2HB   HIS  21          HB3       HIS  21  18.073   1.559  11.292
  142    HD1  HIS  21           HD1      HIS  21  17.133   4.583  10.931
  143    HD2  HIS  21           HD2      HIS  21  17.658   2.617  14.607
  144    HE1  HIS  21           HE1      HIS  21  17.567   6.409  12.660
  145    H    LEU  22           H        LEU  22  17.238   0.997   8.898
  146    HA   LEU  22           HA       LEU  22  17.668   3.418   7.457
  147   1HB   LEU  22          HB2       LEU  22  17.618   0.456   6.792
  148   2HB   LEU  22          HB3       LEU  22  17.780   1.615   5.503
  149    HG   LEU  22           HG       LEU  22  19.652   1.618   7.919
  150   1HD1  LEU  22          HD11      LEU  22  19.806  -0.600   6.957
  151   2HD1  LEU  22          HD12      LEU  22  19.892   0.063   5.313
  152   3HD1  LEU  22          HD13      LEU  22  21.230   0.322   6.458
  153   1HD2  LEU  22          HD21      LEU  22  19.680   3.658   6.492
  154   2HD2  LEU  22          HD22      LEU  22  21.197   2.761   6.378
  155   3HD2  LEU  22          HD23      LEU  22  20.004   2.645   5.068
  156    H    ALA  23           H        ALA  23  15.272   0.814   7.002
  157    HA   ALA  23           HA       ALA  23  13.744   1.874   4.962
  158   1HB   ALA  23          HB1       ALA  23  11.981   0.401   5.707
  159   2HB   ALA  23          HB2       ALA  23  13.510  -0.407   6.083
  160   3HB   ALA  23          HB3       ALA  23  12.590   0.390   7.363
  161    H    GLU  24           H        GLU  24  13.324   2.492   8.490
  162    HA   GLU  24           HA       GLU  24  11.056   4.132   8.332
  163   1HB   GLU  24          HB2       GLU  24  12.235   3.105  10.375
  164   2HB   GLU  24          HB3       GLU  24  13.331   4.464  10.349
  165   1HG   GLU  24          HG2       GLU  24  11.433   6.013  10.582
  166   2HG   GLU  24          HG3       GLU  24  10.296   4.666  10.553
  167    H    LYS  25           H        LYS  25  14.514   5.130   8.565
  168    HA   LYS  25           HA       LYS  25  14.107   7.885   8.187
  169   1HB   LYS  25          HB2       LYS  25  16.394   6.025   7.393
  170   2HB   LYS  25          HB3       LYS  25  16.500   7.763   7.261
  171   1HG   LYS  25          HG2       LYS  25  15.973   6.163   9.820
  172   2HG   LYS  25          HG3       LYS  25  17.488   6.877   9.377
  173   1HD   LYS  25          HD2       LYS  25  14.917   8.192  10.228
  174   2HD   LYS  25          HD3       LYS  25  16.442   8.223  11.083
  175   1HE   LYS  25          HE2       LYS  25  15.922   9.605   8.404
  176   2HE   LYS  25          HE3       LYS  25  15.789  10.371   9.981
  177   1HZ   LYS  25          HZ1       LYS  25  18.299   9.223   8.894
  178   2HZ   LYS  25          HZ2       LYS  25  17.937  10.810   8.985
  179   3HZ   LYS  25          HZ3       LYS  25  18.141   9.952  10.350
  180    H    LEU  26           H        LEU  26  14.415   5.376   5.689
  181    HA   LEU  26           HA       LEU  26  14.289   7.211   3.469
  182   1HB   LEU  26          HB2       LEU  26  13.884   4.257   3.848
  183   2HB   LEU  26          HB3       LEU  26  13.315   5.005   2.360
  184    HG   LEU  26           HG       LEU  26  15.380   5.476   1.548
  185   1HD1  LEU  26          HD11      LEU  26  16.686   5.224   4.282
  186   2HD1  LEU  26          HD12      LEU  26  17.503   5.537   2.733
  187   3HD1  LEU  26          HD13      LEU  26  16.409   6.742   3.395
  188   1HD2  LEU  26          HD21      LEU  26  15.031   3.046   1.700
  189   2HD2  LEU  26          HD22      LEU  26  16.752   3.458   1.812
  190   3HD2  LEU  26          HD23      LEU  26  15.854   3.014   3.275
  191    H    GLU  27           H        GLU  27  11.619   5.826   5.523
  192    HA   GLU  27           HA       GLU  27   9.633   6.820   3.706
  193   1HB   GLU  27          HB2       GLU  27   9.436   6.163   6.683
  194   2HB   GLU  27          HB3       GLU  27   8.124   6.534   5.584
  195   1HG   GLU  27          HG2       GLU  27   9.098   4.546   4.158
  196   2HG   GLU  27          HG3       GLU  27   9.832   4.085   5.698
  197    H    GLU  28           H        GLU  28  11.254   8.080   6.678
  198    HA   GLU  28           HA       GLU  28   9.906  10.558   6.782
  199   1HB   GLU  28          HB2       GLU  28  12.697   9.682   7.641
  200   2HB   GLU  28          HB3       GLU  28  12.010  11.239   8.030
  201   1HG   GLU  28          HG2       GLU  28  10.806   8.576   8.880
  202   2HG   GLU  28          HG3       GLU  28  11.861   9.576   9.869
  203    H    ALA  29           H        ALA  29  12.511   9.444   4.667
  204    HA   ALA  29           HA       ALA  29  13.351  12.023   3.745
  205   1HB   ALA  29          HB1       ALA  29  14.715   9.967   3.468
  206   2HB   ALA  29          HB2       ALA  29  13.515   9.338   2.311
  207   3HB   ALA  29          HB3       ALA  29  14.430  10.797   1.928
  208    H    GLY  30           H        GLY  30  10.472  10.152   3.077
  209   1HA   GLY  30          HA2       GLY  30   8.760  11.739   2.233
  210   2HA   GLY  30          HA3       GLY  30   9.792  11.993   0.821
  211    H    PHE  31           H        PHE  31   9.716   8.657   1.913
  212    HA   PHE  31           HA       PHE  31   7.897   8.014  -0.369
  213   1HB   PHE  31          HB2       PHE  31  10.439   6.534   0.284
  214   2HB   PHE  31          HB3       PHE  31   9.447   6.409  -1.156
  215    HD1  PHE  31           HD1      PHE  31  12.265   8.094   0.371
  216    HD2  PHE  31           HD2      PHE  31   9.278   8.471  -2.719
  217    HE1  PHE  31           HE1      PHE  31  13.587   9.906  -0.685
  218    HE2  PHE  31           HE2      PHE  31  10.608  10.280  -3.777
  219    HZ   PHE  31           HZ       PHE  31  12.753  11.011  -2.759
  220    H    THR  32           H        THR  32   7.975   5.227  -0.120
  221    HA   THR  32           HA       THR  32   7.376   4.615   2.701
  222    HB   THR  32           HB       THR  32   5.573   3.043   1.767
  223    HG1  THR  32           HG1      THR  32   4.546   3.863  -0.118
  224   1HG2  THR  32          HG21      THR  32   5.029   6.047   1.754
  225   2HG2  THR  32          HG22      THR  32   3.833   4.753   2.003
  226   3HG2  THR  32          HG23      THR  32   5.119   5.007   3.194
  227    H    THR  33           H        THR  33   7.931   2.498   3.268
  228    HA   THR  33           HA       THR  33   9.544   1.012   1.238
  229    HB   THR  33           HB       THR  33  11.348   0.883   2.829
  230    HG1  THR  33           HG1      THR  33  11.085   2.581   4.626
  231   1HG2  THR  33          HG21      THR  33  11.190   2.857   1.225
  232   2HG2  THR  33          HG22      THR  33  10.575   3.827   2.572
  233   3HG2  THR  33          HG23      THR  33  12.200   3.097   2.657
  234    H    GLU  34           H        GLU  34   9.862  -1.213   1.638
  235    HA   GLU  34           HA       GLU  34   7.894  -2.427   3.478
  236   1HB   GLU  34          HB2       GLU  34   8.070  -2.461   0.751
  237   2HB   GLU  34          HB3       GLU  34   9.006  -3.869   1.128
  238   1HG   GLU  34          HG2       GLU  34   6.821  -4.507   0.846
  239   2HG   GLU  34          HG3       GLU  34   7.130  -4.671   2.565
  240    H    THR  35           H        THR  35   9.284  -2.562   5.346
  241    HA   THR  35           HA       THR  35  11.890  -3.813   5.217
  242    HB   THR  35           HB       THR  35  10.094  -3.739   7.662
  243    HG1  THR  35           HG1      THR  35  10.137  -1.640   7.182
  244   1HG2  THR  35          HG21      THR  35  12.268  -5.045   7.667
  245   2HG2  THR  35          HG22      THR  35  13.123  -3.536   7.318
  246   3HG2  THR  35          HG23      THR  35  12.216  -3.721   8.841
  247    H    LEU  36           H        LEU  36  12.226  -5.877   4.743
  248    HA   LEU  36           HA       LEU  36  10.184  -7.989   5.381
  249   1HB   LEU  36          HB2       LEU  36  11.630  -7.312   2.779
  250   2HB   LEU  36          HB3       LEU  36  10.752  -8.803   3.034
  251    HG   LEU  36           HG       LEU  36   9.373  -6.121   3.308
  252   1HD1  LEU  36          HD11      LEU  36   9.786  -7.755   0.780
  253   2HD1  LEU  36          HD12      LEU  36   8.750  -6.301   0.965
  254   3HD1  LEU  36          HD13      LEU  36  10.506  -6.179   1.168
  255   1HD2  LEU  36          HD21      LEU  36   8.324  -8.891   2.576
  256   2HD2  LEU  36          HD22      LEU  36   8.152  -8.109   4.165
  257   3HD2  LEU  36          HD23      LEU  36   7.359  -7.411   2.744
  258    H    HIS  37           H        HIS  37  11.185  -9.937   6.010
  259    HA   HIS  37           HA       HIS  37  14.124 -10.079   5.901
  260   1HB   HIS  37          HB2       HIS  37  13.955 -12.041   7.234
  261   2HB   HIS  37          HB3       HIS  37  12.937 -10.795   7.927
  262    HD1  HIS  37           HD1      HIS  37  12.855 -14.335   6.942
  263    HD2  HIS  37           HD2      HIS  37  10.133 -11.175   7.483
  264    HE1  HIS  37           HE1      HIS  37  10.537 -15.405   7.149
  265    H    GLY  38           H        GLY  38  13.016  -9.818   3.394
  266   1HA   GLY  38          HA2       GLY  38  12.659 -10.681   1.315
  267   2HA   GLY  38          HA3       GLY  38  13.986 -11.774   1.719
  268    HA   PRO  39           HA       PRO  39  10.561 -14.633   3.070
  269   1HB   PRO  39          HB2       PRO  39   7.915 -13.977   3.320
  270   2HB   PRO  39          HB3       PRO  39   9.133 -13.636   4.588
  271   1HG   PRO  39          HG2       PRO  39   8.073 -11.760   2.454
  272   2HG   PRO  39          HG3       PRO  39   8.260 -11.447   4.209
  273   1HD   PRO  39          HD2       PRO  39  10.118 -10.672   2.355
  274   2HD   PRO  39          HD3       PRO  39  10.577 -11.193   4.013
  275    H    LEU  40           H        LEU  40   9.685 -12.514   0.372
  276    HA   LEU  40           HA       LEU  40   8.584 -14.799  -1.152
  277   1HB   LEU  40          HB2       LEU  40   7.993 -11.796  -1.103
  278   2HB   LEU  40          HB3       LEU  40   7.429 -12.870  -2.351
  279    HG   LEU  40           HG       LEU  40   6.674 -13.089   0.588
  280   1HD1  LEU  40          HD11      LEU  40   5.065 -12.113  -1.811
  281   2HD1  LEU  40          HD12      LEU  40   4.469 -12.281  -0.143
  282   3HD1  LEU  40          HD13      LEU  40   5.730 -11.097  -0.514
  283   1HD2  LEU  40          HD21      LEU  40   4.927 -14.681  -0.217
  284   2HD2  LEU  40          HD22      LEU  40   5.662 -14.648  -1.835
  285   3HD2  LEU  40          HD23      LEU  40   6.559 -15.305  -0.446
  286    H    LEU  41           H        LEU  41  11.416 -13.538  -0.648
  287    HA   LEU  41           HA       LEU  41  13.291 -12.941  -1.684
  288   1HB   LEU  41          HB2       LEU  41  12.679 -14.917  -3.135
  289   2HB   LEU  41          HB3       LEU  41  11.979 -13.777  -4.277
  290    HG   LEU  41           HG       LEU  41  14.316 -12.631  -4.295
  291   1HD1  LEU  41          HD11      LEU  41  15.248 -13.835  -2.328
  292   2HD1  LEU  41          HD12      LEU  41  15.115 -15.367  -3.217
  293   3HD1  LEU  41          HD13      LEU  41  16.187 -14.073  -3.812
  294   1HD2  LEU  41          HD21      LEU  41  13.853 -15.395  -5.467
  295   2HD2  LEU  41          HD22      LEU  41  13.410 -13.840  -6.188
  296   3HD2  LEU  41          HD23      LEU  41  15.123 -14.258  -5.996
  297    H    GLU  42           H        GLU  42  10.344 -11.569  -2.991
  298    HA   GLU  42           HA       GLU  42  11.452  -8.903  -3.413
  299   1HB   GLU  42          HB2       GLU  42  11.036  -8.973  -5.907
  300   2HB   GLU  42          HB3       GLU  42  12.470  -9.800  -5.352
  301   1HG   GLU  42          HG2       GLU  42  11.384 -11.991  -5.609
  302   2HG   GLU  42          HG3       GLU  42   9.890 -11.230  -6.132
  303    H    ASP  43           H        ASP  43   9.746  -8.293  -2.058
  304    HA   ASP  43           HA       ASP  43   6.995  -9.038  -2.638
  305   1HB   ASP  43          HB2       ASP  43   7.665  -8.239  -0.407
  306   2HB   ASP  43          HB3       ASP  43   8.068  -6.656  -1.107
  307    H    LEU  44           H        LEU  44   9.132  -6.247  -3.494
  308    HA   LEU  44           HA       LEU  44   7.004  -5.197  -5.282
  309   1HB   LEU  44          HB2       LEU  44   9.843  -4.215  -4.861
  310   2HB   LEU  44          HB3       LEU  44   8.711  -3.481  -5.927
  311    HG   LEU  44           HG       LEU  44   8.442  -3.587  -2.907
  312   1HD1  LEU  44          HD11      LEU  44   8.679  -1.228  -4.826
  313   2HD1  LEU  44          HD12      LEU  44   8.692  -1.184  -3.052
  314   3HD1  LEU  44          HD13      LEU  44  10.041  -1.925  -3.940
  315   1HD2  LEU  44          HD21      LEU  44   6.474  -2.492  -4.962
  316   2HD2  LEU  44          HD22      LEU  44   6.183  -3.795  -3.782
  317   3HD2  LEU  44          HD23      LEU  44   6.428  -2.145  -3.220
  318    HA   PRO  45           HA       PRO  45   8.327  -7.627  -8.663
  319   1HB   PRO  45          HB2       PRO  45   7.826  -5.981 -10.860
  320   2HB   PRO  45          HB3       PRO  45   6.599  -6.779  -9.879
  321   1HG   PRO  45          HG2       PRO  45   7.688  -3.948  -9.666
  322   2HG   PRO  45          HG3       PRO  45   5.980  -4.455  -9.658
  323   1HD   PRO  45          HD2       PRO  45   7.349  -3.903  -7.364
  324   2HD   PRO  45          HD3       PRO  45   6.103  -5.189  -7.436
  325    H    ALA  46           H        ALA  46   9.426  -7.279 -10.904
  326    HA   ALA  46           HA       ALA  46  12.214  -6.559 -10.523
  327   1HB   ALA  46          HB1       ALA  46  10.672  -7.474 -13.007
  328   2HB   ALA  46          HB2       ALA  46  12.434  -7.372 -12.877
  329   3HB   ALA  46          HB3       ALA  46  11.548  -8.535 -11.874
  330    H    SER  47           H        SER  47  10.563  -4.304 -10.097
  331    HA   SER  47           HA       SER  47  11.539  -2.358 -11.948
  332   1HB   SER  47          HB2       SER  47   8.542  -2.720 -11.765
  333   2HB   SER  47          HB3       SER  47   9.396  -1.470 -12.679
  334    HG   SER  47           HG       SER  47  10.324  -3.855 -13.421
  335    H    GLY  48           H        GLY  48  11.870  -0.510 -10.658
  336   1HA   GLY  48          HA2       GLY  48  10.658   0.986  -8.943
  337   2HA   GLY  48          HA3       GLY  48  10.545  -0.483  -7.972
  338    H    ILE  49           H        ILE  49  11.882   0.130  -6.326
  339    HA   ILE  49           HA       ILE  49  14.791   0.231  -6.959
  340    HB   ILE  49           HB       ILE  49  13.437   1.530  -4.579
  341   1HG1  ILE  49          HG12      ILE  49  12.737   2.837  -6.521
  342   2HG1  ILE  49          HG13      ILE  49  13.815   3.730  -5.472
  343   1HG2  ILE  49          HG21      ILE  49  16.304   1.689  -5.616
  344   2HG2  ILE  49          HG22      ILE  49  15.648   2.660  -4.276
  345   3HG2  ILE  49          HG23      ILE  49  15.757   0.906  -4.131
  346   1HD1  ILE  49          HD11      ILE  49  14.307   4.138  -7.848
  347   2HD1  ILE  49          HD12      ILE  49  15.688   3.395  -7.025
  348   3HD1  ILE  49          HD13      ILE  49  14.666   2.421  -8.092
  349    H    TRP  50           H        TRP  50  15.977  -1.247  -5.754
  350    HA   TRP  50           HA       TRP  50  14.563  -2.905  -3.706
  351   1HB   TRP  50          HB2       TRP  50  16.561  -3.636  -5.886
  352   2HB   TRP  50          HB3       TRP  50  16.413  -4.580  -4.438
  353    HD1  TRP  50           HD1      TRP  50  13.136  -3.427  -6.094
  354    HE1  TRP  50           HE1      TRP  50  11.977  -5.377  -7.248
  355    HE3  TRP  50           HE3      TRP  50  16.855  -6.909  -5.614
  356    HZ2  TRP  50           HZ2      TRP  50  12.600  -8.121  -7.902
  357    HZ3  TRP  50           HZ3      TRP  50  16.548  -9.186  -6.548
  358    HH2  TRP  50           HH2      TRP  50  14.430  -9.801  -7.694
  359    H    LEU  51           H        LEU  51  15.849  -3.256  -1.813
  360    HA   LEU  51           HA       LEU  51  18.642  -2.241  -1.809
  361   1HB   LEU  51          HB2       LEU  51  16.483  -1.592   0.238
  362   2HB   LEU  51          HB3       LEU  51  18.207  -1.432   0.557
  363    HG   LEU  51           HG       LEU  51  16.625   0.166  -1.507
  364   1HD1  LEU  51          HD11      LEU  51  17.024   2.039  -0.003
  365   2HD1  LEU  51          HD12      LEU  51  16.187   0.748   0.872
  366   3HD1  LEU  51          HD13      LEU  51  17.923   1.002   1.126
  367   1HD2  LEU  51          HD21      LEU  51  18.707   1.564  -1.654
  368   2HD2  LEU  51          HD22      LEU  51  19.576   0.314  -0.734
  369   3HD2  LEU  51          HD23      LEU  51  18.893  -0.046  -2.332
  370    H    VAL  52           H        VAL  52  19.973  -3.596  -0.552
  371    HA   VAL  52           HA       VAL  52  18.625  -5.876   0.788
  372    HB   VAL  52           HB       VAL  52  18.910  -6.640  -1.417
  373   1HG1  VAL  52          HG11      VAL  52  21.031  -6.732  -2.653
  374   2HG1  VAL  52          HG12      VAL  52  20.534  -5.067  -2.359
  375   3HG1  VAL  52          HG13      VAL  52  21.831  -5.794  -1.378
  376   1HG2  VAL  52          HG21      VAL  52  19.521  -8.235   0.386
  377   2HG2  VAL  52          HG22      VAL  52  20.329  -8.577  -1.150
  378   3HG2  VAL  52          HG23      VAL  52  21.230  -7.804   0.168
  379    H    ILE  53           H        ILE  53  19.399  -6.288   2.676
  380    HA   ILE  53           HA       ILE  53  21.930  -5.042   3.579
  381    HB   ILE  53           HB       ILE  53  19.457  -5.921   5.147
  382   1HG1  ILE  53          HG12      ILE  53  19.367  -3.416   5.742
  383   2HG1  ILE  53          HG13      ILE  53  20.417  -3.131   4.378
  384   1HG2  ILE  53          HG21      ILE  53  21.550  -6.146   6.448
  385   2HG2  ILE  53          HG22      ILE  53  21.984  -4.467   6.059
  386   3HG2  ILE  53          HG23      ILE  53  20.569  -4.827   7.071
  387   1HD1  ILE  53          HD11      ILE  53  18.015  -2.673   3.952
  388   2HD1  ILE  53          HD12      ILE  53  18.638  -3.882   2.836
  389   3HD1  ILE  53          HD13      ILE  53  17.638  -4.381   4.218
  390    H    SER  54           H        SER  54  23.569  -6.474   3.788
  391    HA   SER  54           HA       SER  54  23.280  -9.167   4.838
  392   1HB   SER  54          HB2       SER  54  23.901  -8.661   1.896
  393   2HB   SER  54          HB3       SER  54  24.269 -10.189   2.721
  394    HG   SER  54           HG       SER  54  21.690  -9.202   3.022
  395    H    SER  55           H        SER  55  25.813 -10.181   4.328
  396    HA   SER  55           HA       SER  55  27.772  -8.018   4.346
  397   1HB   SER  55          HB2       SER  55  27.548  -9.746   6.844
  398   2HB   SER  55          HB3       SER  55  28.705  -8.436   6.532
  399    HG   SER  55           HG       SER  55  26.363  -7.382   6.160
  400    H    THR  56           H        THR  56  28.089  -9.316   2.340
  401    HA   THR  56           HA       THR  56  29.245 -11.898   2.359
  402    HB   THR  56           HB       THR  56  30.043 -10.921   0.039
  403    HG1  THR  56           HG1      THR  56  29.050  -9.122  -0.548
  404   1HG2  THR  56          HG21      THR  56  27.129 -11.210   0.830
  405   2HG2  THR  56          HG22      THR  56  27.664 -10.924  -0.841
  406   3HG2  THR  56          HG23      THR  56  28.194 -12.377  -0.005
  407    H    HIS  57           H        HIS  57  30.611  -9.504   4.047
  408    HA   HIS  57           HA       HIS  57  33.249  -9.164   3.279
  409   1HB   HIS  57          HB2       HIS  57  33.644  -8.576   5.508
  410   2HB   HIS  57          HB3       HIS  57  31.953  -8.180   5.273
  411    HD1  HIS  57           HD1      HIS  57  30.486 -10.878   6.005
  412    HD2  HIS  57           HD2      HIS  57  34.032  -9.536   7.848
  413    HE1  HIS  57           HE1      HIS  57  30.660 -12.109   8.215
  414    H    GLY  58           H        GLY  58  35.230 -10.138   3.975
  415   1HA   GLY  58          HA2       GLY  58  36.692 -11.871   4.298
  416   2HA   GLY  58          HA3       GLY  58  35.433 -12.707   5.227
  417    H    ALA  59           H        ALA  59  35.833 -14.734   4.259
  418    HA   ALA  59           HA       ALA  59  35.790 -15.090   1.381
  419   1HB   ALA  59          HB1       ALA  59  35.638 -17.133   3.641
  420   2HB   ALA  59          HB2       ALA  59  35.990 -17.474   1.934
  421   3HB   ALA  59          HB3       ALA  59  37.138 -16.527   2.892
  422    H    GLY  60           H        GLY  60  33.251 -14.196   3.295
  423   1HA   GLY  60          HA2       GLY  60  30.945 -14.392   3.013
  424   2HA   GLY  60          HA3       GLY  60  31.233 -15.406   1.595
  425    H    ASP  61           H        ASP  61  29.804 -17.040   2.133
  426    HA   ASP  61           HA       ASP  61  30.691 -18.929   4.204
  427   1HB   ASP  61          HB2       ASP  61  28.917 -17.538   5.317
  428   2HB   ASP  61          HB3       ASP  61  27.792 -18.027   4.046
  429    H    ILE  62           H        ILE  62  29.428 -21.079   3.814
  430    HA   ILE  62           HA       ILE  62  30.202 -21.884   1.339
  431    HB   ILE  62           HB       ILE  62  30.020 -23.303   3.241
  432   1HG1  ILE  62          HG12      ILE  62  28.448 -24.470   0.911
  433   2HG1  ILE  62          HG13      ILE  62  30.196 -24.217   0.932
  434   1HG2  ILE  62          HG21      ILE  62  27.027 -23.578   2.805
  435   2HG2  ILE  62          HG22      ILE  62  28.016 -24.315   4.075
  436   3HG2  ILE  62          HG23      ILE  62  27.760 -22.576   4.086
  437   1HD1  ILE  62          HD11      ILE  62  30.369 -25.753   2.905
  438   2HD1  ILE  62          HD12      ILE  62  28.628 -26.097   2.743
  439   3HD1  ILE  62          HD13      ILE  62  29.741 -26.529   1.437
  440    HA   PRO  63           HA       PRO  63  26.005 -21.770  -0.817
  441   1HB   PRO  63          HB2       PRO  63  24.078 -19.953  -0.186
  442   2HB   PRO  63          HB3       PRO  63  24.191 -21.554   0.607
  443   1HG   PRO  63          HG2       PRO  63  25.264 -18.899   1.623
  444   2HG   PRO  63          HG3       PRO  63  24.261 -20.097   2.503
  445   1HD   PRO  63          HD2       PRO  63  26.948 -20.028   2.764
  446   2HD   PRO  63          HD3       PRO  63  26.063 -21.576   2.744
  447    H    ASP  64           H        ASP  64  27.719 -19.008   0.349
  448    HA   ASP  64           HA       ASP  64  28.673 -17.562  -1.603
  449   1HB   ASP  64          HB2       ASP  64  26.790 -17.158  -2.964
  450   2HB   ASP  64          HB3       ASP  64  25.698 -16.985  -1.583
  451    H    ASN  65           H        ASN  65  26.104 -16.864   0.685
  452    HA   ASN  65           HA       ASN  65  27.208 -16.175   3.079
  453   1HB   ASN  65          HB2       ASN  65  28.571 -14.371   2.051
  454   2HB   ASN  65          HB3       ASN  65  27.106 -13.734   1.308
  455   1HD2  ASN  65          HD22      ASN  65  28.640 -14.346   4.491
  456   2HD2  ASN  65          HD21      ASN  65  27.909 -12.922   5.178
  457    H    LEU  66           H        LEU  66  25.178 -14.821   0.450
  458    HA   LEU  66           HA       LEU  66  22.800 -14.715   2.195
  459   1HB   LEU  66          HB2       LEU  66  23.168 -14.229  -0.803
  460   2HB   LEU  66          HB3       LEU  66  21.629 -14.211   0.054
  461    HG   LEU  66           HG       LEU  66  22.567 -12.369   1.541
  462   1HD1  LEU  66          HD11      LEU  66  24.341 -10.933   0.409
  463   2HD1  LEU  66          HD12      LEU  66  24.924 -12.415   1.153
  464   3HD1  LEU  66          HD13      LEU  66  24.717 -12.339  -0.604
  465   1HD2  LEU  66          HD21      LEU  66  20.912 -11.917  -0.194
  466   2HD2  LEU  66          HD22      LEU  66  22.077 -10.602  -0.113
  467   3HD2  LEU  66          HD23      LEU  66  22.195 -11.792  -1.422
  468    H    SER  67           H        SER  67  21.189 -16.383   2.135
  469    HA   SER  67           HA       SER  67  22.261 -18.897   0.990
  470   1HB   SER  67          HB2       SER  67  20.031 -18.975   2.956
  471   2HB   SER  67          HB3       SER  67  21.403 -20.043   2.725
  472    HG   SER  67           HG       SER  67  22.729 -18.431   3.662
  473    HA   PRO  68           HA       PRO  68  17.928 -19.159  -0.842
  474   1HB   PRO  68          HB2       PRO  68  16.004 -17.260  -0.511
  475   2HB   PRO  68          HB3       PRO  68  16.341 -18.504   0.725
  476   1HG   PRO  68          HG2       PRO  68  17.304 -15.639   0.703
  477   2HG   PRO  68          HG3       PRO  68  16.576 -16.553   2.054
  478   1HD   PRO  68          HD2       PRO  68  19.265 -16.277   1.738
  479   2HD   PRO  68          HD3       PRO  68  18.519 -17.714   2.485
  480    H    PHE  69           H        PHE  69  19.039 -15.812  -0.595
  481    HA   PHE  69           HA       PHE  69  17.927 -14.803  -2.919
  482   1HB   PHE  69          HB2       PHE  69  19.564 -13.816  -0.908
  483   2HB   PHE  69          HB3       PHE  69  20.587 -13.634  -2.287
  484    HD1  PHE  69           HD1      PHE  69  20.342 -11.816  -3.786
  485    HD2  PHE  69           HD2      PHE  69  17.104 -12.831  -1.125
  486    HE1  PHE  69           HE1      PHE  69  19.090  -9.818  -4.548
  487    HE2  PHE  69           HE2      PHE  69  15.838 -10.851  -1.927
  488    HZ   PHE  69           HZ       PHE  69  16.825  -9.342  -3.635
  489    H    TYR  70           H        TYR  70  21.315 -15.724  -2.537
  490    HA   TYR  70           HA       TYR  70  22.055 -15.384  -5.185
  491   1HB   TYR  70          HB2       TYR  70  23.654 -15.782  -3.321
  492   2HB   TYR  70          HB3       TYR  70  23.203 -17.475  -3.345
  493    HD1  TYR  70           HD1      TYR  70  24.147 -14.896  -5.964
  494    HD2  TYR  70           HD2      TYR  70  24.805 -18.853  -4.377
  495    HE1  TYR  70           HE1      TYR  70  25.840 -15.309  -7.717
  496    HE2  TYR  70           HE2      TYR  70  26.510 -19.270  -6.113
  497    HH   TYR  70           HH       TYR  70  27.630 -18.417  -7.965
  498    H    GLU  71           H        GLU  71  20.894 -18.484  -3.721
  499    HA   GLU  71           HA       GLU  71  21.159 -19.959  -6.133
  500   1HB   GLU  71          HB2       GLU  71  19.282 -20.463  -3.782
  501   2HB   GLU  71          HB3       GLU  71  19.725 -21.622  -5.045
  502   1HG   GLU  71          HG2       GLU  71  22.167 -21.154  -4.316
  503   2HG   GLU  71          HG3       GLU  71  21.488 -20.430  -2.874
  504    H    ALA  72           H        ALA  72  18.294 -18.238  -4.729
  505    HA   ALA  72           HA       ALA  72  16.515 -19.028  -6.820
  506   1HB   ALA  72          HB1       ALA  72  15.762 -18.160  -4.622
  507   2HB   ALA  72          HB2       ALA  72  16.416 -16.556  -5.039
  508   3HB   ALA  72          HB3       ALA  72  15.074 -17.248  -5.979
  509    H    LEU  73           H        LEU  73  18.765 -16.220  -6.548
  510    HA   LEU  73           HA       LEU  73  17.772 -14.716  -8.706
  511   1HB   LEU  73          HB2       LEU  73  20.512 -15.077  -7.449
  512   2HB   LEU  73          HB3       LEU  73  20.352 -14.144  -8.913
  513    HG   LEU  73           HG       LEU  73  18.842 -13.562  -6.346
  514   1HD1  LEU  73          HD11      LEU  73  21.370 -12.318  -7.512
  515   2HD1  LEU  73          HD12      LEU  73  20.460 -11.658  -6.137
  516   3HD1  LEU  73          HD13      LEU  73  21.213 -13.255  -6.009
  517   1HD2  LEU  73          HD21      LEU  73  18.405 -11.340  -7.379
  518   2HD2  LEU  73          HD22      LEU  73  19.174 -11.891  -8.887
  519   3HD2  LEU  73          HD23      LEU  73  17.661 -12.627  -8.314
  520    H    GLN  74           H        GLN  74  20.424 -17.152  -8.739
  521    HA   GLN  74           HA       GLN  74  20.571 -16.994 -11.592
  522   1HB   GLN  74          HB2       GLN  74  21.646 -19.517 -10.399
  523   2HB   GLN  74          HB3       GLN  74  22.258 -18.442 -11.619
  524   1HG   GLN  74          HG2       GLN  74  22.717 -16.785  -9.676
  525   2HG   GLN  74          HG3       GLN  74  22.345 -18.157  -8.609
  526   1HE2  GLN  74          HE22      GLN  74  24.337 -17.258 -11.424
  527   2HE2  GLN  74          HE21      GLN  74  25.681 -18.321 -11.032
  528    H    GLU  75           H        GLU  75  18.304 -18.697  -9.628
  529    HA   GLU  75           HA       GLU  75  17.718 -20.751 -11.539
  530   1HB   GLU  75          HB2       GLU  75  17.272 -20.856  -9.076
  531   2HB   GLU  75          HB3       GLU  75  15.962 -19.696  -9.314
  532   1HG   GLU  75          HG2       GLU  75  14.781 -21.282 -10.774
  533   2HG   GLU  75          HG3       GLU  75  16.137 -22.410 -10.683
  534    H    GLN  76           H        GLN  76  16.549 -17.438 -11.035
  535    HA   GLN  76           HA       GLN  76  14.669 -17.806 -13.334
  536   1HB   GLN  76          HB2       GLN  76  13.316 -15.977 -12.271
  537   2HB   GLN  76          HB3       GLN  76  13.267 -17.558 -11.507
  538   1HG   GLN  76          HG2       GLN  76  14.371 -16.879  -9.611
  539   2HG   GLN  76          HG3       GLN  76  15.275 -15.607 -10.429
  540   1HE2  GLN  76          HE22      GLN  76  14.694 -14.294  -8.526
  541   2HE2  GLN  76          HE21      GLN  76  13.173 -13.420  -8.544
  542    H    LYS  77           H        LYS  77  17.242 -15.761 -12.137
  543    HA   LYS  77           HA       LYS  77  17.973 -13.680 -12.744
  544   1HB   LYS  77          HB2       LYS  77  18.122 -15.284 -15.291
  545   2HB   LYS  77          HB3       LYS  77  18.997 -13.771 -15.009
  546   1HG   LYS  77          HG2       LYS  77  20.125 -14.749 -13.085
  547   2HG   LYS  77          HG3       LYS  77  19.259 -16.274 -13.288
  548   1HD   LYS  77          HD2       LYS  77  21.123 -15.131 -15.393
  549   2HD   LYS  77          HD3       LYS  77  21.627 -16.264 -14.127
  550   1HE   LYS  77          HE2       LYS  77  19.940 -17.879 -14.936
  551   2HE   LYS  77          HE3       LYS  77  19.465 -16.769 -16.225
  552   1HZ   LYS  77          HZ1       LYS  77  21.713 -16.959 -17.126
  553   2HZ   LYS  77          HZ2       LYS  77  22.153 -17.988 -15.931
  554   3HZ   LYS  77          HZ3       LYS  77  21.025 -18.431 -17.018
  555    HA   PRO  78           HA       PRO  78  13.852 -12.438 -14.487
  556   1HB   PRO  78          HB2       PRO  78  13.193 -10.455 -12.635
  557   2HB   PRO  78          HB3       PRO  78  12.768 -12.174 -12.537
  558   1HG   PRO  78          HG2       PRO  78  15.048 -10.704 -11.224
  559   2HG   PRO  78          HG3       PRO  78  14.004 -11.961 -10.512
  560   1HD   PRO  78          HD2       PRO  78  16.529 -12.476 -11.452
  561   2HD   PRO  78          HD3       PRO  78  15.209 -13.674 -11.578
  562    H    ASP  79           H        ASP  79  12.987 -10.395 -15.228
  563    HA   ASP  79           HA       ASP  79  15.089  -8.963 -16.654
  564   1HB   ASP  79          HB2       ASP  79  13.119  -9.789 -17.837
  565   2HB   ASP  79          HB3       ASP  79  12.062  -8.787 -16.837
  566    H    LEU  80           H        LEU  80  15.840  -8.160 -14.510
  567    HA   LEU  80           HA       LEU  80  14.477  -6.048 -13.122
  568   1HB   LEU  80          HB2       LEU  80  17.336  -7.018 -13.243
  569   2HB   LEU  80          HB3       LEU  80  16.918  -5.664 -12.287
  570    HG   LEU  80           HG       LEU  80  16.539  -6.799 -10.529
  571   1HD1  LEU  80          HD11      LEU  80  14.444  -8.442 -11.971
  572   2HD1  LEU  80          HD12      LEU  80  14.711  -8.368 -10.209
  573   3HD1  LEU  80          HD13      LEU  80  14.206  -6.925 -11.064
  574   1HD2  LEU  80          HD21      LEU  80  16.922  -9.332 -12.135
  575   2HD2  LEU  80          HD22      LEU  80  18.203  -8.352 -11.370
  576   3HD2  LEU  80          HD23      LEU  80  17.006  -9.180 -10.367
  577    H    SER  81           H        SER  81  14.932  -5.541 -16.136
  578    HA   SER  81           HA       SER  81  17.030  -3.604 -16.424
  579   1HB   SER  81          HB2       SER  81  15.997  -3.329 -18.702
  580   2HB   SER  81          HB3       SER  81  16.445  -4.991 -18.294
  581    HG   SER  81           HG       SER  81  14.465  -5.589 -18.377
  582    H    ALA  82           H        ALA  82  14.211  -3.386 -14.805
  583    HA   ALA  82           HA       ALA  82  13.813  -0.473 -15.320
  584   1HB   ALA  82          HB1       ALA  82  11.403  -0.842 -14.871
  585   2HB   ALA  82          HB2       ALA  82  11.950  -1.761 -16.286
  586   3HB   ALA  82          HB3       ALA  82  11.706  -2.588 -14.731
  587    H    VAL  83           H        VAL  83  15.268  -2.452 -13.219
  588    HA   VAL  83           HA       VAL  83  14.554  -0.647 -10.986
  589    HB   VAL  83           HB       VAL  83  13.303  -2.559 -10.471
  590   1HG1  VAL  83          HG11      VAL  83  14.204  -4.839 -10.250
  591   2HG1  VAL  83          HG12      VAL  83  14.245  -4.243 -11.914
  592   3HG1  VAL  83          HG13      VAL  83  15.739  -4.280 -10.947
  593   1HG2  VAL  83          HG21      VAL  83  15.764  -3.044  -8.778
  594   2HG2  VAL  83          HG22      VAL  83  14.651  -1.690  -8.512
  595   3HG2  VAL  83          HG23      VAL  83  14.061  -3.342  -8.409
  596    H    ARG  84           H        ARG  84  16.179  -0.475  -9.321
  597    HA   ARG  84           HA       ARG  84  18.888  -1.347 -10.068
  598   1HB   ARG  84          HB2       ARG  84  19.804   0.764  -9.360
  599   2HB   ARG  84          HB3       ARG  84  18.720   1.017 -10.728
  600   1HG   ARG  84          HG2       ARG  84  16.954   1.816  -9.101
  601   2HG   ARG  84          HG3       ARG  84  18.121   1.573  -7.790
  602   1HD   ARG  84          HD2       ARG  84  19.642   3.119  -9.400
  603   2HD   ARG  84          HD3       ARG  84  18.065   3.677  -9.943
  604    HE   ARG  84           HE       ARG  84  19.246   3.744  -7.190
  605   1HH1  ARG  84          HH21      ARG  84  16.940   5.116  -9.532
  606   2HH1  ARG  84          HH22      ARG  84  16.276   6.290  -8.467
  607   1HH2  ARG  84          HH11      ARG  84  18.234   5.281  -5.676
  608   2HH2  ARG  84          HH12      ARG  84  17.019   6.358  -6.233
  609    H    PHE  85           H        PHE  85  20.247  -1.530  -8.096
  610    HA   PHE  85           HA       PHE  85  18.579  -2.094  -5.692
  611   1HB   PHE  85          HB2       PHE  85  19.899  -3.938  -5.116
  612   2HB   PHE  85          HB3       PHE  85  19.248  -4.175  -6.717
  613    HD1  PHE  85           HD1      PHE  85  22.329  -3.765  -4.718
  614    HD2  PHE  85           HD2      PHE  85  20.721  -4.245  -8.681
  615    HE1  PHE  85           HE1      PHE  85  24.560  -4.464  -5.547
  616    HE2  PHE  85           HE2      PHE  85  22.954  -4.949  -9.511
  617    HZ   PHE  85           HZ       PHE  85  24.874  -5.066  -7.940
  618    H    GLY  86           H        GLY  86  19.916  -1.949  -3.674
  619   1HA   GLY  86          HA2       GLY  86  22.410  -0.342  -3.892
  620   2HA   GLY  86          HA3       GLY  86  21.144   0.152  -2.753
  621    H    ALA  87           H        ALA  87  23.947  -1.522  -2.924
  622    HA   ALA  87           HA       ALA  87  23.233  -3.879  -1.307
  623   1HB   ALA  87          HB1       ALA  87  25.867  -2.778  -2.409
  624   2HB   ALA  87          HB2       ALA  87  25.695  -4.293  -1.536
  625   3HB   ALA  87          HB3       ALA  87  24.899  -4.102  -3.103
  626    H    ILE  88           H        ILE  88  23.422  -3.886   0.904
  627    HA   ILE  88           HA       ILE  88  24.728  -1.574   2.249
  628    HB   ILE  88           HB       ILE  88  22.082  -2.921   2.905
  629   1HG1  ILE  88          HG12      ILE  88  22.593  -0.237   1.572
  630   2HG1  ILE  88          HG13      ILE  88  21.731  -1.623   0.921
  631   1HG2  ILE  88          HG21      ILE  88  23.316  -2.106   4.896
  632   2HG2  ILE  88          HG22      ILE  88  23.353  -0.472   4.197
  633   3HG2  ILE  88          HG23      ILE  88  21.821  -1.241   4.646
  634   1HD1  ILE  88          HD11      ILE  88  19.969  -1.328   2.669
  635   2HD1  ILE  88          HD12      ILE  88  20.786   0.183   3.159
  636   3HD1  ILE  88          HD13      ILE  88  20.127   0.025   1.533
  637    H    GLY  89           H        GLY  89  26.222  -2.233   3.676
  638   1HA   GLY  89          HA2       GLY  89  27.256  -3.442   5.352
  639   2HA   GLY  89          HA3       GLY  89  25.916  -4.599   5.354
  640    H    ILE  90           H        ILE  90  26.333  -4.839   2.344
  641    HA   ILE  90           HA       ILE  90  27.723  -7.149   2.017
  642    HB   ILE  90           HB       ILE  90  26.984  -4.806   0.295
  643   1HG1  ILE  90          HG12      ILE  90  25.242  -6.386   1.065
  644   2HG1  ILE  90          HG13      ILE  90  25.355  -6.272  -0.677
  645   1HG2  ILE  90          HG21      ILE  90  27.549  -5.910  -1.799
  646   2HG2  ILE  90          HG22      ILE  90  28.977  -5.453  -0.876
  647   3HG2  ILE  90          HG23      ILE  90  28.445  -7.149  -0.926
  648   1HD1  ILE  90          HD11      ILE  90  26.365  -8.591   1.000
  649   2HD1  ILE  90          HD12      ILE  90  24.960  -8.553  -0.080
  650   3HD1  ILE  90          HD13      ILE  90  26.577  -8.440  -0.764
  651    H    GLY  91           H        GLY  91  29.748  -7.805   1.453
  652   1HA   GLY  91          HA2       GLY  91  32.017  -5.887   1.737
  653   2HA   GLY  91          HA3       GLY  91  32.005  -7.473   2.494
  654    H    SER  92           H        SER  92  30.395  -7.435  -0.554
  655    HA   SER  92           HA       SER  92  32.229  -9.108  -1.908
  656   1HB   SER  92          HB2       SER  92  29.977  -7.351  -2.884
  657   2HB   SER  92          HB3       SER  92  30.723  -8.660  -3.823
  658    HG   SER  92           HG       SER  92  29.525 -10.008  -2.795
  659    H    ARG  93           H        ARG  93  32.226  -5.651  -1.450
  660    HA   ARG  93           HA       ARG  93  34.635  -5.319  -2.985
  661   1HB   ARG  93          HB2       ARG  93  33.814  -3.564  -4.475
  662   2HB   ARG  93          HB3       ARG  93  32.996  -5.086  -4.786
  663   1HG   ARG  93          HG2       ARG  93  31.041  -4.185  -3.343
  664   2HG   ARG  93          HG3       ARG  93  31.879  -2.638  -3.343
  665   1HD   ARG  93          HD2       ARG  93  30.286  -2.530  -5.095
  666   2HD   ARG  93          HD3       ARG  93  31.843  -2.742  -5.908
  667    HE   ARG  93           HE       ARG  93  29.771  -4.848  -5.375
  668   1HH1  ARG  93          HH11      ARG  93  32.527  -3.882  -7.449
  669   2HH1  ARG  93          HH12      ARG  93  32.584  -5.423  -8.229
  670   1HH2  ARG  93          HH21      ARG  93  29.902  -6.725  -6.287
  671   2HH2  ARG  93          HH22      ARG  93  31.087  -7.159  -7.522
  672    H    GLU  94           H        GLU  94  35.467  -3.169  -2.616
  673    HA   GLU  94           HA       GLU  94  35.877  -1.149  -1.774
  674   1HB   GLU  94          HB2       GLU  94  33.110  -1.309  -0.601
  675   2HB   GLU  94          HB3       GLU  94  34.160   0.090  -0.449
  676   1HG   GLU  94          HG2       GLU  94  34.169   0.516  -2.803
  677   2HG   GLU  94          HG3       GLU  94  33.396  -1.021  -3.173
  678    H    TYR  95           H        TYR  95  34.780  -3.653   0.327
  679    HA   TYR  95           HA       TYR  95  36.762  -2.910   2.408
  680   1HB   TYR  95          HB2       TYR  95  34.700  -1.622   2.944
  681   2HB   TYR  95          HB3       TYR  95  33.770  -3.114   2.961
  682    HD1  TYR  95           HD1      TYR  95  36.664  -1.367   4.595
  683    HD2  TYR  95           HD2      TYR  95  33.628  -4.414   4.972
  684    HE1  TYR  95           HE1      TYR  95  37.240  -1.639   6.989
  685    HE2  TYR  95           HE2      TYR  95  34.199  -4.694   7.361
  686    HH   TYR  95           HH       TYR  95  35.395  -3.817   9.161
  687    H    ASP  96           H        ASP  96  37.514  -4.581   3.492
  688    HA   ASP  96           HA       ASP  96  38.190  -6.697   3.807
  689   1HB   ASP  96          HB2       ASP  96  36.770  -5.985   5.700
  690   2HB   ASP  96          HB3       ASP  96  35.407  -6.852   4.985
  691    H    THR  97           H        THR  97  37.652  -6.718   1.190
  692    HA   THR  97           HA       THR  97  35.992  -8.868   0.314
  693    HB   THR  97           HB       THR  97  37.856  -8.559  -1.662
  694    HG1  THR  97           HG1      THR  97  39.180  -7.087  -0.696
  695   1HG2  THR  97          HG21      THR  97  35.619  -6.609  -1.009
  696   2HG2  THR  97          HG22      THR  97  36.407  -6.820  -2.599
  697   3HG2  THR  97          HG23      THR  97  35.475  -8.147  -1.896
  698    H    PHE  98           H        PHE  98  36.954 -10.741  -0.928
  699    HA   PHE  98           HA       PHE  98  39.540 -11.768  -0.081
  700   1HB   PHE  98          HB2       PHE  98  37.960 -12.713   1.608
  701   2HB   PHE  98          HB3       PHE  98  36.938 -13.312   0.301
  702    HD1  PHE  98           HD1      PHE  98  40.393 -13.602   1.753
  703    HD2  PHE  98           HD2      PHE  98  37.311 -15.473  -0.620
  704    HE1  PHE  98           HE1      PHE  98  41.709 -15.705   1.692
  705    HE2  PHE  98           HE2      PHE  98  38.631 -17.571  -0.678
  706    HZ   PHE  98           HZ       PHE  98  40.832 -17.693   0.477
  707    H    CYS  99           H        CYS  99  40.167 -13.477  -1.625
  708    HA   CYS  99           HA       CYS  99  39.172 -13.020  -4.323
  709   1HB   CYS  99          HB2       CYS  99  41.281 -14.952  -3.250
  710   2HB   CYS  99          HB3       CYS  99  40.987 -14.564  -4.952
  711    HG   CYS  99           HG       CYS  99  43.175 -13.372  -4.143
  712    H    GLY 100           H        GLY 100  36.916 -13.746  -3.572
  713   1HA   GLY 100          HA2       GLY 100  36.549 -16.644  -4.134
  714   2HA   GLY 100          HA3       GLY 100  35.937 -15.991  -2.611
  715    H    ALA 101           H        ALA 101  34.030 -17.028  -3.878
  716    HA   ALA 101           HA       ALA 101  32.942 -15.803  -6.172
  717   1HB   ALA 101          HB1       ALA 101  31.611 -17.555  -4.056
  718   2HB   ALA 101          HB2       ALA 101  30.995 -17.256  -5.690
  719   3HB   ALA 101          HB3       ALA 101  32.518 -18.135  -5.477
  720    H    ILE 102           H        ILE 102  33.035 -14.311  -3.199
  721    HA   ILE 102           HA       ILE 102  30.447 -13.503  -2.607
  722    HB   ILE 102           HB       ILE 102  31.507 -11.667  -1.373
  723   1HG1  ILE 102          HG12      ILE 102  34.101 -12.470  -2.773
  724   2HG1  ILE 102          HG13      ILE 102  33.220 -10.955  -2.976
  725   1HG2  ILE 102          HG21      ILE 102  32.770 -13.071   0.156
  726   2HG2  ILE 102          HG22      ILE 102  31.448 -14.023  -0.515
  727   3HG2  ILE 102          HG23      ILE 102  33.107 -14.260  -1.108
  728   1HD1  ILE 102          HD11      ILE 102  35.056 -10.512  -1.543
  729   2HD1  ILE 102          HD12      ILE 102  33.608 -10.492  -0.515
  730   3HD1  ILE 102          HD13      ILE 102  34.698 -11.900  -0.507
  731    H    ASP 103           H        ASP 103  32.526 -12.214  -5.167
  732    HA   ASP 103           HA       ASP 103  31.040  -9.808  -5.694
  733   1HB   ASP 103          HB2       ASP 103  33.304 -10.095  -6.496
  734   2HB   ASP 103          HB3       ASP 103  32.862 -11.559  -7.378
  735    H    LYS 104           H        LYS 104  30.471 -13.194  -6.525
  736    HA   LYS 104           HA       LYS 104  29.134 -12.714  -8.981
  737   1HB   LYS 104          HB2       LYS 104  28.960 -15.134  -7.158
  738   2HB   LYS 104          HB3       LYS 104  28.327 -15.040  -8.801
  739   1HG   LYS 104          HG2       LYS 104  30.614 -14.536  -9.611
  740   2HG   LYS 104          HG3       LYS 104  31.250 -14.780  -7.977
  741   1HD   LYS 104          HD2       LYS 104  30.363 -17.117  -8.010
  742   2HD   LYS 104          HD3       LYS 104  29.776 -16.855  -9.665
  743   1HE   LYS 104          HE2       LYS 104  32.106 -16.372 -10.405
  744   2HE   LYS 104          HE3       LYS 104  32.688 -16.668  -8.763
  745   1HZ   LYS 104          HZ1       LYS 104  32.961 -18.612 -10.161
  746   2HZ   LYS 104          HZ2       LYS 104  31.902 -18.962  -8.975
  747   3HZ   LYS 104          HZ3       LYS 104  31.371 -18.680 -10.497
  748    H    LEU 105           H        LEU 105  27.928 -12.469  -5.687
  749    HA   LEU 105           HA       LEU 105  25.180 -12.903  -6.205
  750   1HB   LEU 105          HB2       LEU 105  26.259 -12.693  -3.963
  751   2HB   LEU 105          HB3       LEU 105  26.514 -10.981  -4.226
  752    HG   LEU 105           HG       LEU 105  24.647 -11.521  -2.727
  753   1HD1  LEU 105          HD11      LEU 105  23.441 -10.192  -5.166
  754   2HD1  LEU 105          HD12      LEU 105  23.035  -9.964  -3.464
  755   3HD1  LEU 105          HD13      LEU 105  24.595  -9.389  -4.071
  756   1HD2  LEU 105          HD21      LEU 105  23.919 -13.606  -3.809
  757   2HD2  LEU 105          HD22      LEU 105  22.563 -12.505  -3.540
  758   3HD2  LEU 105          HD23      LEU 105  23.243 -12.671  -5.166
  759    H    GLU 106           H        GLU 106  27.070  -9.860  -6.185
  760    HA   GLU 106           HA       GLU 106  24.901  -8.247  -7.182
  761   1HB   GLU 106          HB2       GLU 106  27.905  -7.715  -7.080
  762   2HB   GLU 106          HB3       GLU 106  26.654  -6.511  -7.369
  763   1HG   GLU 106          HG2       GLU 106  25.657  -6.976  -5.154
  764   2HG   GLU 106          HG3       GLU 106  26.929  -8.154  -4.810
  765    H    ALA 107           H        ALA 107  27.640 -10.006  -8.623
  766    HA   ALA 107           HA       ALA 107  27.491  -8.889 -11.222
  767   1HB   ALA 107          HB1       ALA 107  28.203 -11.775 -10.619
  768   2HB   ALA 107          HB2       ALA 107  28.723 -10.788 -11.985
  769   3HB   ALA 107          HB3       ALA 107  29.329 -10.409 -10.359
  770    H    GLU 108           H        GLU 108  25.740 -11.768  -9.806
  771    HA   GLU 108           HA       GLU 108  24.341 -12.356 -12.239
  772   1HB   GLU 108          HB2       GLU 108  23.933 -13.049  -9.330
  773   2HB   GLU 108          HB3       GLU 108  22.795 -13.546 -10.569
  774   1HG   GLU 108          HG2       GLU 108  25.752 -14.327 -10.527
  775   2HG   GLU 108          HG3       GLU 108  24.401 -15.315 -10.037
  776    H    LEU 109           H        LEU 109  23.542 -10.222  -9.451
  777    HA   LEU 109           HA       LEU 109  20.900  -9.562 -10.293
  778   1HB   LEU 109          HB2       LEU 109  23.033  -8.170  -8.648
  779   2HB   LEU 109          HB3       LEU 109  21.610  -7.261  -9.128
  780    HG   LEU 109           HG       LEU 109  21.462  -9.875  -7.596
  781   1HD1  LEU 109          HD11      LEU 109  22.660  -8.151  -6.284
  782   2HD1  LEU 109          HD12      LEU 109  21.333  -7.008  -6.556
  783   3HD1  LEU 109          HD13      LEU 109  21.066  -8.482  -5.597
  784   1HD2  LEU 109          HD21      LEU 109  19.409  -7.662  -8.111
  785   2HD2  LEU 109          HD22      LEU 109  19.359  -9.306  -8.779
  786   3HD2  LEU 109          HD23      LEU 109  19.163  -9.057  -7.043
  787    H    LYS 110           H        LYS 110  24.046  -7.960 -11.094
  788    HA   LYS 110           HA       LYS 110  22.655  -6.096 -12.737
  789   1HB   LYS 110          HB2       LYS 110  24.652  -4.988 -13.299
  790   2HB   LYS 110          HB3       LYS 110  24.490  -5.290 -11.558
  791   1HG   LYS 110          HG2       LYS 110  25.670  -7.484 -12.222
  792   2HG   LYS 110          HG3       LYS 110  26.360  -6.561 -13.551
  793   1HD   LYS 110          HD2       LYS 110  26.689  -6.072 -10.541
  794   2HD   LYS 110          HD3       LYS 110  27.946  -6.529 -11.675
  795   1HE   LYS 110          HE2       LYS 110  26.441  -3.866 -11.715
  796   2HE   LYS 110          HE3       LYS 110  28.008  -4.125 -10.959
  797   1HZ   LYS 110          HZ1       LYS 110  28.273  -3.199 -13.153
  798   2HZ   LYS 110          HZ2       LYS 110  28.915  -4.692 -13.138
  799   3HZ   LYS 110          HZ3       LYS 110  27.471  -4.425 -13.860
  800    H    ASN 111           H        ASN 111  24.161  -9.160 -13.405
  801    HA   ASN 111           HA       ASN 111  24.012  -9.067 -16.266
  802   1HB   ASN 111          HB2       ASN 111  25.229 -10.870 -15.662
  803   2HB   ASN 111          HB3       ASN 111  24.471 -11.039 -14.115
  804   1HD2  ASN 111          HD21      ASN 111  22.582 -12.230 -13.760
  805   2HD2  ASN 111          HD22      ASN 111  22.262 -13.568 -14.819
  806    H    SER 112           H        SER 112  21.653  -9.855 -13.685
  807    HA   SER 112           HA       SER 112  19.666 -10.873 -15.469
  808   1HB   SER 112          HB2       SER 112  19.372  -9.754 -12.682
  809   2HB   SER 112          HB3       SER 112  18.158 -10.702 -13.557
  810    HG   SER 112           HG       SER 112  20.696 -11.512 -12.618
  811    H    GLY 113           H        GLY 113  20.400  -7.593 -14.235
  812   1HA   GLY 113          HA2       GLY 113  19.787  -6.236 -16.452
  813   2HA   GLY 113          HA3       GLY 113  18.166  -6.416 -15.776
  814    H    ALA 114           H        ALA 114  19.561  -6.180 -12.929
  815    HA   ALA 114           HA       ALA 114  18.912  -3.384 -12.764
  816   1HB   ALA 114          HB1       ALA 114  18.253  -4.872 -10.924
  817   2HB   ALA 114          HB2       ALA 114  19.955  -5.318 -10.648
  818   3HB   ALA 114          HB3       ALA 114  19.348  -3.668 -10.335
  819    H    LYS 115           H        LYS 115  20.523  -2.118 -11.093
  820    HA   LYS 115           HA       LYS 115  23.351  -2.571 -11.686
  821   1HB   LYS 115          HB2       LYS 115  23.726  -0.150 -12.116
  822   2HB   LYS 115          HB3       LYS 115  22.803  -0.942 -13.394
  823   1HG   LYS 115          HG2       LYS 115  20.705   0.044 -12.557
  824   2HG   LYS 115          HG3       LYS 115  21.544   0.713 -11.157
  825   1HD   LYS 115          HD2       LYS 115  21.161   2.468 -12.757
  826   2HD   LYS 115          HD3       LYS 115  22.901   2.158 -12.655
  827   1HE   LYS 115          HE2       LYS 115  22.779   0.802 -14.740
  828   2HE   LYS 115          HE3       LYS 115  21.032   1.069 -14.816
  829   1HZ   LYS 115          HZ1       LYS 115  23.091   3.193 -15.017
  830   2HZ   LYS 115          HZ2       LYS 115  22.229   2.588 -16.258
  831   3HZ   LYS 115          HZ3       LYS 115  21.475   3.440 -15.092
  832    H    GLN 116           H        GLN 116  24.672  -1.617  -9.980
  833    HA   GLN 116           HA       GLN 116  23.286  -1.293  -7.414
  834   1HB   GLN 116          HB2       GLN 116  25.433  -2.482  -7.498
  835   2HB   GLN 116          HB3       GLN 116  26.202  -1.059  -8.201
  836   1HG   GLN 116          HG2       GLN 116  25.743   0.237  -6.147
  837   2HG   GLN 116          HG3       GLN 116  24.824  -1.117  -5.482
  838   1HE2  GLN 116          HE22      GLN 116  26.433  -0.552  -3.688
  839   2HE2  GLN 116          HE21      GLN 116  27.895  -1.510  -3.662
  840    H    THR 117           H        THR 117  22.588   0.720  -6.726
  841    HA   THR 117           HA       THR 117  23.333   3.106  -8.256
  842    HB   THR 117           HB       THR 117  21.770   3.175  -5.648
  843    HG1  THR 117           HG1      THR 117  20.839   1.530  -6.824
  844   1HG2  THR 117          HG21      THR 117  22.447   5.280  -6.774
  845   2HG2  THR 117          HG22      THR 117  21.630   4.733  -8.257
  846   3HG2  THR 117          HG23      THR 117  20.702   5.069  -6.784
  847    H    GLY 118           H        GLY 118  24.761   4.702  -7.583
  848   1HA   GLY 118          HA2       GLY 118  26.215   5.905  -6.319
  849   2HA   GLY 118          HA3       GLY 118  25.460   5.199  -4.897
  850    H    GLU 119           H        GLU 119  26.398   3.502  -3.861
  851    HA   GLU 119           HA       GLU 119  28.738   2.053  -4.697
  852   1HB   GLU 119          HB2       GLU 119  30.298   2.906  -3.061
  853   2HB   GLU 119          HB3       GLU 119  29.834   4.214  -4.135
  854   1HG   GLU 119          HG2       GLU 119  28.302   5.117  -2.412
  855   2HG   GLU 119          HG3       GLU 119  28.677   3.758  -1.353
  856    H    THR 120           H        THR 120  29.486   0.800  -2.521
  857    HA   THR 120           HA       THR 120  27.075  -0.404  -1.460
  858    HB   THR 120           HB       THR 120  29.946  -0.748  -0.509
  859    HG1  THR 120           HG1      THR 120  30.035  -1.073  -2.618
  860   1HG2  THR 120          HG21      THR 120  28.290  -1.875   0.915
  861   2HG2  THR 120          HG22      THR 120  27.515  -2.596  -0.513
  862   3HG2  THR 120          HG23      THR 120  29.166  -3.068  -0.054
  863    H    LEU 121           H        LEU 121  26.013   0.052   0.394
  864    HA   LEU 121           HA       LEU 121  26.825   2.385   2.022
  865   1HB   LEU 121          HB2       LEU 121  24.428   1.654   1.132
  866   2HB   LEU 121          HB3       LEU 121  24.431   0.610   2.543
  867    HG   LEU 121           HG       LEU 121  24.827   3.612   2.599
  868   1HD1  LEU 121          HD11      LEU 121  22.568   2.806   1.755
  869   2HD1  LEU 121          HD12      LEU 121  22.274   2.229   3.408
  870   3HD1  LEU 121          HD13      LEU 121  22.609   3.961   3.084
  871   1HD2  LEU 121          HD21      LEU 121  24.456   1.635   4.843
  872   2HD2  LEU 121          HD22      LEU 121  25.669   2.936   4.657
  873   3HD2  LEU 121          HD23      LEU 121  24.015   3.347   5.019
  874    H    LYS 122           H        LYS 122  27.311   2.084   4.337
  875    HA   LYS 122           HA       LYS 122  27.711  -0.707   5.268
  876   1HB   LYS 122          HB2       LYS 122  29.706   1.524   5.826
  877   2HB   LYS 122          HB3       LYS 122  29.798  -0.166   6.254
  878   1HG   LYS 122          HG2       LYS 122  31.283  -0.159   4.532
  879   2HG   LYS 122          HG3       LYS 122  29.821  -0.584   3.642
  880   1HD   LYS 122          HD2       LYS 122  29.578   1.855   3.011
  881   2HD   LYS 122          HD3       LYS 122  31.074   2.204   3.885
  882   1HE   LYS 122          HE2       LYS 122  32.373   0.834   2.351
  883   2HE   LYS 122          HE3       LYS 122  30.899   0.190   1.610
  884   1HZ   LYS 122          HZ1       LYS 122  31.770   1.874   0.188
  885   2HZ   LYS 122          HZ2       LYS 122  30.385   2.399   0.811
  886   3HZ   LYS 122          HZ3       LYS 122  31.804   3.004   1.394
  887    H    ILE 123           H        ILE 123  26.927  -0.915   7.386
  888    HA   ILE 123           HA       ILE 123  26.224   1.539   8.880
  889    HB   ILE 123           HB       ILE 123  24.118  -0.072   9.433
  890   1HG1  ILE 123          HG12      ILE 123  23.107  -0.911   7.373
  891   2HG1  ILE 123          HG13      ILE 123  24.557  -0.594   6.457
  892   1HG2  ILE 123          HG21      ILE 123  24.023   2.286   8.859
  893   2HG2  ILE 123          HG22      ILE 123  24.302   1.918   7.151
  894   3HG2  ILE 123          HG23      ILE 123  22.803   1.390   7.950
  895   1HD1  ILE 123          HD11      ILE 123  24.173  -2.999   7.086
  896   2HD1  ILE 123          HD12      ILE 123  25.728  -2.389   7.657
  897   3HD1  ILE 123          HD13      ILE 123  24.365  -2.556   8.792
  898    H    ASN 124           H        ASN 124  26.512   1.414  11.042
  899    HA   ASN 124           HA       ASN 124  26.518  -0.968  12.585
  900   1HB   ASN 124          HB2       ASN 124  29.103  -0.100  11.430
  901   2HB   ASN 124          HB3       ASN 124  29.141   0.013  13.173
  902   1HD2  ASN 124          HD21      ASN 124  27.323  -2.506  11.306
  903   2HD2  ASN 124          HD22      ASN 124  28.167  -3.829  12.082
  904    H    ILE 125           H        ILE 125  27.334  -0.303  14.868
  905    HA   ILE 125           HA       ILE 125  26.894   2.533  15.515
  906    HB   ILE 125           HB       ILE 125  25.329   1.887  17.338
  907   1HG1  ILE 125          HG12      ILE 125  25.053  -0.810  15.929
  908   2HG1  ILE 125          HG13      ILE 125  25.967  -0.563  17.414
  909   1HG2  ILE 125          HG21      ILE 125  24.213   1.143  14.606
  910   2HG2  ILE 125          HG22      ILE 125  23.343   1.847  15.983
  911   3HG2  ILE 125          HG23      ILE 125  24.558   2.804  15.134
  912   1HD1  ILE 125          HD11      ILE 125  22.972  -0.145  17.071
  913   2HD1  ILE 125          HD12      ILE 125  23.784  -1.437  17.965
  914   3HD1  ILE 125          HD13      ILE 125  23.890   0.236  18.549
  915    H    LEU 126           H        LEU 126  27.176   2.425  18.227
  916    HA   LEU 126           HA       LEU 126  29.893   1.939  18.660
  917   1HB   LEU 126          HB2       LEU 126  28.494   3.393  20.069
  918   2HB   LEU 126          HB3       LEU 126  27.599   1.991  20.661
  919    HG   LEU 126           HG       LEU 126  29.641   1.122  21.766
  920   1HD1  LEU 126          HD11      LEU 126  31.417   2.031  20.328
  921   2HD1  LEU 126          HD12      LEU 126  30.957   3.693  20.767
  922   3HD1  LEU 126          HD13      LEU 126  31.645   2.594  21.983
  923   1HD2  LEU 126          HD21      LEU 126  29.024   4.023  22.460
  924   2HD2  LEU 126          HD22      LEU 126  28.100   2.601  22.990
  925   3HD2  LEU 126          HD23      LEU 126  29.769   2.818  23.535
  926    H    ASP 127           H        ASP 127  27.127  -0.234  19.178
  927    HA   ASP 127           HA       ASP 127  28.753  -2.500  20.063
  928   1HB   ASP 127          HB2       ASP 127  26.457  -2.303  20.850
  929   2HB   ASP 127          HB3       ASP 127  25.849  -2.292  19.193
  930    H    HIS 128           H        HIS 128  30.190  -1.900  18.219
  931    HA   HIS 128           HA       HIS 128  29.517  -2.209  15.504
  932   1HB   HIS 128          HB2       HIS 128  31.981  -2.108  15.203
  933   2HB   HIS 128          HB3       HIS 128  31.354  -0.840  16.240
  934    HD1  HIS 128           HD1      HIS 128  31.958  -1.070  18.932
  935    HD2  HIS 128           HD2      HIS 128  33.682  -3.885  16.306
  936    HE1  HIS 128           HE1      HIS 128  33.816  -2.224  20.234
  937    H    ASP 129           H        ASP 129  30.641  -3.756  13.996
  938    HA   ASP 129           HA       ASP 129  30.789  -6.514  15.007
  939   1HB   ASP 129          HB2       ASP 129  28.481  -5.300  13.673
  940   2HB   ASP 129          HB3       ASP 129  29.112  -6.588  12.688
  941    H    ILE 130           H        ILE 130  30.585  -4.726  11.880
  942    HA   ILE 130           HA       ILE 130  32.946  -6.281  10.938
  943    HB   ILE 130           HB       ILE 130  30.234  -6.116   9.609
  944   1HG1  ILE 130          HG12      ILE 130  31.866  -8.569  10.220
  945   2HG1  ILE 130          HG13      ILE 130  30.688  -7.918  11.350
  946   1HG2  ILE 130          HG21      ILE 130  32.843  -7.139   8.400
  947   2HG2  ILE 130          HG22      ILE 130  31.233  -7.311   7.671
  948   3HG2  ILE 130          HG23      ILE 130  31.932  -5.719   7.845
  949   1HD1  ILE 130          HD11      ILE 130  28.881  -8.150   9.697
  950   2HD1  ILE 130          HD12      ILE 130  30.020  -8.909   8.565
  951   3HD1  ILE 130          HD13      ILE 130  29.654  -9.692  10.107
  952    HA   PRO 131           HA       PRO 131  33.146  -2.453   8.218
  953   1HB   PRO 131          HB2       PRO 131  31.210  -0.563   8.026
  954   2HB   PRO 131          HB3       PRO 131  31.116  -2.116   7.130
  955   1HG   PRO 131          HG2       PRO 131  29.845  -1.456   9.811
  956   2HG   PRO 131          HG3       PRO 131  29.041  -2.100   8.385
  957   1HD   PRO 131          HD2       PRO 131  29.863  -3.796  10.282
  958   2HD   PRO 131          HD3       PRO 131  30.121  -4.198   8.560
  959    H    GLU 132           H        GLU 132  31.305  -1.757  11.120
  960    HA   GLU 132           HA       GLU 132  31.726  -0.600  13.024
  961   1HB   GLU 132          HB2       GLU 132  34.578  -0.096  12.133
  962   2HB   GLU 132          HB3       GLU 132  33.919  -0.070  13.763
  963   1HG   GLU 132          HG2       GLU 132  33.481  -2.530  13.607
  964   2HG   GLU 132          HG3       GLU 132  34.217  -2.541  12.011
  965    H    ASP 133           H        ASP 133  30.928   0.780  10.365
  966    HA   ASP 133           HA       ASP 133  31.196   3.554  11.352
  967   1HB   ASP 133          HB2       ASP 133  33.048   3.114   9.735
  968   2HB   ASP 133          HB3       ASP 133  31.857   2.675   8.512
  969    HA   PRO 134           HA       PRO 134  26.925   3.200  10.085
  970   1HB   PRO 134          HB2       PRO 134  25.971   5.686  10.628
  971   2HB   PRO 134          HB3       PRO 134  26.580   4.600  11.909
  972   1HG   PRO 134          HG2       PRO 134  28.098   6.817  10.487
  973   2HG   PRO 134          HG3       PRO 134  27.926   6.555  12.255
  974   1HD   PRO 134          HD2       PRO 134  30.093   5.653  10.884
  975   2HD   PRO 134          HD3       PRO 134  29.382   4.705  12.221
  976    H    ALA 135           H        ALA 135  29.076   5.185   8.248
  977    HA   ALA 135           HA       ALA 135  28.884   6.624   6.533
  978   1HB   ALA 135          HB1       ALA 135  28.609   5.412   4.482
  979   2HB   ALA 135          HB2       ALA 135  29.342   4.325   5.679
  980   3HB   ALA 135          HB3       ALA 135  27.614   4.182   5.275
  981    H    GLU 136           H        GLU 136  26.797   7.517   8.078
  982    HA   GLU 136           HA       GLU 136  24.255   7.375   6.888
  983   1HB   GLU 136          HB2       GLU 136  23.629   9.195   8.360
  984   2HB   GLU 136          HB3       GLU 136  24.636   8.023   9.209
  985   1HG   GLU 136          HG2       GLU 136  26.608   9.534   8.938
  986   2HG   GLU 136          HG3       GLU 136  25.582  10.713   8.116
  987    H    GLU 137           H        GLU 137  26.977   9.332   5.944
  988    HA   GLU 137           HA       GLU 137  25.643  11.388   4.492
  989   1HB   GLU 137          HB2       GLU 137  28.346  10.034   4.097
  990   2HB   GLU 137          HB3       GLU 137  27.834  11.468   3.209
  991   1HG   GLU 137          HG2       GLU 137  28.114  11.322   6.244
  992   2HG   GLU 137          HG3       GLU 137  29.321  11.966   5.143
  993    H    TRP 138           H        TRP 138  26.196   7.970   3.734
  994    HA   TRP 138           HA       TRP 138  25.821   7.969   0.919
  995   1HB   TRP 138          HB2       TRP 138  26.411   6.074   2.566
  996   2HB   TRP 138          HB3       TRP 138  24.723   5.878   2.798
  997    HD1  TRP 138           HD1      TRP 138  27.452   4.888   0.513
  998    HE1  TRP 138           HE1      TRP 138  26.549   3.352  -1.331
  999    HE3  TRP 138           HE3      TRP 138  22.414   5.674   1.109
 1000    HZ2  TRP 138           HZ2      TRP 138  24.025   2.601  -2.450
 1001    HZ3  TRP 138           HZ3      TRP 138  20.798   4.422  -0.268
 1002    HH2  TRP 138           HH2      TRP 138  21.577   2.909  -2.072
 1003    H    LEU 139           H        LEU 139  23.575   7.391   3.524
 1004    HA   LEU 139           HA       LEU 139  21.175   7.238   2.104
 1005   1HB   LEU 139          HB2       LEU 139  21.927   7.213   4.815
 1006   2HB   LEU 139          HB3       LEU 139  20.934   8.644   4.725
 1007    HG   LEU 139           HG       LEU 139  19.109   7.257   3.642
 1008   1HD1  LEU 139          HD11      LEU 139  20.415   5.336   2.809
 1009   2HD1  LEU 139          HD12      LEU 139  20.977   4.977   4.457
 1010   3HD1  LEU 139          HD13      LEU 139  19.275   4.763   4.024
 1011   1HD2  LEU 139          HD21      LEU 139  18.432   6.201   5.787
 1012   2HD2  LEU 139          HD22      LEU 139  20.084   6.417   6.410
 1013   3HD2  LEU 139          HD23      LEU 139  19.076   7.832   6.035
 1014    H    GLY 140           H        GLY 140  22.491  10.169   3.672
 1015   1HA   GLY 140          HA2       GLY 140  20.466  11.945   2.820
 1016   2HA   GLY 140          HA3       GLY 140  22.124  12.408   3.248
 1017    H    SER 141           H        SER 141  23.709  11.337   1.300
 1018    HA   SER 141           HA       SER 141  23.296  13.212  -0.787
 1019   1HB   SER 141          HB2       SER 141  25.483  12.271   0.083
 1020   2HB   SER 141          HB3       SER 141  25.131  10.770  -0.793
 1021    HG   SER 141           HG       SER 141  26.472  12.243  -1.959
 1022    H    TRP 142           H        TRP 142  22.813   9.633  -0.676
 1023    HA   TRP 142           HA       TRP 142  22.115   9.274  -3.395
 1024   1HB   TRP 142          HB2       TRP 142  22.815   7.485  -1.932
 1025   2HB   TRP 142          HB3       TRP 142  21.447   7.774  -0.869
 1026    HD1  TRP 142           HD1      TRP 142  22.169   6.350  -4.376
 1027    HE1  TRP 142           HE1      TRP 142  20.426   4.543  -4.857
 1028    HE3  TRP 142           HE3      TRP 142  19.268   6.939  -0.215
 1029    HZ2  TRP 142           HZ2      TRP 142  17.952   3.568  -3.655
 1030    HZ3  TRP 142           HZ3      TRP 142  17.215   5.567   0.089
 1031    HH2  TRP 142           HH2      TRP 142  16.558   3.889  -1.623
 1032    H    VAL 143           H        VAL 143  20.069  10.030  -0.516
 1033    HA   VAL 143           HA       VAL 143  17.574  10.056  -1.896
 1034    HB   VAL 143           HB       VAL 143  18.615  11.307   0.653
 1035   1HG1  VAL 143          HG11      VAL 143  17.005  12.962  -0.117
 1036   2HG1  VAL 143          HG12      VAL 143  15.810  11.680  -0.453
 1037   3HG1  VAL 143          HG13      VAL 143  16.328  12.035   1.217
 1038   1HG2  VAL 143          HG21      VAL 143  16.406   9.269   0.096
 1039   2HG2  VAL 143          HG22      VAL 143  18.066   8.856   0.555
 1040   3HG2  VAL 143          HG23      VAL 143  17.043   9.743   1.687
 1041    H    ASN 144           H        ASN 144  19.959  12.729  -1.290
 1042    HA   ASN 144           HA       ASN 144  18.477  14.699  -2.668
 1043   1HB   ASN 144          HB2       ASN 144  21.507  14.485  -2.430
 1044   2HB   ASN 144          HB3       ASN 144  20.621  15.927  -2.889
 1045   1HD2  ASN 144          HD22      ASN 144  22.462  15.443  -0.575
 1046   2HD2  ASN 144          HD21      ASN 144  21.531  15.771   0.857
 1047    H    LEU 145           H        LEU 145  20.551  12.142  -3.898
 1048    HA   LEU 145           HA       LEU 145  20.862  13.282  -6.565
 1049   1HB   LEU 145          HB2       LEU 145  21.785  10.847  -5.108
 1050   2HB   LEU 145          HB3       LEU 145  21.433  10.587  -6.806
 1051    HG   LEU 145           HG       LEU 145  22.941  12.401  -7.469
 1052   1HD1  LEU 145          HD11      LEU 145  22.844  13.828  -5.422
 1053   2HD1  LEU 145          HD12      LEU 145  23.738  12.582  -4.531
 1054   3HD1  LEU 145          HD13      LEU 145  24.503  13.432  -5.888
 1055   1HD2  LEU 145          HD21      LEU 145  23.763  10.080  -7.313
 1056   2HD2  LEU 145          HD22      LEU 145  25.046  11.235  -6.920
 1057   3HD2  LEU 145          HD23      LEU 145  24.227  10.343  -5.618
 1058    H    LEU 146           H        LEU 146  18.839  10.608  -5.147
 1059    HA   LEU 146           HA       LEU 146  17.623  10.057  -7.670
 1060   1HB   LEU 146          HB2       LEU 146  16.347   8.509  -6.536
 1061   2HB   LEU 146          HB3       LEU 146  17.948   8.458  -5.832
 1062    HG   LEU 146           HG       LEU 146  16.785  10.010  -3.986
 1063   1HD1  LEU 146          HD11      LEU 146  14.471   9.259  -3.516
 1064   2HD1  LEU 146          HD12      LEU 146  14.534  10.153  -5.031
 1065   3HD1  LEU 146          HD13      LEU 146  14.431   8.385  -5.056
 1066   1HD2  LEU 146          HD21      LEU 146  16.351   8.017  -2.644
 1067   2HD2  LEU 146          HD22      LEU 146  16.316   7.002  -4.094
 1068   3HD2  LEU 146          HD23      LEU 146  17.824   7.800  -3.587
 1069    H    LYS 147           H        LYS 147  16.787  12.203  -4.990
 1070    HA   LYS 147           HA       LYS 147  14.178  12.945  -5.811
 1071   1HB   LYS 147          HB2       LYS 147  16.380  14.230  -4.161
 1072   2HB   LYS 147          HB3       LYS 147  14.962  15.180  -4.636
 1073   1HG   LYS 147          HG2       LYS 147  13.449  13.463  -3.685
 1074   2HG   LYS 147          HG3       LYS 147  14.845  12.522  -3.142
 1075   1HD   LYS 147          HD2       LYS 147  15.524  14.363  -1.651
 1076   2HD   LYS 147          HD3       LYS 147  14.190  15.372  -2.256
 1077   1HE   LYS 147          HE2       LYS 147  12.601  13.636  -1.482
 1078   2HE   LYS 147          HE3       LYS 147  13.927  12.688  -0.819
 1079   1HZ   LYS 147          HZ1       LYS 147  12.887  13.955   0.886
 1080   2HZ   LYS 147          HZ2       LYS 147  14.388  14.580   0.679
 1081   3HZ   LYS 147          HZ3       LYS 147  13.081  15.378   0.095
  Start of MODEL   19
    1   1H    MET   1          H1        MET   1   0.367  -0.291  -0.159
    2   2H    MET   1          H2        MET   1   1.717  -1.044   0.385
    3   3H    MET   1          H3        MET   1   1.250   0.368   1.060
    4    HA   MET   1           HA       MET   1   2.184  -0.001  -1.698
    5   1HB   MET   1          HB2       MET   1   0.483   1.769  -1.579
    6   2HB   MET   1          HB3       MET   1   1.355   2.563  -0.261
    7   1HG   MET   1          HG2       MET   1   1.736   3.660  -2.430
    8   2HG   MET   1          HG3       MET   1   3.231   3.060  -1.727
    9   1HE   MET   1          HE1       MET   1   4.639   3.242  -3.860
   10   2HE   MET   1          HE2       MET   1   4.106   2.704  -5.468
   11   3HE   MET   1          HE3       MET   1   3.248   4.027  -4.646
   12    H    ALA   2           H        ALA   2   4.368   0.305  -2.046
   13    HA   ALA   2           HA       ALA   2   5.987   1.752  -0.137
   14   1HB   ALA   2          HB1       ALA   2   7.711  -0.046   0.006
   15   2HB   ALA   2          HB2       ALA   2   6.206  -0.491   0.829
   16   3HB   ALA   2          HB3       ALA   2   6.586  -1.173  -0.769
   17    H    ASP   3           H        ASP   3   7.975   2.379  -1.118
   18    HA   ASP   3           HA       ASP   3   8.066   2.233  -4.073
   19   1HB   ASP   3          HB2       ASP   3   7.915   4.485  -2.898
   20   2HB   ASP   3          HB3       ASP   3   9.454   4.125  -2.139
   21    H    ILE   4           H        ILE   4   9.724   1.401  -1.096
   22    HA   ILE   4           HA       ILE   4  11.994   0.250  -2.635
   23    HB   ILE   4           HB       ILE   4  12.194   1.436   0.150
   24   1HG1  ILE   4          HG12      ILE   4  13.092   2.789  -2.424
   25   2HG1  ILE   4          HG13      ILE   4  11.694   3.284  -1.469
   26   1HG2  ILE   4          HG21      ILE   4  14.613   1.230  -0.231
   27   2HG2  ILE   4          HG22      ILE   4  13.845  -0.328  -0.486
   28   3HG2  ILE   4          HG23      ILE   4  14.327   0.646  -1.886
   29   1HD1  ILE   4          HD11      ILE   4  13.478   4.768  -0.958
   30   2HD1  ILE   4          HD12      ILE   4  13.191   3.747   0.463
   31   3HD1  ILE   4          HD13      ILE   4  14.590   3.444  -0.596
   32    H    THR   5           H        THR   5  12.082  -1.906  -2.371
   33    HA   THR   5           HA       THR   5  10.751  -3.190  -0.048
   34    HB   THR   5           HB       THR   5  10.315  -4.105  -2.321
   35    HG1  THR   5           HG1      THR   5  10.182  -5.500  -0.626
   36   1HG2  THR   5          HG21      THR   5  12.391  -3.645  -3.472
   37   2HG2  THR   5          HG22      THR   5  13.249  -4.819  -2.449
   38   3HG2  THR   5          HG23      THR   5  11.968  -5.360  -3.549
   39    H    LEU   6           H        LEU   6  11.985  -3.929   1.686
   40    HA   LEU   6           HA       LEU   6  14.943  -3.480   1.588
   41   1HB   LEU   6          HB2       LEU   6  12.944  -3.773   3.845
   42   2HB   LEU   6          HB3       LEU   6  14.658  -3.904   4.109
   43    HG   LEU   6           HG       LEU   6  13.719  -1.775   4.766
   44   1HD1  LEU   6          HD11      LEU   6  16.095  -1.919   4.278
   45   2HD1  LEU   6          HD12      LEU   6  15.788  -1.496   2.576
   46   3HD1  LEU   6          HD13      LEU   6  15.464  -0.322   3.866
   47   1HD2  LEU   6          HD21      LEU   6  12.046  -1.423   2.974
   48   2HD2  LEU   6          HD22      LEU   6  13.111  -0.023   3.205
   49   3HD2  LEU   6          HD23      LEU   6  13.364  -1.102   1.823
   50    H    ILE   7           H        ILE   7  15.713  -5.336   0.658
   51    HA   ILE   7           HA       ILE   7  14.621  -7.966   1.430
   52    HB   ILE   7           HB       ILE   7  16.928  -7.452  -0.475
   53   1HG1  ILE   7          HG12      ILE   7  15.131  -6.188  -1.456
   54   2HG1  ILE   7          HG13      ILE   7  15.392  -7.666  -2.355
   55   1HG2  ILE   7          HG21      ILE   7  16.695  -9.763   0.325
   56   2HG2  ILE   7          HG22      ILE   7  14.987  -9.781  -0.145
   57   3HG2  ILE   7          HG23      ILE   7  16.254  -9.663  -1.383
   58   1HD1  ILE   7          HD11      ILE   7  13.031  -7.221  -2.189
   59   2HD1  ILE   7          HD12      ILE   7  13.375  -8.678  -1.254
   60   3HD1  ILE   7          HD13      ILE   7  13.108  -7.132  -0.417
   61    H    SER   8           H        SER   8  15.215  -7.421   3.699
   62    HA   SER   8           HA       SER   8  18.031  -7.301   4.359
   63   1HB   SER   8          HB2       SER   8  15.968  -7.949   6.436
   64   2HB   SER   8          HB3       SER   8  17.372  -6.878   6.524
   65    HG   SER   8           HG       SER   8  14.794  -6.462   5.619
   66    H    GLY   9           H        GLY   9  19.107  -8.812   5.790
   67   1HA   GLY   9          HA2       GLY   9  19.425 -10.860   6.880
   68   2HA   GLY   9          HA3       GLY   9  17.979 -11.531   6.099
   69    H    SER  10           H        SER  10  19.818 -13.223   5.934
   70    HA   SER  10           HA       SER  10  20.833 -13.087   3.141
   71   1HB   SER  10          HB2       SER  10  23.015 -13.986   4.033
   72   2HB   SER  10          HB3       SER  10  22.665 -12.320   4.488
   73    HG   SER  10           HG       SER  10  23.234 -14.311   6.097
   74    H    THR  11           H        THR  11  20.686 -15.174   6.066
   75    HA   THR  11           HA       THR  11  20.133 -17.569   4.528
   76    HB   THR  11           HB       THR  11  20.134 -18.512   6.905
   77    HG1  THR  11           HG1      THR  11  19.490 -16.777   8.116
   78   1HG2  THR  11          HG21      THR  11  22.489 -18.179   7.353
   79   2HG2  THR  11          HG22      THR  11  22.261 -18.325   5.606
   80   3HG2  THR  11          HG23      THR  11  22.527 -16.732   6.327
   81    H    LEU  12           H        LEU  12  18.082 -15.646   4.020
   82    HA   LEU  12           HA       LEU  12  15.904 -15.136   4.088
   83   1HB   LEU  12          HB2       LEU  12  15.764 -17.713   3.884
   84   2HB   LEU  12          HB3       LEU  12  15.275 -17.711   5.560
   85    HG   LEU  12           HG       LEU  12  13.269 -16.335   4.965
   86   1HD1  LEU  12          HD11      LEU  12  12.691 -16.183   2.498
   87   2HD1  LEU  12          HD12      LEU  12  13.961 -15.088   3.036
   88   3HD1  LEU  12          HD13      LEU  12  14.381 -16.572   2.138
   89   1HD2  LEU  12          HD21      LEU  12  12.076 -18.117   3.784
   90   2HD2  LEU  12          HD22      LEU  12  13.617 -18.845   3.275
   91   3HD2  LEU  12          HD23      LEU  12  13.169 -18.803   4.994
   92    H    GLY  13           H        GLY  13  17.682 -14.429   6.340
   93   1HA   GLY  13          HA2       GLY  13  15.847 -13.139   8.094
   94   2HA   GLY  13          HA3       GLY  13  16.495 -14.592   8.869
   95    H    GLY  14           H        GLY  14  17.016 -12.061   9.872
   96   1HA   GLY  14          HA2       GLY  14  19.110 -11.428  10.924
   97   2HA   GLY  14          HA3       GLY  14  19.939 -11.667   9.384
   98    H    ALA  15           H        ALA  15  20.295  -9.334  10.608
   99    HA   ALA  15           HA       ALA  15  20.377  -7.144  10.411
  100   1HB   ALA  15          HB1       ALA  15  20.422  -6.250   8.164
  101   2HB   ALA  15          HB2       ALA  15  21.158  -7.862   8.184
  102   3HB   ALA  15          HB3       ALA  15  19.509  -7.640   7.549
  103    H    GLU  16           H        GLU  16  17.219  -8.328  10.363
  104    HA   GLU  16           HA       GLU  16  15.708  -6.232   9.441
  105   1HB   GLU  16          HB2       GLU  16  15.103  -8.057  11.793
  106   2HB   GLU  16          HB3       GLU  16  13.929  -6.967  11.037
  107   1HG   GLU  16          HG2       GLU  16  14.276  -8.121   8.852
  108   2HG   GLU  16          HG3       GLU  16  15.352  -9.272   9.649
  109    H    TYR  17           H        TYR  17  17.337  -6.361  12.609
  110    HA   TYR  17           HA       TYR  17  16.032  -4.192  13.864
  111   1HB   TYR  17          HB2       TYR  17  17.559  -5.753  14.997
  112   2HB   TYR  17          HB3       TYR  17  18.920  -5.143  14.065
  113    HD1  TYR  17           HD1      TYR  17  16.370  -4.210  16.638
  114    HD2  TYR  17           HD2      TYR  17  20.128  -3.182  14.776
  115    HE1  TYR  17           HE1      TYR  17  16.773  -2.509  18.395
  116    HE2  TYR  17           HE2      TYR  17  20.541  -1.488  16.525
  117    HH   TYR  17           HH       TYR  17  19.737  -0.483  18.464
  118    H    VAL  18           H        VAL  18  18.806  -4.216  11.583
  119    HA   VAL  18           HA       VAL  18  19.137  -1.308  11.692
  120    HB   VAL  18           HB       VAL  18  20.313  -3.452   9.865
  121   1HG1  VAL  18          HG11      VAL  18  22.018  -1.707   9.318
  122   2HG1  VAL  18          HG12      VAL  18  20.409  -1.321   8.708
  123   3HG1  VAL  18          HG13      VAL  18  21.017  -0.502  10.155
  124   1HG2  VAL  18          HG21      VAL  18  22.380  -3.099  11.207
  125   2HG2  VAL  18          HG22      VAL  18  21.493  -1.996  12.279
  126   3HG2  VAL  18          HG23      VAL  18  21.065  -3.718  12.203
  127    H    ALA  19           H        ALA  19  17.546  -3.756   9.592
  128    HA   ALA  19           HA       ALA  19  16.901  -2.039   7.461
  129   1HB   ALA  19          HB1       ALA  19  15.310  -3.690   6.799
  130   2HB   ALA  19          HB2       ALA  19  16.714  -4.538   7.481
  131   3HB   ALA  19          HB3       ALA  19  15.212  -4.363   8.430
  132    H    GLU  20           H        GLU  20  15.068  -2.635  10.534
  133    HA   GLU  20           HA       GLU  20  12.802  -1.081   9.882
  134   1HB   GLU  20          HB2       GLU  20  14.220  -1.779  12.485
  135   2HB   GLU  20          HB3       GLU  20  12.800  -0.740  12.454
  136   1HG   GLU  20          HG2       GLU  20  11.489  -2.507  11.329
  137   2HG   GLU  20          HG3       GLU  20  12.879  -3.586  11.381
  138    H    HIS  21           H        HIS  21  15.967  -0.079  11.305
  139    HA   HIS  21           HA       HIS  21  15.198   2.663  11.681
  140   1HB   HIS  21          HB2       HIS  21  17.111   1.512  12.821
  141   2HB   HIS  21          HB3       HIS  21  17.991   1.510  11.292
  142    HD1  HIS  21           HD1      HIS  21  17.097   3.808  14.183
  143    HD2  HIS  21           HD2      HIS  21  18.715   3.999  10.300
  144    HE1  HIS  21           HE1      HIS  21  18.176   6.103  13.968
  145    H    LEU  22           H        LEU  22  16.940   0.950   9.052
  146    HA   LEU  22           HA       LEU  22  17.443   3.150   7.347
  147   1HB   LEU  22          HB2       LEU  22  16.915   0.193   6.891
  148   2HB   LEU  22          HB3       LEU  22  17.156   1.257   5.532
  149    HG   LEU  22           HG       LEU  22  19.169   0.993   7.815
  150   1HD1  LEU  22          HD11      LEU  22  19.179  -0.441   5.125
  151   2HD1  LEU  22          HD12      LEU  22  20.424  -0.534   6.401
  152   3HD1  LEU  22          HD13      LEU  22  18.821  -1.193   6.694
  153   1HD2  LEU  22          HD21      LEU  22  19.434   2.111   4.983
  154   2HD2  LEU  22          HD22      LEU  22  19.470   3.048   6.492
  155   3HD2  LEU  22          HD23      LEU  22  20.769   1.909   6.137
  156    H    ALA  23           H        ALA  23  14.704   0.858   7.267
  157    HA   ALA  23           HA       ALA  23  13.188   2.066   5.271
  158   1HB   ALA  23          HB1       ALA  23  12.246   0.540   7.738
  159   2HB   ALA  23          HB2       ALA  23  11.267   0.852   6.299
  160   3HB   ALA  23          HB3       ALA  23  12.710  -0.163   6.173
  161    H    GLU  24           H        GLU  24  13.118   2.790   8.827
  162    HA   GLU  24           HA       GLU  24  11.009   4.658   8.736
  163   1HB   GLU  24          HB2       GLU  24  12.172   3.610  10.760
  164   2HB   GLU  24          HB3       GLU  24  13.438   4.801  10.591
  165   1HG   GLU  24          HG2       GLU  24  11.791   6.607  10.848
  166   2HG   GLU  24          HG3       GLU  24  10.477   5.435  10.953
  167    H    LYS  25           H        LYS  25  14.561   5.279   8.740
  168    HA   LYS  25           HA       LYS  25  14.427   8.043   8.236
  169   1HB   LYS  25          HB2       LYS  25  16.464   5.911   7.443
  170   2HB   LYS  25          HB3       LYS  25  16.750   7.620   7.237
  171   1HG   LYS  25          HG2       LYS  25  16.205   6.154   9.874
  172   2HG   LYS  25          HG3       LYS  25  17.740   6.738   9.321
  173   1HD   LYS  25          HD2       LYS  25  15.371   8.287  10.344
  174   2HD   LYS  25          HD3       LYS  25  17.006   8.225  10.999
  175   1HE   LYS  25          HE2       LYS  25  17.792   9.416   8.879
  176   2HE   LYS  25          HE3       LYS  25  16.083   9.636   8.456
  177   1HZ   LYS  25          HZ1       LYS  25  17.394  10.696  10.893
  178   2HZ   LYS  25          HZ2       LYS  25  16.959  11.569   9.592
  179   3HZ   LYS  25          HZ3       LYS  25  15.812  10.887  10.526
  180    H    LEU  26           H        LEU  26  14.361   5.387   5.884
  181    HA   LEU  26           HA       LEU  26  14.366   7.133   3.598
  182   1HB   LEU  26          HB2       LEU  26  13.594   4.245   4.019
  183   2HB   LEU  26          HB3       LEU  26  13.475   5.019   2.432
  184    HG   LEU  26           HG       LEU  26  16.058   4.952   4.053
  185   1HD1  LEU  26          HD11      LEU  26  15.210   3.062   1.825
  186   2HD1  LEU  26          HD12      LEU  26  16.773   3.090   2.678
  187   3HD1  LEU  26          HD13      LEU  26  15.304   2.652   3.551
  188   1HD2  LEU  26          HD21      LEU  26  16.065   6.708   2.356
  189   2HD2  LEU  26          HD22      LEU  26  17.111   5.392   1.846
  190   3HD2  LEU  26          HD23      LEU  26  15.494   5.565   1.123
  191    H    GLU  27           H        GLU  27  11.655   6.079   5.731
  192    HA   GLU  27           HA       GLU  27   9.670   7.102   3.897
  193   1HB   GLU  27          HB2       GLU  27   9.667   6.495   6.884
  194   2HB   GLU  27          HB3       GLU  27   8.306   7.194   6.028
  195   1HG   GLU  27          HG2       GLU  27   8.327   5.248   4.449
  196   2HG   GLU  27          HG3       GLU  27   9.581   4.511   5.426
  197    H    GLU  28           H        GLU  28  11.601   8.450   6.660
  198    HA   GLU  28           HA       GLU  28  10.525  11.069   6.532
  199   1HB   GLU  28          HB2       GLU  28  13.248  10.011   7.406
  200   2HB   GLU  28          HB3       GLU  28  12.706  11.646   7.644
  201   1HG   GLU  28          HG2       GLU  28  11.321   9.203   8.811
  202   2HG   GLU  28          HG3       GLU  28  12.517  10.181   9.643
  203    H    ALA  29           H        ALA  29  12.891   9.410   4.481
  204    HA   ALA  29           HA       ALA  29  13.921  11.766   3.192
  205   1HB   ALA  29          HB1       ALA  29  13.828   8.913   2.114
  206   2HB   ALA  29          HB2       ALA  29  14.834  10.228   1.534
  207   3HB   ALA  29          HB3       ALA  29  15.111   9.573   3.153
  208    H    GLY  30           H        GLY  30  10.821  10.258   3.019
  209   1HA   GLY  30          HA2       GLY  30   9.129  11.646   2.096
  210   2HA   GLY  30          HA3       GLY  30  10.156  12.021   0.711
  211    H    PHE  31           H        PHE  31  10.071   8.665   1.734
  212    HA   PHE  31           HA       PHE  31   8.303   8.021  -0.593
  213   1HB   PHE  31          HB2       PHE  31  10.609   6.286   0.245
  214   2HB   PHE  31          HB3       PHE  31   9.748   6.329  -1.276
  215    HD1  PHE  31           HD1      PHE  31  12.728   7.319   0.372
  216    HD2  PHE  31           HD2      PHE  31   9.937   8.621  -2.650
  217    HE1  PHE  31           HE1      PHE  31  14.446   8.833  -0.569
  218    HE2  PHE  31           HE2      PHE  31  11.664  10.137  -3.587
  219    HZ   PHE  31           HZ       PHE  31  13.926  10.240  -2.555
  220    H    THR  32           H        THR  32   8.153   5.282  -0.250
  221    HA   THR  32           HA       THR  32   7.305   4.791   2.536
  222    HB   THR  32           HB       THR  32   5.518   3.267   1.490
  223    HG1  THR  32           HG1      THR  32   5.755   5.166  -0.614
  224   1HG2  THR  32          HG21      THR  32   3.833   5.050   1.503
  225   2HG2  THR  32          HG22      THR  32   4.980   5.211   2.847
  226   3HG2  THR  32          HG23      THR  32   5.119   6.283   1.435
  227    H    THR  33           H        THR  33   7.685   2.599   3.163
  228    HA   THR  33           HA       THR  33   9.453   1.055   1.343
  229    HB   THR  33           HB       THR  33  11.048   0.939   3.198
  230    HG1  THR  33           HG1      THR  33  10.611   2.679   4.873
  231   1HG2  THR  33          HG21      THR  33  10.414   3.887   2.775
  232   2HG2  THR  33          HG22      THR  33  11.996   3.104   3.023
  233   3HG2  THR  33          HG23      THR  33  11.128   2.881   1.501
  234    H    GLU  34           H        GLU  34   9.731  -1.241   1.992
  235    HA   GLU  34           HA       GLU  34   7.651  -2.229   3.846
  236   1HB   GLU  34          HB2       GLU  34   7.912  -2.486   1.069
  237   2HB   GLU  34          HB3       GLU  34   8.389  -4.003   1.758
  238   1HG   GLU  34          HG2       GLU  34   5.941  -2.435   2.645
  239   2HG   GLU  34          HG3       GLU  34   5.911  -3.546   1.347
  240    H    THR  35           H        THR  35   9.026  -2.521   5.675
  241    HA   THR  35           HA       THR  35  11.658  -3.605   5.512
  242    HB   THR  35           HB       THR  35   9.913  -3.755   7.975
  243    HG1  THR  35           HG1      THR  35  10.161  -1.629   8.326
  244   1HG2  THR  35          HG21      THR  35  12.839  -2.996   7.513
  245   2HG2  THR  35          HG22      THR  35  12.047  -3.272   9.081
  246   3HG2  THR  35          HG23      THR  35  12.281  -4.623   7.959
  247    H    LEU  36           H        LEU  36  12.205  -5.710   5.184
  248    HA   LEU  36           HA       LEU  36  10.378  -7.939   5.893
  249   1HB   LEU  36          HB2       LEU  36  11.645  -7.469   3.159
  250   2HB   LEU  36          HB3       LEU  36  10.717  -8.872   3.610
  251    HG   LEU  36           HG       LEU  36   9.488  -6.103   3.520
  252   1HD1  LEU  36          HD11      LEU  36   8.724  -6.634   1.297
  253   2HD1  LEU  36          HD12      LEU  36  10.494  -6.670   1.342
  254   3HD1  LEU  36          HD13      LEU  36   9.594  -8.197   1.317
  255   1HD2  LEU  36          HD21      LEU  36   8.279  -8.906   3.388
  256   2HD2  LEU  36          HD22      LEU  36   8.212  -7.810   4.788
  257   3HD2  LEU  36          HD23      LEU  36   7.392  -7.372   3.285
  258    H    HIS  37           H        HIS  37  11.612 -10.037   5.365
  259    HA   HIS  37           HA       HIS  37  14.566  -9.751   5.484
  260   1HB   HIS  37          HB2       HIS  37  14.544 -11.971   6.683
  261   2HB   HIS  37          HB3       HIS  37  13.997 -10.579   7.596
  262    HD1  HIS  37           HD1      HIS  37  11.596 -10.684   8.610
  263    HD2  HIS  37           HD2      HIS  37  12.502 -13.738   5.845
  264    HE1  HIS  37           HE1      HIS  37   9.637 -12.331   8.676
  265    H    GLY  38           H        GLY  38  13.186  -9.571   3.144
  266   1HA   GLY  38          HA2       GLY  38  12.757 -10.430   1.083
  267   2HA   GLY  38          HA3       GLY  38  14.232 -11.364   1.357
  268    HA   PRO  39           HA       PRO  39  11.166 -14.557   2.929
  269   1HB   PRO  39          HB2       PRO  39   8.455 -14.160   3.144
  270   2HB   PRO  39          HB3       PRO  39   9.631 -13.706   4.415
  271   1HG   PRO  39          HG2       PRO  39   8.446 -11.931   2.256
  272   2HG   PRO  39          HG3       PRO  39   8.566 -11.604   4.016
  273   1HD   PRO  39          HD2       PRO  39  10.400 -10.628   2.262
  274   2HD   PRO  39          HD3       PRO  39  10.886 -11.228   3.884
  275    H    LEU  40           H        LEU  40  10.043 -12.595   0.206
  276    HA   LEU  40           HA       LEU  40   9.455 -15.032  -1.370
  277   1HB   LEU  40          HB2       LEU  40   8.252 -12.221  -1.291
  278   2HB   LEU  40          HB3       LEU  40   7.990 -13.327  -2.606
  279    HG   LEU  40           HG       LEU  40   7.159 -13.846   0.276
  280   1HD1  LEU  40          HD11      LEU  40   5.874 -12.032  -0.787
  281   2HD1  LEU  40          HD12      LEU  40   5.492 -13.090  -2.162
  282   3HD1  LEU  40          HD13      LEU  40   4.869 -13.467  -0.539
  283   1HD2  LEU  40          HD21      LEU  40   6.599 -15.444  -2.266
  284   2HD2  LEU  40          HD22      LEU  40   7.546 -15.982  -0.860
  285   3HD2  LEU  40          HD23      LEU  40   5.813 -15.714  -0.694
  286    H    LEU  41           H        LEU  41  11.924 -13.119  -0.792
  287    HA   LEU  41           HA       LEU  41  13.556 -11.981  -1.746
  288   1HB   LEU  41          HB2       LEU  41  13.582 -14.243  -3.014
  289   2HB   LEU  41          HB3       LEU  41  12.932 -13.327  -4.369
  290    HG   LEU  41           HG       LEU  41  15.007 -11.787  -4.143
  291   1HD1  LEU  41          HD11      LEU  41  16.976 -12.805  -3.043
  292   2HD1  LEU  41          HD12      LEU  41  15.716 -12.429  -1.865
  293   3HD1  LEU  41          HD13      LEU  41  15.944 -14.105  -2.405
  294   1HD2  LEU  41          HD21      LEU  41  15.349 -14.713  -4.865
  295   2HD2  LEU  41          HD22      LEU  41  14.790 -13.412  -5.934
  296   3HD2  LEU  41          HD23      LEU  41  16.457 -13.405  -5.335
  297    H    GLU  42           H        GLU  42  10.418 -11.402  -3.093
  298    HA   GLU  42           HA       GLU  42  11.208  -8.769  -4.132
  299   1HB   GLU  42          HB2       GLU  42  10.255  -9.336  -6.407
  300   2HB   GLU  42          HB3       GLU  42  11.828 -10.000  -6.027
  301   1HG   GLU  42          HG2       GLU  42  10.875 -12.213  -5.602
  302   2HG   GLU  42          HG3       GLU  42   9.260 -11.619  -5.997
  303    H    ASP  43           H        ASP  43   9.782  -8.261  -2.274
  304    HA   ASP  43           HA       ASP  43   6.931  -8.851  -2.517
  305   1HB   ASP  43          HB2       ASP  43   7.797  -8.208  -0.355
  306   2HB   ASP  43          HB3       ASP  43   8.396  -6.670  -1.012
  307    H    LEU  44           H        LEU  44   9.099  -6.063  -3.398
  308    HA   LEU  44           HA       LEU  44   6.919  -5.011  -5.119
  309   1HB   LEU  44          HB2       LEU  44   9.737  -3.977  -4.707
  310   2HB   LEU  44          HB3       LEU  44   8.574  -3.229  -5.729
  311    HG   LEU  44           HG       LEU  44   8.285  -3.502  -2.717
  312   1HD1  LEU  44          HD11      LEU  44   9.938  -1.799  -3.613
  313   2HD1  LEU  44          HD12      LEU  44   8.598  -1.016  -4.460
  314   3HD1  LEU  44          HD13      LEU  44   8.594  -1.101  -2.686
  315   1HD2  LEU  44          HD21      LEU  44   6.048  -3.613  -3.666
  316   2HD2  LEU  44          HD22      LEU  44   6.296  -1.999  -3.009
  317   3HD2  LEU  44          HD23      LEU  44   6.395  -2.252  -4.761
  318    HA   PRO  45           HA       PRO  45   8.240  -7.263  -8.626
  319   1HB   PRO  45          HB2       PRO  45   7.733  -5.487 -10.727
  320   2HB   PRO  45          HB3       PRO  45   6.528  -6.417  -9.835
  321   1HG   PRO  45          HG2       PRO  45   7.425  -3.546  -9.436
  322   2HG   PRO  45          HG3       PRO  45   5.754  -4.180  -9.432
  323   1HD   PRO  45          HD2       PRO  45   7.164  -3.654  -7.133
  324   2HD   PRO  45          HD3       PRO  45   5.972  -4.987  -7.242
  325    H    ALA  46           H        ALA  46   9.368  -6.860 -10.830
  326    HA   ALA  46           HA       ALA  46  12.147  -6.161 -10.359
  327   1HB   ALA  46          HB1       ALA  46  12.443  -6.980 -12.692
  328   2HB   ALA  46          HB2       ALA  46  11.496  -8.128 -11.734
  329   3HB   ALA  46          HB3       ALA  46  10.686  -7.048 -12.898
  330    H    SER  47           H        SER  47  10.472  -3.922  -9.986
  331    HA   SER  47           HA       SER  47  11.524  -1.937 -11.738
  332   1HB   SER  47          HB2       SER  47   9.134  -1.087 -12.307
  333   2HB   SER  47          HB3       SER  47   9.829  -2.384 -13.282
  334    HG   SER  47           HG       SER  47   7.676  -2.822 -12.705
  335    H    GLY  48           H        GLY  48  11.732  -0.105 -10.455
  336   1HA   GLY  48          HA2       GLY  48  10.409   1.324  -8.733
  337   2HA   GLY  48          HA3       GLY  48  10.403  -0.160  -7.779
  338    H    ILE  49           H        ILE  49  11.697   0.590  -6.112
  339    HA   ILE  49           HA       ILE  49  14.588   0.819  -6.766
  340    HB   ILE  49           HB       ILE  49  13.132   2.016  -4.397
  341   1HG1  ILE  49          HG12      ILE  49  12.393   3.323  -6.321
  342   2HG1  ILE  49          HG13      ILE  49  13.392   4.249  -5.225
  343   1HG2  ILE  49          HG21      ILE  49  15.442   1.541  -3.878
  344   2HG2  ILE  49          HG22      ILE  49  16.000   2.321  -5.368
  345   3HG2  ILE  49          HG23      ILE  49  15.274   3.287  -4.065
  346   1HD1  ILE  49          HD11      ILE  49  14.383   3.068  -7.846
  347   2HD1  ILE  49          HD12      ILE  49  13.878   4.746  -7.591
  348   3HD1  ILE  49          HD13      ILE  49  15.301   4.126  -6.743
  349    H    TRP  50           H        TRP  50  15.866  -0.555  -5.376
  350    HA   TRP  50           HA       TRP  50  14.409  -2.334  -3.474
  351   1HB   TRP  50          HB2       TRP  50  16.147  -3.002  -5.856
  352   2HB   TRP  50          HB3       TRP  50  16.288  -3.973  -4.429
  353    HD1  TRP  50           HD1      TRP  50  13.023  -2.828  -6.263
  354    HE1  TRP  50           HE1      TRP  50  11.794  -4.899  -7.109
  355    HE3  TRP  50           HE3      TRP  50  16.158  -6.404  -4.392
  356    HZ2  TRP  50           HZ2      TRP  50  12.286  -7.749  -7.217
  357    HZ3  TRP  50           HZ3      TRP  50  15.800  -8.792  -4.951
  358    HH2  TRP  50           HH2      TRP  50  13.925  -9.465  -6.416
  359    H    LEU  51           H        LEU  51  15.759  -3.031  -1.765
  360    HA   LEU  51           HA       LEU  51  18.580  -2.108  -1.747
  361   1HB   LEU  51          HB2       LEU  51  16.478  -1.682   0.415
  362   2HB   LEU  51          HB3       LEU  51  18.201  -1.729   0.781
  363    HG   LEU  51           HG       LEU  51  16.847   0.304  -1.049
  364   1HD1  LEU  51          HD11      LEU  51  17.400   1.889   0.743
  365   2HD1  LEU  51          HD12      LEU  51  16.323   0.614   1.334
  366   3HD1  LEU  51          HD13      LEU  51  18.046   0.570   1.743
  367   1HD2  LEU  51          HD21      LEU  51  19.157   1.444  -0.794
  368   2HD2  LEU  51          HD22      LEU  51  19.762  -0.143  -0.273
  369   3HD2  LEU  51          HD23      LEU  51  19.050   0.069  -1.888
  370    H    VAL  52           H        VAL  52  19.927  -3.651  -0.831
  371    HA   VAL  52           HA       VAL  52  18.609  -6.086   0.292
  372    HB   VAL  52           HB       VAL  52  21.167  -6.030  -1.362
  373   1HG1  VAL  52          HG11      VAL  52  20.837  -8.472  -1.468
  374   2HG1  VAL  52          HG12      VAL  52  20.926  -7.941   0.214
  375   3HG1  VAL  52          HG13      VAL  52  19.353  -8.334  -0.500
  376   1HG2  VAL  52          HG21      VAL  52  18.348  -6.763  -2.284
  377   2HG2  VAL  52          HG22      VAL  52  19.347  -5.426  -2.890
  378   3HG2  VAL  52          HG23      VAL  52  19.841  -7.090  -3.191
  379    H    ILE  53           H        ILE  53  19.411  -6.708   2.277
  380    HA   ILE  53           HA       ILE  53  21.641  -5.108   3.389
  381    HB   ILE  53           HB       ILE  53  19.085  -5.536   4.961
  382   1HG1  ILE  53          HG12      ILE  53  18.862  -2.938   4.542
  383   2HG1  ILE  53          HG13      ILE  53  19.718  -3.276   3.046
  384   1HG2  ILE  53          HG21      ILE  53  21.397  -3.583   5.277
  385   2HG2  ILE  53          HG22      ILE  53  20.023  -3.800   6.382
  386   3HG2  ILE  53          HG23      ILE  53  21.207  -5.096   6.178
  387   1HD1  ILE  53          HD11      ILE  53  17.844  -4.959   2.503
  388   2HD1  ILE  53          HD12      ILE  53  17.044  -4.407   3.980
  389   3HD1  ILE  53          HD13      ILE  53  17.331  -3.282   2.638
  390    H    SER  54           H        SER  54  23.086  -6.690   3.440
  391    HA   SER  54           HA       SER  54  22.606  -9.165   4.984
  392   1HB   SER  54          HB2       SER  54  23.760  -9.200   2.169
  393   2HB   SER  54          HB3       SER  54  23.280 -10.579   3.159
  394    HG   SER  54           HG       SER  54  21.125  -9.958   2.905
  395    H    SER  55           H        SER  55  25.093 -10.381   4.564
  396    HA   SER  55           HA       SER  55  27.193  -8.305   4.620
  397   1HB   SER  55          HB2       SER  55  26.925 -10.406   6.812
  398   2HB   SER  55          HB3       SER  55  28.160  -9.145   6.663
  399    HG   SER  55           HG       SER  55  26.527  -8.643   8.191
  400    H    THR  56           H        THR  56  28.860  -9.076   3.288
  401    HA   THR  56           HA       THR  56  29.035 -12.005   2.840
  402    HB   THR  56           HB       THR  56  29.647 -11.116   0.480
  403    HG1  THR  56           HG1      THR  56  28.951  -9.171   0.006
  404   1HG2  THR  56          HG21      THR  56  27.508 -12.266   1.059
  405   2HG2  THR  56          HG22      THR  56  26.807 -10.689   1.491
  406   3HG2  THR  56          HG23      THR  56  27.311 -11.013  -0.182
  407    H    HIS  57           H        HIS  57  30.916  -9.622   4.252
  408    HA   HIS  57           HA       HIS  57  33.508 -10.195   3.135
  409   1HB   HIS  57          HB2       HIS  57  33.143  -8.338   4.696
  410   2HB   HIS  57          HB3       HIS  57  32.586  -9.470   5.934
  411    HD1  HIS  57           HD1      HIS  57  35.920  -8.615   4.116
  412    HD2  HIS  57           HD2      HIS  57  34.340 -10.401   7.594
  413    HE1  HIS  57           HE1      HIS  57  37.896  -9.113   5.641
  414    H    GLY  58           H        GLY  58  34.823 -12.020   3.430
  415   1HA   GLY  58          HA2       GLY  58  35.364 -14.191   3.928
  416   2HA   GLY  58          HA3       GLY  58  34.536 -13.991   5.483
  417    H    ALA  59           H        ALA  59  32.998 -13.545   2.324
  418    HA   ALA  59           HA       ALA  59  31.241 -14.321   1.321
  419   1HB   ALA  59          HB1       ALA  59  30.848 -16.657   1.064
  420   2HB   ALA  59          HB2       ALA  59  32.601 -16.367   1.098
  421   3HB   ALA  59          HB3       ALA  59  31.781 -17.039   2.527
  422    H    GLY  60           H        GLY  60  31.223 -13.730   4.496
  423   1HA   GLY  60          HA2       GLY  60  29.166 -12.755   5.384
  424   2HA   GLY  60          HA3       GLY  60  28.275 -14.088   4.688
  425    H    ASP  61           H        ASP  61  27.470 -14.201   6.950
  426    HA   ASP  61           HA       ASP  61  29.057 -14.911   9.172
  427   1HB   ASP  61          HB2       ASP  61  26.730 -14.103   9.291
  428   2HB   ASP  61          HB3       ASP  61  26.162 -15.609   8.563
  429    H    ILE  62           H        ILE  62  28.051 -16.865   6.474
  430    HA   ILE  62           HA       ILE  62  29.506 -19.174   7.501
  431    HB   ILE  62           HB       ILE  62  27.768 -20.751   6.673
  432   1HG1  ILE  62          HG12      ILE  62  25.909 -18.342   6.519
  433   2HG1  ILE  62          HG13      ILE  62  26.598 -19.195   5.131
  434   1HG2  ILE  62          HG21      ILE  62  26.375 -20.714   8.626
  435   2HG2  ILE  62          HG22      ILE  62  27.975 -20.137   9.093
  436   3HG2  ILE  62          HG23      ILE  62  26.646 -18.977   8.869
  437   1HD1  ILE  62          HD11      ILE  62  24.632 -20.339   7.141
  438   2HD1  ILE  62          HD12      ILE  62  24.347 -19.948   5.438
  439   3HD1  ILE  62          HD13      ILE  62  25.439 -21.282   5.861
  440    HA   PRO  63           HA       PRO  63  31.350 -19.110   3.583
  441   1HB   PRO  63          HB2       PRO  63  30.472 -21.952   3.043
  442   2HB   PRO  63          HB3       PRO  63  32.095 -21.216   2.833
  443   1HG   PRO  63          HG2       PRO  63  31.574 -22.700   5.027
  444   2HG   PRO  63          HG3       PRO  63  32.441 -21.137   5.204
  445   1HD   PRO  63          HD2       PRO  63  29.516 -21.734   5.676
  446   2HD   PRO  63          HD3       PRO  63  30.651 -20.776   6.674
  447    H    ASP  64           H        ASP  64  27.954 -19.897   3.459
  448    HA   ASP  64           HA       ASP  64  27.754 -18.609   0.825
  449   1HB   ASP  64          HB2       ASP  64  27.801 -20.975   0.215
  450   2HB   ASP  64          HB3       ASP  64  26.536 -21.336   1.396
  451    H    ASN  65           H        ASN  65  27.349 -17.129   2.732
  452    HA   ASN  65           HA       ASN  65  25.242 -17.429   4.527
  453   1HB   ASN  65          HB2       ASN  65  27.162 -15.892   4.651
  454   2HB   ASN  65          HB3       ASN  65  26.396 -14.873   3.423
  455   1HD2  ASN  65          HD22      ASN  65  26.285 -13.009   4.879
  456   2HD2  ASN  65          HD21      ASN  65  25.255 -13.049   6.281
  457    H    LEU  66           H        LEU  66  25.094 -16.128   1.266
  458    HA   LEU  66           HA       LEU  66  22.265 -15.267   1.521
  459   1HB   LEU  66          HB2       LEU  66  24.372 -15.221  -0.691
  460   2HB   LEU  66          HB3       LEU  66  22.696 -14.847  -1.014
  461    HG   LEU  66           HG       LEU  66  24.189 -12.885  -0.791
  462   1HD1  LEU  66          HD11      LEU  66  21.792 -12.646  -0.627
  463   2HD1  LEU  66          HD12      LEU  66  21.831 -13.013   1.116
  464   3HD1  LEU  66          HD13      LEU  66  22.577 -11.528   0.488
  465   1HD2  LEU  66          HD21      LEU  66  24.140 -13.389   2.205
  466   2HD2  LEU  66          HD22      LEU  66  25.558 -13.591   1.152
  467   3HD2  LEU  66          HD23      LEU  66  24.817 -11.994   1.360
  468    H    SER  67           H        SER  67  21.969 -17.788   2.292
  469    HA   SER  67           HA       SER  67  22.793 -19.804   0.441
  470   1HB   SER  67          HB2       SER  67  21.035 -21.026   2.157
  471   2HB   SER  67          HB3       SER  67  22.768 -20.803   2.426
  472    HG   SER  67           HG       SER  67  21.541 -20.126   4.196
  473    HA   PRO  68           HA       PRO  68  18.247 -20.034  -0.923
  474   1HB   PRO  68          HB2       PRO  68  16.376 -18.255   0.001
  475   2HB   PRO  68          HB3       PRO  68  16.843 -19.723   0.904
  476   1HG   PRO  68          HG2       PRO  68  17.774 -16.892   1.400
  477   2HG   PRO  68          HG3       PRO  68  17.347 -18.154   2.590
  478   1HD   PRO  68          HD2       PRO  68  19.878 -17.599   1.929
  479   2HD   PRO  68          HD3       PRO  68  19.313 -19.188   2.495
  480    H    PHE  69           H        PHE  69  19.269 -16.694  -0.179
  481    HA   PHE  69           HA       PHE  69  17.915 -15.459  -2.319
  482   1HB   PHE  69          HB2       PHE  69  20.325 -14.644  -0.659
  483   2HB   PHE  69          HB3       PHE  69  19.585 -13.603  -1.853
  484    HD1  PHE  69           HD1      PHE  69  19.713 -12.167   0.355
  485    HD2  PHE  69           HD2      PHE  69  16.851 -15.339  -0.313
  486    HE1  PHE  69           HE1      PHE  69  18.245 -11.221   2.095
  487    HE2  PHE  69           HE2      PHE  69  15.390 -14.359   1.399
  488    HZ   PHE  69           HZ       PHE  69  16.091 -12.321   2.643
  489    H    TYR  70           H        TYR  70  21.415 -16.470  -2.157
  490    HA   TYR  70           HA       TYR  70  21.957 -15.373  -4.711
  491   1HB   TYR  70          HB2       TYR  70  23.680 -15.840  -2.995
  492   2HB   TYR  70          HB3       TYR  70  23.437 -17.556  -3.255
  493    HD1  TYR  70           HD1      TYR  70  25.495 -18.309  -4.117
  494    HD2  TYR  70           HD2      TYR  70  23.717 -14.755  -5.807
  495    HE1  TYR  70           HE1      TYR  70  27.267 -18.238  -5.846
  496    HE2  TYR  70           HE2      TYR  70  25.479 -14.671  -7.521
  497    HH   TYR  70           HH       TYR  70  27.373 -15.707  -8.398
  498    H    GLU  71           H        GLU  71  21.109 -18.771  -3.731
  499    HA   GLU  71           HA       GLU  71  21.269 -19.796  -6.370
  500   1HB   GLU  71          HB2       GLU  71  19.499 -20.710  -4.060
  501   2HB   GLU  71          HB3       GLU  71  19.836 -21.616  -5.547
  502   1HG   GLU  71          HG2       GLU  71  22.336 -21.276  -4.903
  503   2HG   GLU  71          HG3       GLU  71  21.754 -20.889  -3.307
  504    H    ALA  72           H        ALA  72  18.443 -18.390  -4.581
  505    HA   ALA  72           HA       ALA  72  16.600 -18.748  -6.711
  506   1HB   ALA  72          HB1       ALA  72  15.251 -17.033  -5.545
  507   2HB   ALA  72          HB2       ALA  72  15.895 -18.245  -4.416
  508   3HB   ALA  72          HB3       ALA  72  16.649 -16.636  -4.517
  509    H    LEU  73           H        LEU  73  18.991 -16.110  -6.196
  510    HA   LEU  73           HA       LEU  73  17.974 -14.356  -8.198
  511   1HB   LEU  73          HB2       LEU  73  20.738 -14.890  -7.028
  512   2HB   LEU  73          HB3       LEU  73  20.543 -13.785  -8.347
  513    HG   LEU  73           HG       LEU  73  19.209 -13.540  -5.613
  514   1HD1  LEU  73          HD11      LEU  73  21.611 -13.191  -5.502
  515   2HD1  LEU  73          HD12      LEU  73  21.551 -12.033  -6.844
  516   3HD1  LEU  73          HD13      LEU  73  20.776 -11.650  -5.288
  517   1HD2  LEU  73          HD21      LEU  73  19.192 -11.625  -7.980
  518   2HD2  LEU  73          HD22      LEU  73  17.784 -12.443  -7.271
  519   3HD2  LEU  73          HD23      LEU  73  18.638 -11.227  -6.334
  520    H    GLN  74           H        GLN  74  20.616 -16.798  -8.436
  521    HA   GLN  74           HA       GLN  74  20.746 -16.386 -11.271
  522   1HB   GLN  74          HB2       GLN  74  21.996 -18.836  -9.989
  523   2HB   GLN  74          HB3       GLN  74  22.478 -17.908 -11.393
  524   1HG   GLN  74          HG2       GLN  74  22.971 -15.981  -9.839
  525   2HG   GLN  74          HG3       GLN  74  22.589 -17.053  -8.487
  526   1HE2  GLN  74          HE22      GLN  74  24.752 -16.567 -11.237
  527   2HE2  GLN  74          HE21      GLN  74  26.026 -17.634 -10.660
  528    H    GLU  75           H        GLU  75  18.679 -18.354  -9.408
  529    HA   GLU  75           HA       GLU  75  18.132 -20.373 -11.323
  530   1HB   GLU  75          HB2       GLU  75  17.535 -20.525  -8.942
  531   2HB   GLU  75          HB3       GLU  75  16.345 -19.240  -9.160
  532   1HG   GLU  75          HG2       GLU  75  15.023 -20.674 -10.649
  533   2HG   GLU  75          HG3       GLU  75  16.276 -21.918 -10.605
  534    H    GLN  76           H        GLN  76  16.845 -17.094 -10.898
  535    HA   GLN  76           HA       GLN  76  15.187 -17.494 -13.355
  536   1HB   GLN  76          HB2       GLN  76  13.603 -15.823 -12.325
  537   2HB   GLN  76          HB3       GLN  76  13.601 -17.454 -11.669
  538   1HG   GLN  76          HG2       GLN  76  14.565 -16.835  -9.661
  539   2HG   GLN  76          HG3       GLN  76  15.316 -15.379 -10.314
  540   1HE2  GLN  76          HE22      GLN  76  14.381 -14.482  -8.233
  541   2HE2  GLN  76          HE21      GLN  76  12.783 -13.747  -8.379
  542    H    LYS  77           H        LYS  77  17.533 -15.379 -11.867
  543    HA   LYS  77           HA       LYS  77  18.223 -13.240 -12.386
  544   1HB   LYS  77          HB2       LYS  77  18.466 -14.723 -14.999
  545   2HB   LYS  77          HB3       LYS  77  19.295 -13.204 -14.631
  546   1HG   LYS  77          HG2       LYS  77  20.441 -14.239 -12.759
  547   2HG   LYS  77          HG3       LYS  77  19.597 -15.768 -13.018
  548   1HD   LYS  77          HD2       LYS  77  21.442 -14.518 -15.079
  549   2HD   LYS  77          HD3       LYS  77  21.963 -15.698 -13.863
  550   1HE   LYS  77          HE2       LYS  77  20.292 -17.296 -14.732
  551   2HE   LYS  77          HE3       LYS  77  19.808 -16.143 -15.980
  552   1HZ   LYS  77          HZ1       LYS  77  21.387 -17.759 -16.830
  553   2HZ   LYS  77          HZ2       LYS  77  22.059 -16.278 -16.880
  554   3HZ   LYS  77          HZ3       LYS  77  22.508 -17.346 -15.723
  555    HA   PRO  78           HA       PRO  78  14.081 -12.119 -14.180
  556   1HB   PRO  78          HB2       PRO  78  13.336 -10.181 -12.301
  557   2HB   PRO  78          HB3       PRO  78  12.946 -11.913 -12.262
  558   1HG   PRO  78          HG2       PRO  78  15.147 -10.431 -10.838
  559   2HG   PRO  78          HG3       PRO  78  14.130 -11.759 -10.211
  560   1HD   PRO  78          HD2       PRO  78  16.696 -12.135 -11.103
  561   2HD   PRO  78          HD3       PRO  78  15.427 -13.379 -11.300
  562    H    ASP  79           H        ASP  79  13.134 -10.100 -14.927
  563    HA   ASP  79           HA       ASP  79  15.205  -8.634 -16.355
  564   1HB   ASP  79          HB2       ASP  79  13.268  -9.538 -17.534
  565   2HB   ASP  79          HB3       ASP  79  12.177  -8.543 -16.562
  566    H    LEU  80           H        LEU  80  15.912  -7.770 -14.220
  567    HA   LEU  80           HA       LEU  80  14.475  -5.671 -12.883
  568   1HB   LEU  80          HB2       LEU  80  17.379  -6.518 -12.940
  569   2HB   LEU  80          HB3       LEU  80  16.840  -5.227 -11.954
  570    HG   LEU  80           HG       LEU  80  16.494  -6.459 -10.260
  571   1HD1  LEU  80          HD11      LEU  80  14.176  -6.638 -10.867
  572   2HD1  LEU  80          HD12      LEU  80  14.493  -8.122 -11.805
  573   3HD1  LEU  80          HD13      LEU  80  14.713  -8.092 -10.038
  574   1HD2  LEU  80          HD21      LEU  80  18.237  -7.911 -11.115
  575   2HD2  LEU  80          HD22      LEU  80  17.054  -8.808 -10.156
  576   3HD2  LEU  80          HD23      LEU  80  17.012  -8.924 -11.924
  577    H    SER  81           H        SER  81  14.930  -5.179 -15.872
  578    HA   SER  81           HA       SER  81  17.019  -3.233 -16.195
  579   1HB   SER  81          HB2       SER  81  15.992  -3.032 -18.487
  580   2HB   SER  81          HB3       SER  81  16.476  -4.672 -18.032
  581    HG   SER  81           HG       SER  81  14.514  -5.317 -18.133
  582    H    ALA  82           H        ALA  82  14.165  -3.027 -14.621
  583    HA   ALA  82           HA       ALA  82  13.705  -0.144 -15.242
  584   1HB   ALA  82          HB1       ALA  82  11.900  -1.525 -16.179
  585   2HB   ALA  82          HB2       ALA  82  11.657  -2.305 -14.600
  586   3HB   ALA  82          HB3       ALA  82  11.302  -0.573 -14.808
  587    H    VAL  83           H        VAL  83  15.168  -2.014 -13.020
  588    HA   VAL  83           HA       VAL  83  14.280  -0.176 -10.854
  589    HB   VAL  83           HB       VAL  83  13.199  -2.143 -10.289
  590   1HG1  VAL  83          HG11      VAL  83  15.744  -3.695 -10.810
  591   2HG1  VAL  83          HG12      VAL  83  14.259  -4.382 -10.108
  592   3HG1  VAL  83          HG13      VAL  83  14.244  -3.768 -11.760
  593   1HG2  VAL  83          HG21      VAL  83  14.387  -1.250  -8.314
  594   2HG2  VAL  83          HG22      VAL  83  14.169  -2.998  -8.270
  595   3HG2  VAL  83          HG23      VAL  83  15.747  -2.332  -8.659
  596    H    ARG  84           H        ARG  84  15.795   0.252  -9.190
  597    HA   ARG  84           HA       ARG  84  18.635  -0.264  -9.870
  598   1HB   ARG  84          HB2       ARG  84  19.198   1.919  -8.830
  599   2HB   ARG  84          HB3       ARG  84  18.364   2.058 -10.380
  600   1HG   ARG  84          HG2       ARG  84  16.294   2.660  -9.321
  601   2HG   ARG  84          HG3       ARG  84  16.913   2.314  -7.700
  602   1HD   ARG  84          HD2       ARG  84  18.310   4.350  -9.448
  603   2HD   ARG  84          HD3       ARG  84  16.797   4.772  -8.636
  604    HE   ARG  84           HE       ARG  84  18.566   3.636  -6.698
  605   1HH1  ARG  84          HH11      ARG  84  18.497   6.441  -8.839
  606   2HH1  ARG  84          HH12      ARG  84  19.108   7.552  -7.673
  607   1HH2  ARG  84          HH21      ARG  84  19.257   5.149  -5.053
  608   2HH2  ARG  84          HH22      ARG  84  19.436   6.821  -5.420
  609    H    PHE  85           H        PHE  85  19.969  -0.433  -8.030
  610    HA   PHE  85           HA       PHE  85  18.528  -1.531  -5.643
  611   1HB   PHE  85          HB2       PHE  85  20.690  -2.599  -7.469
  612   2HB   PHE  85          HB3       PHE  85  20.761  -2.996  -5.775
  613    HD1  PHE  85           HD1      PHE  85  19.992  -5.099  -5.251
  614    HD2  PHE  85           HD2      PHE  85  17.985  -2.882  -8.357
  615    HE1  PHE  85           HE1      PHE  85  18.453  -7.002  -5.635
  616    HE2  PHE  85           HE2      PHE  85  16.439  -4.773  -8.709
  617    HZ   PHE  85           HZ       PHE  85  16.702  -6.858  -7.395
  618    H    GLY  86           H        GLY  86  19.938  -1.659  -3.770
  619   1HA   GLY  86          HA2       GLY  86  22.475  -0.183  -3.746
  620   2HA   GLY  86          HA3       GLY  86  21.231   0.334  -2.585
  621    H    ALA  87           H        ALA  87  23.848  -1.128  -2.148
  622    HA   ALA  87           HA       ALA  87  22.869  -3.699  -0.973
  623   1HB   ALA  87          HB1       ALA  87  25.173  -4.526  -1.411
  624   2HB   ALA  87          HB2       ALA  87  24.369  -4.055  -2.915
  625   3HB   ALA  87          HB3       ALA  87  25.591  -2.995  -2.183
  626    H    ILE  88           H        ILE  88  23.027  -3.664   1.233
  627    HA   ILE  88           HA       ILE  88  24.724  -1.559   2.493
  628    HB   ILE  88           HB       ILE  88  21.902  -2.444   3.225
  629   1HG1  ILE  88          HG12      ILE  88  22.837   0.083   1.814
  630   2HG1  ILE  88          HG13      ILE  88  21.787  -1.169   1.168
  631   1HG2  ILE  88          HG21      ILE  88  21.975  -0.588   4.861
  632   2HG2  ILE  88          HG22      ILE  88  23.210  -1.777   5.182
  633   3HG2  ILE  88          HG23      ILE  88  23.647  -0.236   4.410
  634   1HD1  ILE  88          HD11      ILE  88  20.039  -0.578   2.817
  635   2HD1  ILE  88          HD12      ILE  88  21.059   0.766   3.396
  636   3HD1  ILE  88          HD13      ILE  88  20.476   0.767   1.741
  637    H    GLY  89           H        GLY  89  26.025  -2.275   4.072
  638   1HA   GLY  89          HA2       GLY  89  26.806  -3.533   5.880
  639   2HA   GLY  89          HA3       GLY  89  25.408  -4.614   5.747
  640    H    ILE  90           H        ILE  90  25.750  -5.044   2.927
  641    HA   ILE  90           HA       ILE  90  27.294  -7.261   2.574
  642    HB   ILE  90           HB       ILE  90  26.211  -5.096   0.756
  643   1HG1  ILE  90          HG12      ILE  90  25.462  -7.993   1.216
  644   2HG1  ILE  90          HG13      ILE  90  24.699  -6.643   2.036
  645   1HG2  ILE  90          HG21      ILE  90  27.391  -7.681  -0.297
  646   2HG2  ILE  90          HG22      ILE  90  26.629  -6.398  -1.236
  647   3HG2  ILE  90          HG23      ILE  90  28.166  -6.077  -0.460
  648   1HD1  ILE  90          HD11      ILE  90  24.528  -7.171  -0.949
  649   2HD1  ILE  90          HD12      ILE  90  23.280  -7.460   0.267
  650   3HD1  ILE  90          HD13      ILE  90  23.789  -5.803  -0.070
  651    H    GLY  91           H        GLY  91  29.345  -7.723   1.925
  652   1HA   GLY  91          HA2       GLY  91  31.403  -5.589   2.289
  653   2HA   GLY  91          HA3       GLY  91  31.597  -7.300   2.683
  654    H    SER  92           H        SER  92  29.833  -7.308  -0.098
  655    HA   SER  92           HA       SER  92  31.655  -8.617  -1.643
  656   1HB   SER  92          HB2       SER  92  29.121  -7.183  -2.403
  657   2HB   SER  92          HB3       SER  92  29.944  -8.408  -3.399
  658    HG   SER  92           HG       SER  92  28.468  -9.497  -2.231
  659    H    ARG  93           H        ARG  93  32.140  -5.384  -1.111
  660    HA   ARG  93           HA       ARG  93  33.967  -5.274  -3.296
  661   1HB   ARG  93          HB2       ARG  93  31.765  -3.166  -3.065
  662   2HB   ARG  93          HB3       ARG  93  33.320  -2.798  -3.786
  663   1HG   ARG  93          HG2       ARG  93  31.392  -4.886  -4.881
  664   2HG   ARG  93          HG3       ARG  93  31.553  -3.232  -5.434
  665   1HD   ARG  93          HD2       ARG  93  32.778  -4.555  -6.976
  666   2HD   ARG  93          HD3       ARG  93  33.959  -3.661  -6.007
  667    HE   ARG  93           HE       ARG  93  33.335  -6.313  -4.970
  668   1HH1  ARG  93          HH11      ARG  93  35.328  -4.690  -7.422
  669   2HH1  ARG  93          HH12      ARG  93  36.601  -5.851  -7.363
  670   1HH2  ARG  93          HH21      ARG  93  35.082  -7.776  -4.760
  671   2HH2  ARG  93          HH22      ARG  93  36.426  -7.683  -5.851
  672    H    GLU  94           H        GLU  94  35.676  -4.108  -2.784
  673    HA   GLU  94           HA       GLU  94  37.226  -2.918  -1.691
  674   1HB   GLU  94          HB2       GLU  94  35.062  -1.911   0.138
  675   2HB   GLU  94          HB3       GLU  94  36.672  -1.233  -0.034
  676   1HG   GLU  94          HG2       GLU  94  34.493  -1.207  -2.170
  677   2HG   GLU  94          HG3       GLU  94  35.025   0.151  -1.197
  678    H    TYR  95           H        TYR  95  35.098  -4.944   0.068
  679    HA   TYR  95           HA       TYR  95  37.160  -5.515   2.146
  680   1HB   TYR  95          HB2       TYR  95  35.164  -4.056   2.733
  681   2HB   TYR  95          HB3       TYR  95  34.137  -5.440   2.423
  682    HD1  TYR  95           HD1      TYR  95  37.435  -5.567   4.292
  683    HD2  TYR  95           HD2      TYR  95  33.123  -5.481   4.566
  684    HE1  TYR  95           HE1      TYR  95  37.580  -6.024   6.710
  685    HE2  TYR  95           HE2      TYR  95  33.272  -5.915   6.987
  686    HH   TYR  95           HH       TYR  95  34.660  -6.214   8.819
  687    H    ASP  96           H        ASP  96  35.657  -6.940  -0.476
  688    HA   ASP  96           HA       ASP  96  35.414  -9.585   0.735
  689   1HB   ASP  96          HB2       ASP  96  34.403 -10.252  -1.390
  690   2HB   ASP  96          HB3       ASP  96  33.604  -8.825  -0.782
  691    H    THR  97           H        THR  97  37.845  -7.933  -0.203
  692    HA   THR  97           HA       THR  97  39.257  -9.864  -1.840
  693    HB   THR  97           HB       THR  97  41.218  -8.175  -1.382
  694    HG1  THR  97           HG1      THR  97  40.498  -7.095   0.395
  695   1HG2  THR  97          HG21      THR  97  39.864  -8.148  -3.461
  696   2HG2  THR  97          HG22      THR  97  38.644  -7.132  -2.663
  697   3HG2  THR  97          HG23      THR  97  40.288  -6.512  -2.934
  698    H    PHE  98           H        PHE  98  38.442  -9.918   1.139
  699    HA   PHE  98           HA       PHE  98  40.734 -11.253   2.431
  700   1HB   PHE  98          HB2       PHE  98  39.116  -9.871   3.709
  701   2HB   PHE  98          HB3       PHE  98  37.806 -10.945   3.234
  702    HD1  PHE  98           HD1      PHE  98  41.084 -10.875   5.082
  703    HD2  PHE  98           HD2      PHE  98  37.264 -12.819   4.594
  704    HE1  PHE  98           HE1      PHE  98  41.526 -12.257   7.096
  705    HE2  PHE  98           HE2      PHE  98  37.708 -14.198   6.608
  706    HZ   PHE  98           HZ       PHE  98  39.840 -13.922   7.863
  707    H    CYS  99           H        CYS  99  38.084 -12.046   0.318
  708    HA   CYS  99           HA       CYS  99  38.464 -14.966   0.676
  709   1HB   CYS  99          HB2       CYS  99  35.845 -14.934   0.275
  710   2HB   CYS  99          HB3       CYS  99  36.532 -14.739   1.882
  711    HG   CYS  99           HG       CYS  99  35.809 -12.221  -0.141
  712    H    GLY 100           H        GLY 100  39.649 -13.166  -1.244
  713   1HA   GLY 100          HA2       GLY 100  40.189 -13.261  -3.480
  714   2HA   GLY 100          HA3       GLY 100  38.913 -14.461  -3.746
  715    H    ALA 101           H        ALA 101  36.665 -13.684  -3.773
  716    HA   ALA 101           HA       ALA 101  36.023 -10.927  -3.697
  717   1HB   ALA 101          HB1       ALA 101  36.892 -10.903  -6.030
  718   2HB   ALA 101          HB2       ALA 101  35.839 -12.277  -6.444
  719   3HB   ALA 101          HB3       ALA 101  35.133 -10.703  -6.019
  720    H    ILE 102           H        ILE 102  33.807 -10.698  -3.487
  721    HA   ILE 102           HA       ILE 102  32.017 -13.050  -3.820
  722    HB   ILE 102           HB       ILE 102  31.929 -11.129  -1.462
  723   1HG1  ILE 102          HG12      ILE 102  33.889 -12.668  -1.275
  724   2HG1  ILE 102          HG13      ILE 102  32.700 -12.868  -0.020
  725   1HG2  ILE 102          HG21      ILE 102  30.348 -12.936  -0.531
  726   2HG2  ILE 102          HG22      ILE 102  29.708 -11.901  -1.807
  727   3HG2  ILE 102          HG23      ILE 102  30.237 -13.551  -2.191
  728   1HD1  ILE 102          HD11      ILE 102  31.874 -14.940  -1.010
  729   2HD1  ILE 102          HD12      ILE 102  32.912 -14.724  -2.429
  730   3HD1  ILE 102          HD13      ILE 102  33.633 -15.018  -0.839
  731    H    ASP 103           H        ASP 103  32.853 -10.010  -4.821
  732    HA   ASP 103           HA       ASP 103  30.709  -8.473  -5.418
  733   1HB   ASP 103          HB2       ASP 103  32.982  -8.115  -6.210
  734   2HB   ASP 103          HB3       ASP 103  32.863  -9.491  -7.292
  735    H    LYS 104           H        LYS 104  31.204 -11.722  -6.660
  736    HA   LYS 104           HA       LYS 104  29.591 -11.908  -8.880
  737   1HB   LYS 104          HB2       LYS 104  29.800 -13.919  -6.612
  738   2HB   LYS 104          HB3       LYS 104  29.215 -14.252  -8.245
  739   1HG   LYS 104          HG2       LYS 104  31.429 -13.623  -9.134
  740   2HG   LYS 104          HG3       LYS 104  32.031 -13.356  -7.487
  741   1HD   LYS 104          HD2       LYS 104  31.538 -15.730  -6.929
  742   2HD   LYS 104          HD3       LYS 104  30.974 -15.997  -8.595
  743   1HE   LYS 104          HE2       LYS 104  33.223 -15.347  -9.446
  744   2HE   LYS 104          HE3       LYS 104  33.779 -15.094  -7.788
  745   1HZ   LYS 104          HZ1       LYS 104  33.396 -17.457  -7.372
  746   2HZ   LYS 104          HZ2       LYS 104  32.881 -17.688  -8.908
  747   3HZ   LYS 104          HZ3       LYS 104  34.425 -17.264  -8.619
  748    H    LEU 105           H        LEU 105  28.454 -11.651  -5.488
  749    HA   LEU 105           HA       LEU 105  25.770 -12.457  -5.975
  750   1HB   LEU 105          HB2       LEU 105  26.881 -12.258  -3.754
  751   2HB   LEU 105          HB3       LEU 105  26.888 -10.512  -3.897
  752    HG   LEU 105           HG       LEU 105  25.160 -11.418  -2.401
  753   1HD1  LEU 105          HD11      LEU 105  23.736 -10.073  -4.719
  754   2HD1  LEU 105          HD12      LEU 105  23.332 -10.035  -3.002
  755   3HD1  LEU 105          HD13      LEU 105  24.794  -9.218  -3.575
  756   1HD2  LEU 105          HD21      LEU 105  23.816 -12.535  -4.891
  757   2HD2  LEU 105          HD22      LEU 105  24.651 -13.500  -3.648
  758   3HD2  LEU 105          HD23      LEU 105  23.188 -12.589  -3.232
  759    H    GLU 106           H        GLU 106  27.194  -9.137  -5.786
  760    HA   GLU 106           HA       GLU 106  24.806  -7.808  -6.703
  761   1HB   GLU 106          HB2       GLU 106  27.678  -6.960  -6.358
  762   2HB   GLU 106          HB3       GLU 106  26.476  -5.913  -7.107
  763   1HG   GLU 106          HG2       GLU 106  26.224  -7.156  -4.336
  764   2HG   GLU 106          HG3       GLU 106  26.668  -5.505  -4.714
  765    H    ALA 107           H        ALA 107  27.704  -9.183  -8.272
  766    HA   ALA 107           HA       ALA 107  27.434  -7.924 -10.770
  767   1HB   ALA 107          HB1       ALA 107  28.485 -10.739 -10.307
  768   2HB   ALA 107          HB2       ALA 107  28.865  -9.657 -11.651
  769   3HB   ALA 107          HB3       ALA 107  29.433  -9.255 -10.018
  770    H    GLU 108           H        GLU 108  25.948 -11.033  -9.569
  771    HA   GLU 108           HA       GLU 108  24.699 -11.686 -12.071
  772   1HB   GLU 108          HB2       GLU 108  24.180 -12.388  -9.178
  773   2HB   GLU 108          HB3       GLU 108  23.124 -12.941 -10.463
  774   1HG   GLU 108          HG2       GLU 108  26.089 -13.630 -10.215
  775   2HG   GLU 108          HG3       GLU 108  24.715 -14.640  -9.849
  776    H    LEU 109           H        LEU 109  23.659  -9.609  -9.343
  777    HA   LEU 109           HA       LEU 109  20.983  -9.217 -10.330
  778   1HB   LEU 109          HB2       LEU 109  22.827  -7.872  -8.333
  779   2HB   LEU 109          HB3       LEU 109  21.374  -7.015  -8.832
  780    HG   LEU 109           HG       LEU 109  21.311  -9.874  -7.792
  781   1HD1  LEU 109          HD11      LEU 109  20.978  -7.276  -6.243
  782   2HD1  LEU 109          HD12      LEU 109  20.617  -8.903  -5.615
  783   3HD1  LEU 109          HD13      LEU 109  22.274  -8.469  -6.053
  784   1HD2  LEU 109          HD21      LEU 109  19.289  -9.355  -8.984
  785   2HD2  LEU 109          HD22      LEU 109  18.892  -9.122  -7.280
  786   3HD2  LEU 109          HD23      LEU 109  19.222  -7.720  -8.309
  787    H    LYS 110           H        LYS 110  24.022  -7.349 -10.743
  788    HA   LYS 110           HA       LYS 110  22.835  -5.272 -12.291
  789   1HB   LYS 110          HB2       LYS 110  25.701  -6.284 -12.064
  790   2HB   LYS 110          HB3       LYS 110  25.238  -4.759 -12.835
  791   1HG   LYS 110          HG2       LYS 110  24.419  -3.842 -10.762
  792   2HG   LYS 110          HG3       LYS 110  24.458  -5.366  -9.945
  793   1HD   LYS 110          HD2       LYS 110  26.311  -4.317  -9.055
  794   2HD   LYS 110          HD3       LYS 110  27.000  -5.398 -10.263
  795   1HE   LYS 110          HE2       LYS 110  27.107  -3.472 -11.880
  796   2HE   LYS 110          HE3       LYS 110  26.452  -2.411 -10.634
  797   1HZ   LYS 110          HZ1       LYS 110  28.852  -2.258 -10.733
  798   2HZ   LYS 110          HZ2       LYS 110  28.426  -2.883  -9.288
  799   3HZ   LYS 110          HZ3       LYS 110  29.038  -3.852 -10.459
  800    H    ASN 111           H        ASN 111  24.289  -8.402 -13.119
  801    HA   ASN 111           HA       ASN 111  24.131  -8.171 -15.977
  802   1HB   ASN 111          HB2       ASN 111  25.491  -9.894 -15.460
  803   2HB   ASN 111          HB3       ASN 111  24.750 -10.205 -13.926
  804   1HD2  ASN 111          HD21      ASN 111  22.943 -11.554 -13.662
  805   2HD2  ASN 111          HD22      ASN 111  22.766 -12.872 -14.779
  806    H    SER 112           H        SER 112  21.821  -9.219 -13.458
  807    HA   SER 112           HA       SER 112  19.906 -10.308 -15.263
  808   1HB   SER 112          HB2       SER 112  19.524  -9.221 -12.474
  809   2HB   SER 112          HB3       SER 112  18.361 -10.207 -13.370
  810    HG   SER 112           HG       SER 112  20.955 -10.954 -12.497
  811    H    GLY 113           H        GLY 113  20.439  -6.979 -14.039
  812   1HA   GLY 113          HA2       GLY 113  19.722  -5.704 -16.291
  813   2HA   GLY 113          HA3       GLY 113  18.133  -5.946 -15.562
  814    H    ALA 114           H        ALA 114  19.471  -5.580 -12.750
  815    HA   ALA 114           HA       ALA 114  18.653  -2.840 -12.616
  816   1HB   ALA 114          HB1       ALA 114  19.890  -4.730 -10.562
  817   2HB   ALA 114          HB2       ALA 114  19.382  -3.074 -10.188
  818   3HB   ALA 114          HB3       ALA 114  18.182  -4.235 -10.703
  819    H    LYS 115           H        LYS 115  20.024  -1.195 -11.340
  820    HA   LYS 115           HA       LYS 115  22.923  -1.422 -11.946
  821   1HB   LYS 115          HB2       LYS 115  23.034   1.002 -12.201
  822   2HB   LYS 115          HB3       LYS 115  22.053   0.258 -13.462
  823   1HG   LYS 115          HG2       LYS 115  19.983   1.013 -12.360
  824   2HG   LYS 115          HG3       LYS 115  20.915   1.663 -11.002
  825   1HD   LYS 115          HD2       LYS 115  22.094   3.208 -12.586
  826   2HD   LYS 115          HD3       LYS 115  21.046   2.610 -13.892
  827   1HE   LYS 115          HE2       LYS 115  19.048   3.353 -12.579
  828   2HE   LYS 115          HE3       LYS 115  20.126   3.976 -11.317
  829   1HZ   LYS 115          HZ1       LYS 115  21.031   5.526 -12.951
  830   2HZ   LYS 115          HZ2       LYS 115  20.047   4.946 -14.120
  831   3HZ   LYS 115          HZ3       LYS 115  19.418   5.724 -12.837
  832    H    GLN 116           H        GLN 116  24.163  -1.155 -10.141
  833    HA   GLN 116           HA       GLN 116  22.825  -0.725  -7.546
  834   1HB   GLN 116          HB2       GLN 116  24.590  -2.443  -7.726
  835   2HB   GLN 116          HB3       GLN 116  25.735  -1.196  -8.238
  836   1HG   GLN 116          HG2       GLN 116  25.305   0.007  -6.050
  837   2HG   GLN 116          HG3       GLN 116  24.239  -1.315  -5.575
  838   1HE2  GLN 116          HE22      GLN 116  26.028  -0.888  -3.780
  839   2HE2  GLN 116          HE21      GLN 116  27.390  -1.983  -3.827
  840    H    THR 117           H        THR 117  22.219   1.433  -7.351
  841    HA   THR 117           HA       THR 117  23.820   3.553  -8.620
  842    HB   THR 117           HB       THR 117  21.420   3.638  -6.744
  843    HG1  THR 117           HG1      THR 117  21.230   2.851  -8.951
  844   1HG2  THR 117          HG21      THR 117  21.312   6.056  -7.473
  845   2HG2  THR 117          HG22      THR 117  22.697   5.705  -6.441
  846   3HG2  THR 117          HG23      THR 117  22.911   5.870  -8.201
  847    H    GLY 118           H        GLY 118  25.115   5.075  -7.454
  848   1HA   GLY 118          HA2       GLY 118  26.501   5.826  -5.781
  849   2HA   GLY 118          HA3       GLY 118  25.533   4.919  -4.612
  850    H    GLU 119           H        GLU 119  26.775   3.541  -3.563
  851    HA   GLU 119           HA       GLU 119  28.132   1.409  -4.897
  852   1HB   GLU 119          HB2       GLU 119  30.364   1.668  -4.112
  853   2HB   GLU 119          HB3       GLU 119  29.935   3.168  -4.922
  854   1HG   GLU 119          HG2       GLU 119  29.441   4.175  -2.661
  855   2HG   GLU 119          HG3       GLU 119  30.128   2.697  -1.955
  856    H    THR 120           H        THR 120  29.151  -0.076  -3.042
  857    HA   THR 120           HA       THR 120  27.024  -0.814  -1.427
  858    HB   THR 120           HB       THR 120  29.965  -1.528  -1.113
  859    HG1  THR 120           HG1      THR 120  29.511  -3.060  -2.691
  860   1HG2  THR 120          HG21      THR 120  27.406  -3.098  -0.530
  861   2HG2  THR 120          HG22      THR 120  29.070  -3.712  -0.386
  862   3HG2  THR 120          HG23      THR 120  28.507  -2.421   0.688
  863    H    LEU 121           H        LEU 121  26.374  -0.404   0.547
  864    HA   LEU 121           HA       LEU 121  27.463   1.935   1.974
  865   1HB   LEU 121          HB2       LEU 121  24.929   1.158   1.121
  866   2HB   LEU 121          HB3       LEU 121  24.919   0.577   2.779
  867    HG   LEU 121           HG       LEU 121  25.332   3.371   1.792
  868   1HD1  LEU 121          HD11      LEU 121  23.060   2.228   3.434
  869   2HD1  LEU 121          HD12      LEU 121  23.220   3.901   2.851
  870   3HD1  LEU 121          HD13      LEU 121  23.015   2.586   1.690
  871   1HD2  LEU 121          HD21      LEU 121  25.363   2.382   4.676
  872   2HD2  LEU 121          HD22      LEU 121  26.676   3.236   3.811
  873   3HD2  LEU 121          HD23      LEU 121  25.194   4.080   4.213
  874    H    LYS 122           H        LYS 122  27.829   1.762   4.320
  875    HA   LYS 122           HA       LYS 122  27.797  -0.983   5.469
  876   1HB   LYS 122          HB2       LYS 122  30.036   1.069   5.700
  877   2HB   LYS 122          HB3       LYS 122  29.797  -0.241   6.827
  878   1HG   LYS 122          HG2       LYS 122  31.487  -0.985   5.408
  879   2HG   LYS 122          HG3       LYS 122  30.052  -1.910   4.996
  880   1HD   LYS 122          HD2       LYS 122  31.428  -1.309   3.050
  881   2HD   LYS 122          HD3       LYS 122  29.796  -0.685   2.906
  882   1HE   LYS 122          HE2       LYS 122  30.595   1.567   3.637
  883   2HE   LYS 122          HE3       LYS 122  32.229   0.919   3.824
  884   1HZ   LYS 122          HZ1       LYS 122  30.734   1.071   1.258
  885   2HZ   LYS 122          HZ2       LYS 122  31.971   2.046   1.711
  886   3HZ   LYS 122          HZ3       LYS 122  32.250   0.466   1.438
  887    H    ILE 123           H        ILE 123  27.189  -0.987   7.647
  888    HA   ILE 123           HA       ILE 123  26.119   1.521   8.798
  889    HB   ILE 123           HB       ILE 123  24.032   0.039   9.284
  890   1HG1  ILE 123          HG12      ILE 123  23.416  -1.530   7.493
  891   2HG1  ILE 123          HG13      ILE 123  25.005  -1.454   6.790
  892   1HG2  ILE 123          HG21      ILE 123  24.070   2.036   7.820
  893   2HG2  ILE 123          HG22      ILE 123  24.516   1.012   6.440
  894   3HG2  ILE 123          HG23      ILE 123  22.948   0.797   7.242
  895   1HD1  ILE 123          HD11      ILE 123  24.488  -2.471   9.618
  896   2HD1  ILE 123          HD12      ILE 123  24.451  -3.504   8.176
  897   3HD1  ILE 123          HD13      ILE 123  25.952  -2.698   8.622
  898    H    ASN 124           H        ASN 124  25.622   1.330  11.088
  899    HA   ASN 124           HA       ASN 124  26.298  -1.050  12.549
  900   1HB   ASN 124          HB2       ASN 124  28.536   0.518  11.837
  901   2HB   ASN 124          HB3       ASN 124  28.209   1.034  13.473
  902   1HD2  ASN 124          HD21      ASN 124  28.167  -2.021  11.542
  903   2HD2  ASN 124          HD22      ASN 124  29.152  -2.966  12.670
  904    H    ILE 125           H        ILE 125  24.044   0.726  12.329
  905    HA   ILE 125           HA       ILE 125  24.037   2.696  14.387
  906    HB   ILE 125           HB       ILE 125  22.687   3.079  12.530
  907   1HG1  ILE 125          HG12      ILE 125  20.457   3.465  13.414
  908   2HG1  ILE 125          HG13      ILE 125  20.743   2.374  14.764
  909   1HG2  ILE 125          HG21      ILE 125  20.779   1.742  11.785
  910   2HG2  ILE 125          HG22      ILE 125  22.277   0.825  11.662
  911   3HG2  ILE 125          HG23      ILE 125  21.141   0.499  12.992
  912   1HD1  ILE 125          HD11      ILE 125  20.951   4.776  15.376
  913   2HD1  ILE 125          HD12      ILE 125  22.465   3.905  15.658
  914   3HD1  ILE 125          HD13      ILE 125  22.291   4.952  14.226
  915    H    LEU 126           H        LEU 126  24.510   2.022  16.351
  916    HA   LEU 126           HA       LEU 126  24.504   1.015  18.314
  917   1HB   LEU 126          HB2       LEU 126  22.417   2.404  18.305
  918   2HB   LEU 126          HB3       LEU 126  21.489   0.949  17.961
  919    HG   LEU 126           HG       LEU 126  22.063   0.017  20.168
  920   1HD1  LEU 126          HD11      LEU 126  24.344   0.824  20.512
  921   2HD1  LEU 126          HD12      LEU 126  23.779   2.512  20.537
  922   3HD1  LEU 126          HD13      LEU 126  23.326   1.384  21.834
  923   1HD2  LEU 126          HD21      LEU 126  21.217   2.929  20.386
  924   2HD2  LEU 126          HD22      LEU 126  20.153   1.565  19.986
  925   3HD2  LEU 126          HD23      LEU 126  20.918   1.644  21.578
  926    H    ASP 127           H        ASP 127  24.956  -0.779  16.126
  927    HA   ASP 127           HA       ASP 127  24.643  -3.340  17.445
  928   1HB   ASP 127          HB2       ASP 127  22.446  -3.180  16.288
  929   2HB   ASP 127          HB3       ASP 127  23.265  -2.808  14.768
  930    H    HIS 128           H        HIS 128  25.987  -4.955  16.278
  931    HA   HIS 128           HA       HIS 128  27.916  -3.840  14.324
  932   1HB   HIS 128          HB2       HIS 128  29.771  -4.872  15.625
  933   2HB   HIS 128          HB3       HIS 128  29.030  -3.484  16.406
  934    HD1  HIS 128           HD1      HIS 128  27.459  -6.998  16.783
  935    HD2  HIS 128           HD2      HIS 128  29.793  -4.171  18.857
  936    HE1  HIS 128           HE1      HIS 128  27.592  -7.811  19.198
  937    H    ASP 129           H        ASP 129  29.049  -5.568  13.135
  938    HA   ASP 129           HA       ASP 129  27.732  -8.189  13.170
  939   1HB   ASP 129          HB2       ASP 129  26.448  -6.284  11.799
  940   2HB   ASP 129          HB3       ASP 129  27.571  -6.503  10.602
  941    H    ILE 130           H        ILE 130  29.215  -6.205  10.848
  942    HA   ILE 130           HA       ILE 130  31.669  -7.886  10.529
  943    HB   ILE 130           HB       ILE 130  29.378  -7.449   8.625
  944   1HG1  ILE 130          HG12      ILE 130  29.465  -9.586   9.845
  945   2HG1  ILE 130          HG13      ILE 130  29.611  -9.818   8.127
  946   1HG2  ILE 130          HG21      ILE 130  31.084  -6.650   7.183
  947   2HG2  ILE 130          HG22      ILE 130  32.198  -7.959   7.653
  948   3HG2  ILE 130          HG23      ILE 130  30.724  -8.296   6.703
  949   1HD1  ILE 130          HD11      ILE 130  32.042 -10.207   8.333
  950   2HD1  ILE 130          HD12      ILE 130  31.928  -9.976  10.094
  951   3HD1  ILE 130          HD13      ILE 130  31.091 -11.326   9.318
  952    HA   PRO 131           HA       PRO 131  32.681  -3.988   8.106
  953   1HB   PRO 131          HB2       PRO 131  31.147  -1.724   8.093
  954   2HB   PRO 131          HB3       PRO 131  30.857  -3.111   6.997
  955   1HG   PRO 131          HG2       PRO 131  29.501  -2.565   9.670
  956   2HG   PRO 131          HG3       PRO 131  28.723  -2.886   8.113
  957   1HD   PRO 131          HD2       PRO 131  29.080  -4.906   9.816
  958   2HD   PRO 131          HD3       PRO 131  29.459  -5.154   8.095
  959    H    GLU 132           H        GLU 132  30.848  -2.948  10.954
  960    HA   GLU 132           HA       GLU 132  31.237  -1.478  12.632
  961   1HB   GLU 132          HB2       GLU 132  33.770  -3.116  12.610
  962   2HB   GLU 132          HB3       GLU 132  33.515  -1.843  13.803
  963   1HG   GLU 132          HG2       GLU 132  32.822  -3.915  14.763
  964   2HG   GLU 132          HG3       GLU 132  31.434  -2.862  14.566
  965    H    ASP 133           H        ASP 133  31.495  -0.344  10.078
  966    HA   ASP 133           HA       ASP 133  32.915   2.131  10.743
  967   1HB   ASP 133          HB2       ASP 133  34.717   0.913   9.684
  968   2HB   ASP 133          HB3       ASP 133  33.678   0.439   8.339
  969    HA   PRO 134           HA       PRO 134  28.810   2.320   8.617
  970   1HB   PRO 134          HB2       PRO 134  27.716   4.442   9.976
  971   2HB   PRO 134          HB3       PRO 134  27.737   2.768  10.599
  972   1HG   PRO 134          HG2       PRO 134  29.655   5.017  11.250
  973   2HG   PRO 134          HG3       PRO 134  28.843   3.889  12.382
  974   1HD   PRO 134          HD2       PRO 134  31.407   3.511  11.518
  975   2HD   PRO 134          HD3       PRO 134  30.314   2.129  11.823
  976    H    ALA 135           H        ALA 135  27.965   3.766   7.049
  977    HA   ALA 135           HA       ALA 135  29.520   6.191   6.342
  978   1HB   ALA 135          HB1       ALA 135  29.856   5.326   4.062
  979   2HB   ALA 135          HB2       ALA 135  30.622   4.247   5.238
  980   3HB   ALA 135          HB3       ALA 135  29.068   3.796   4.497
  981    H    GLU 136           H        GLU 136  27.015   6.257   7.479
  982    HA   GLU 136           HA       GLU 136  24.812   5.694   5.821
  983   1HB   GLU 136          HB2       GLU 136  23.499   6.973   7.418
  984   2HB   GLU 136          HB3       GLU 136  24.580   5.841   8.208
  985   1HG   GLU 136          HG2       GLU 136  25.462   8.727   7.893
  986   2HG   GLU 136          HG3       GLU 136  24.233   8.325   9.077
  987    H    GLU 137           H        GLU 137  26.918   8.455   5.623
  988    HA   GLU 137           HA       GLU 137  25.204  10.364   4.378
  989   1HB   GLU 137          HB2       GLU 137  28.160   9.738   3.973
  990   2HB   GLU 137          HB3       GLU 137  27.357  11.172   3.337
  991   1HG   GLU 137          HG2       GLU 137  27.614  10.479   6.298
  992   2HG   GLU 137          HG3       GLU 137  28.631  11.611   5.420
  993    H    TRP 138           H        TRP 138  26.547   7.336   3.162
  994    HA   TRP 138           HA       TRP 138  26.255   7.700   0.367
  995   1HB   TRP 138          HB2       TRP 138  25.960   5.384   2.263
  996   2HB   TRP 138          HB3       TRP 138  25.523   5.208   0.576
  997    HD1  TRP 138           HD1      TRP 138  27.055   3.467  -0.100
  998    HE1  TRP 138           HE1      TRP 138  29.529   3.169  -0.406
  999    HE3  TRP 138           HE3      TRP 138  28.659   7.769   2.225
 1000    HZ2  TRP 138           HZ2      TRP 138  31.976   4.614   0.278
 1001    HZ3  TRP 138           HZ3      TRP 138  31.069   8.264   2.373
 1002    HH2  TRP 138           HH2      TRP 138  32.740   6.699   1.406
 1003    H    LEU 139           H        LEU 139  23.806   6.905   2.922
 1004    HA   LEU 139           HA       LEU 139  21.681   6.191   1.095
 1005   1HB   LEU 139          HB2       LEU 139  22.050   5.982   3.784
 1006   2HB   LEU 139          HB3       LEU 139  21.207   7.488   3.799
 1007    HG   LEU 139           HG       LEU 139  19.312   6.451   2.493
 1008   1HD1  LEU 139          HD11      LEU 139  20.460   4.471   1.516
 1009   2HD1  LEU 139          HD12      LEU 139  20.748   3.833   3.149
 1010   3HD1  LEU 139          HD13      LEU 139  19.099   3.978   2.518
 1011   1HD2  LEU 139          HD21      LEU 139  18.412   5.253   4.486
 1012   2HD2  LEU 139          HD22      LEU 139  20.047   5.225   5.186
 1013   3HD2  LEU 139          HD23      LEU 139  19.214   6.770   4.924
 1014    H    GLY 140           H        GLY 140  22.498   9.096   2.919
 1015   1HA   GLY 140          HA2       GLY 140  20.593  10.920   1.948
 1016   2HA   GLY 140          HA3       GLY 140  22.246  11.361   2.420
 1017    H    SER 141           H        SER 141  23.826  10.169   0.509
 1018    HA   SER 141           HA       SER 141  23.543  11.854  -1.748
 1019   1HB   SER 141          HB2       SER 141  25.647  10.786  -0.825
 1020   2HB   SER 141          HB3       SER 141  25.148   9.271  -1.597
 1021    HG   SER 141           HG       SER 141  26.570  10.559  -2.887
 1022    H    TRP 142           H        TRP 142  22.986   8.313  -1.465
 1023    HA   TRP 142           HA       TRP 142  22.131   7.745  -4.046
 1024   1HB   TRP 142          HB2       TRP 142  22.865   6.156  -2.364
 1025   2HB   TRP 142          HB3       TRP 142  21.504   6.553  -1.345
 1026    HD1  TRP 142           HD1      TRP 142  22.372   4.556  -4.482
 1027    HE1  TRP 142           HE1      TRP 142  20.562   2.767  -4.857
 1028    HE3  TRP 142           HE3      TRP 142  19.240   5.855  -0.677
 1029    HZ2  TRP 142           HZ2      TRP 142  17.986   2.085  -3.713
 1030    HZ3  TRP 142           HZ3      TRP 142  17.102   4.607  -0.337
 1031    HH2  TRP 142           HH2      TRP 142  16.474   2.744  -1.843
 1032    H    VAL 143           H        VAL 143  20.200   8.857  -1.249
 1033    HA   VAL 143           HA       VAL 143  17.635   8.868  -2.520
 1034    HB   VAL 143           HB       VAL 143  18.887  10.200  -0.098
 1035   1HG1  VAL 143          HG11      VAL 143  17.319  11.882  -0.855
 1036   2HG1  VAL 143          HG12      VAL 143  16.038  10.651  -1.036
 1037   3HG1  VAL 143          HG13      VAL 143  16.698  11.073   0.572
 1038   1HG2  VAL 143          HG21      VAL 143  16.633   8.169  -0.435
 1039   2HG2  VAL 143          HG22      VAL 143  18.290   7.805   0.052
 1040   3HG2  VAL 143          HG23      VAL 143  17.270   8.778   1.113
 1041    H    ASN 144           H        ASN 144  19.965  11.625  -1.911
 1042    HA   ASN 144           HA       ASN 144  18.262  13.362  -3.347
 1043   1HB   ASN 144          HB2       ASN 144  19.537  15.033  -2.678
 1044   2HB   ASN 144          HB3       ASN 144  20.281  13.840  -1.627
 1045   1HD2  ASN 144          HD22      ASN 144  22.072  12.485  -3.164
 1046   2HD2  ASN 144          HD21      ASN 144  23.231  13.590  -3.870
 1047    H    LEU 145           H        LEU 145  20.513  11.083  -4.569
 1048    HA   LEU 145           HA       LEU 145  20.821  12.281  -7.192
 1049   1HB   LEU 145          HB2       LEU 145  21.592   9.727  -5.840
 1050   2HB   LEU 145          HB3       LEU 145  21.186   9.553  -7.536
 1051    HG   LEU 145           HG       LEU 145  22.828  11.231  -8.195
 1052   1HD1  LEU 145          HD11      LEU 145  22.896  12.656  -6.173
 1053   2HD1  LEU 145          HD12      LEU 145  23.647  11.327  -5.260
 1054   3HD1  LEU 145          HD13      LEU 145  24.509  12.087  -6.612
 1055   1HD2  LEU 145          HD21      LEU 145  23.971   9.058  -6.382
 1056   2HD2  LEU 145          HD22      LEU 145  23.456   8.846  -8.071
 1057   3HD2  LEU 145          HD23      LEU 145  24.836   9.887  -7.696
 1058    H    LEU 146           H        LEU 146  18.503  10.022  -5.659
 1059    HA   LEU 146           HA       LEU 146  17.246   9.356  -8.198
 1060   1HB   LEU 146          HB2       LEU 146  16.213   7.770  -7.093
 1061   2HB   LEU 146          HB3       LEU 146  17.566   7.974  -6.018
 1062    HG   LEU 146           HG       LEU 146  15.853   9.370  -4.568
 1063   1HD1  LEU 146          HD11      LEU 146  13.563   8.381  -4.727
 1064   2HD1  LEU 146          HD12      LEU 146  13.942   9.378  -6.130
 1065   3HD1  LEU 146          HD13      LEU 146  14.013   7.608  -6.256
 1066   1HD2  LEU 146          HD21      LEU 146  16.983   7.228  -3.976
 1067   2HD2  LEU 146          HD22      LEU 146  15.299   7.259  -3.419
 1068   3HD2  LEU 146          HD23      LEU 146  15.750   6.334  -4.874
 1069    H    LYS 147           H        LYS 147  16.695  11.482  -5.526
 1070    HA   LYS 147           HA       LYS 147  14.125  12.521  -6.073
 1071   1HB   LYS 147          HB2       LYS 147  16.652  13.648  -4.821
 1072   2HB   LYS 147          HB3       LYS 147  15.226  14.654  -5.062
 1073   1HG   LYS 147          HG2       LYS 147  13.848  13.013  -3.780
 1074   2HG   LYS 147          HG3       LYS 147  15.318  12.084  -3.432
 1075   1HD   LYS 147          HD2       LYS 147  16.296  14.033  -2.273
 1076   2HD   LYS 147          HD3       LYS 147  14.874  15.011  -2.647
 1077   1HE   LYS 147          HE2       LYS 147  14.821  12.442  -0.997
 1078   2HE   LYS 147          HE3       LYS 147  14.956  14.056  -0.301
 1079   1HZ   LYS 147          HZ1       LYS 147  12.664  13.174  -1.957
 1080   2HZ   LYS 147          HZ2       LYS 147  12.700  13.167  -0.326
 1081   3HZ   LYS 147          HZ3       LYS 147  12.793  14.592  -1.140
  Start of MODEL   20
    1   1H    MET   1          H1        MET   1   1.812  -2.594   0.922
    2   2H    MET   1          H2        MET   1   3.435  -2.486   1.203
    3   3H    MET   1          H3        MET   1   2.406  -1.490   1.990
    4    HA   MET   1           HA       MET   1   2.847  -1.512  -0.907
    5   1HB   MET   1          HB2       MET   1   0.589  -0.711  -0.232
    6   2HB   MET   1          HB3       MET   1   1.333   0.512   0.808
    7   1HG   MET   1          HG2       MET   1   2.404   1.541  -1.176
    8   2HG   MET   1          HG3       MET   1   1.702   0.289  -2.209
    9   1HE   MET   1          HE1       MET   1   1.486   3.414  -2.774
   10   2HE   MET   1          HE2       MET   1   0.783   2.162  -3.825
   11   3HE   MET   1          HE3       MET   1  -0.210   3.534  -3.288
   12    H    ALA   2           H        ALA   2   4.723  -0.557  -1.578
   13    HA   ALA   2           HA       ALA   2   6.182   1.307   0.171
   14   1HB   ALA   2          HB1       ALA   2   7.183  -1.466  -0.647
   15   2HB   ALA   2          HB2       ALA   2   8.200  -0.193   0.039
   16   3HB   ALA   2          HB3       ALA   2   6.888  -0.901   1.004
   17    H    ASP   3           H        ASP   3   8.012   2.230  -0.928
   18    HA   ASP   3           HA       ASP   3   7.904   2.244  -3.883
   19   1HB   ASP   3          HB2       ASP   3   7.906   4.424  -2.511
   20   2HB   ASP   3          HB3       ASP   3   9.496   3.969  -1.948
   21    H    ILE   4           H        ILE   4   9.760   1.171  -1.104
   22    HA   ILE   4           HA       ILE   4  11.925   0.151  -2.866
   23    HB   ILE   4           HB       ILE   4  12.330   1.249  -0.070
   24   1HG1  ILE   4          HG12      ILE   4  12.835   2.804  -2.635
   25   2HG1  ILE   4          HG13      ILE   4  11.602   3.173  -1.428
   26   1HG2  ILE   4          HG21      ILE   4  14.677   1.170  -0.644
   27   2HG2  ILE   4          HG22      ILE   4  13.986  -0.397  -1.037
   28   3HG2  ILE   4          HG23      ILE   4  14.312   0.757  -2.330
   29   1HD1  ILE   4          HD11      ILE   4  13.388   3.572   0.260
   30   2HD1  ILE   4          HD12      ILE   4  14.599   3.389  -1.036
   31   3HD1  ILE   4          HD13      ILE   4  13.407   4.690  -1.115
   32    H    THR   5           H        THR   5  12.234  -2.014  -2.577
   33    HA   THR   5           HA       THR   5  11.088  -3.359  -0.198
   34    HB   THR   5           HB       THR   5  10.573  -4.328  -2.396
   35    HG1  THR   5           HG1      THR   5  10.712  -5.792  -0.811
   36   1HG2  THR   5          HG21      THR   5  12.258  -5.440  -3.773
   37   2HG2  THR   5          HG22      THR   5  12.414  -3.680  -3.782
   38   3HG2  THR   5          HG23      THR   5  13.543  -4.665  -2.830
   39    H    LEU   6           H        LEU   6  12.429  -3.821   1.522
   40    HA   LEU   6           HA       LEU   6  15.372  -3.309   1.276
   41   1HB   LEU   6          HB2       LEU   6  13.395  -3.148   3.562
   42   2HB   LEU   6          HB3       LEU   6  15.077  -3.420   3.889
   43    HG   LEU   6           HG       LEU   6  14.265  -1.081   4.150
   44   1HD1  LEU   6          HD11      LEU   6  16.575  -1.438   2.215
   45   2HD1  LEU   6          HD12      LEU   6  16.254  -0.003   3.206
   46   3HD1  LEU   6          HD13      LEU   6  16.647  -1.535   3.991
   47   1HD2  LEU   6          HD21      LEU   6  14.340  -0.929   1.125
   48   2HD2  LEU   6          HD22      LEU   6  12.849  -0.975   2.087
   49   3HD2  LEU   6          HD23      LEU   6  13.974   0.388   2.256
   50    H    ILE   7           H        ILE   7  16.016  -5.238   0.547
   51    HA   ILE   7           HA       ILE   7  14.748  -7.710   1.510
   52    HB   ILE   7           HB       ILE   7  16.806  -7.588  -0.705
   53   1HG1  ILE   7          HG12      ILE   7  13.854  -7.108  -1.245
   54   2HG1  ILE   7          HG13      ILE   7  15.060  -5.823  -1.258
   55   1HG2  ILE   7          HG21      ILE   7  15.897  -9.761   0.288
   56   2HG2  ILE   7          HG22      ILE   7  14.297  -9.283  -0.322
   57   3HG2  ILE   7          HG23      ILE   7  15.626  -9.595  -1.446
   58   1HD1  ILE   7          HD11      ILE   7  14.646  -6.577  -3.526
   59   2HD1  ILE   7          HD12      ILE   7  16.316  -6.912  -3.048
   60   3HD1  ILE   7          HD13      ILE   7  15.121  -8.223  -3.115
   61    H    SER   8           H        SER   8  15.687  -8.152   3.548
   62    HA   SER   8           HA       SER   8  18.620  -8.230   3.777
   63   1HB   SER   8          HB2       SER   8  16.757  -9.565   5.737
   64   2HB   SER   8          HB3       SER   8  18.351  -8.849   5.991
   65    HG   SER   8           HG       SER   8  15.862  -7.578   5.584
   66    H    GLY   9           H        GLY   9  19.781 -10.418   4.100
   67   1HA   GLY   9          HA2       GLY   9  18.314 -12.846   3.746
   68   2HA   GLY   9          HA3       GLY   9  19.004 -12.367   2.193
   69    H    SER  10           H        SER  10  21.119 -11.486   4.863
   70    HA   SER  10           HA       SER  10  23.093 -13.347   4.091
   71   1HB   SER  10          HB2       SER  10  23.775 -12.639   6.646
   72   2HB   SER  10          HB3       SER  10  24.173 -11.741   5.180
   73    HG   SER  10           HG       SER  10  23.161 -10.525   6.944
   74    H    THR  11           H        THR  11  23.347 -15.392   4.526
   75    HA   THR  11           HA       THR  11  22.648 -17.502   5.017
   76    HB   THR  11           HB       THR  11  23.398 -18.005   7.403
   77    HG1  THR  11           HG1      THR  11  22.962 -15.949   8.303
   78   1HG2  THR  11          HG21      THR  11  25.282 -16.340   5.672
   79   2HG2  THR  11          HG22      THR  11  25.732 -17.549   6.892
   80   3HG2  THR  11          HG23      THR  11  24.900 -18.056   5.414
   81    H    LEU  12           H        LEU  12  20.343 -16.714   4.495
   82    HA   LEU  12           HA       LEU  12  18.127 -16.786   4.809
   83   1HB   LEU  12          HB2       LEU  12  18.776 -19.108   4.725
   84   2HB   LEU  12          HB3       LEU  12  18.884 -19.193   6.483
   85    HG   LEU  12           HG       LEU  12  16.434 -18.810   6.660
   86   1HD1  LEU  12          HD11      LEU  12  15.014 -18.908   4.623
   87   2HD1  LEU  12          HD12      LEU  12  15.988 -17.443   4.673
   88   3HD1  LEU  12          HD13      LEU  12  16.469 -18.794   3.612
   89   1HD2  LEU  12          HD21      LEU  12  17.163 -21.028   4.707
   90   2HD2  LEU  12          HD22      LEU  12  17.318 -21.101   6.476
   91   3HD2  LEU  12          HD23      LEU  12  15.715 -20.961   5.738
   92    H    GLY  13           H        GLY  13  18.556 -14.746   5.934
   93   1HA   GLY  13          HA2       GLY  13  16.874 -14.119   8.054
   94   2HA   GLY  13          HA3       GLY  13  18.442 -14.548   8.785
   95    H    GLY  14           H        GLY  14  18.858 -12.292   9.375
   96   1HA   GLY  14          HA2       GLY  14  20.723 -11.142   7.822
   97   2HA   GLY  14          HA3       GLY  14  19.262 -10.334   7.244
   98    H    ALA  15           H        ALA  15  20.880  -8.630   8.168
   99    HA   ALA  15           HA       ALA  15  20.621  -8.030  11.008
  100   1HB   ALA  15          HB1       ALA  15  21.781  -5.954  10.382
  101   2HB   ALA  15          HB2       ALA  15  22.620  -7.356   9.700
  102   3HB   ALA  15          HB3       ALA  15  21.596  -6.336   8.658
  103    H    GLU  16           H        GLU  16  18.108  -8.536  10.415
  104    HA   GLU  16           HA       GLU  16  16.612  -6.676   8.947
  105   1HB   GLU  16          HB2       GLU  16  15.781  -8.458  11.264
  106   2HB   GLU  16          HB3       GLU  16  14.651  -7.509  10.283
  107   1HG   GLU  16          HG2       GLU  16  15.365  -8.697   8.244
  108   2HG   GLU  16          HG3       GLU  16  16.522  -9.649   9.178
  109    H    TYR  17           H        TYR  17  17.713  -6.406  12.329
  110    HA   TYR  17           HA       TYR  17  16.038  -4.209  13.079
  111   1HB   TYR  17          HB2       TYR  17  17.360  -5.503  14.691
  112   2HB   TYR  17          HB3       TYR  17  18.860  -4.976  13.937
  113    HD1  TYR  17           HD1      TYR  17  15.875  -3.796  15.860
  114    HD2  TYR  17           HD2      TYR  17  19.869  -2.862  14.508
  115    HE1  TYR  17           HE1      TYR  17  15.911  -1.812  17.344
  116    HE2  TYR  17           HE2      TYR  17  19.913  -0.880  15.984
  117    HH   TYR  17           HH       TYR  17  18.745   0.394  17.550
  118    H    VAL  18           H        VAL  18  19.119  -4.385  11.250
  119    HA   VAL  18           HA       VAL  18  19.453  -1.487  11.171
  120    HB   VAL  18           HB       VAL  18  20.841  -3.683   9.571
  121   1HG1  VAL  18          HG11      VAL  18  21.106  -1.472   8.530
  122   2HG1  VAL  18          HG12      VAL  18  21.615  -0.778  10.086
  123   3HG1  VAL  18          HG13      VAL  18  22.618  -2.002   9.274
  124   1HG2  VAL  18          HG21      VAL  18  22.703  -3.397  11.203
  125   2HG2  VAL  18          HG22      VAL  18  21.684  -2.308  12.168
  126   3HG2  VAL  18          HG23      VAL  18  21.255  -4.022  11.988
  127    H    ALA  19           H        ALA  19  18.128  -4.101   9.073
  128    HA   ALA  19           HA       ALA  19  17.522  -2.444   6.834
  129   1HB   ALA  19          HB1       ALA  19  15.970  -4.168   6.171
  130   2HB   ALA  19          HB2       ALA  19  17.436  -4.932   6.814
  131   3HB   ALA  19          HB3       ALA  19  15.953  -4.859   7.800
  132    H    GLU  20           H        GLU  20  15.623  -3.126   9.829
  133    HA   GLU  20           HA       GLU  20  13.401  -1.511   9.109
  134   1HB   GLU  20          HB2       GLU  20  13.498  -3.267  10.913
  135   2HB   GLU  20          HB3       GLU  20  14.418  -2.134  11.913
  136   1HG   GLU  20          HG2       GLU  20  12.523  -0.527  11.811
  137   2HG   GLU  20          HG3       GLU  20  11.635  -1.633  10.765
  138    H    HIS  21           H        HIS  21  16.454  -0.684  10.880
  139    HA   HIS  21           HA       HIS  21  15.723   2.016  11.453
  140   1HB   HIS  21          HB2       HIS  21  17.614   0.905  12.538
  141   2HB   HIS  21          HB3       HIS  21  18.456   0.746  10.995
  142    HD1  HIS  21           HD1      HIS  21  19.948   2.808  10.281
  143    HD2  HIS  21           HD2      HIS  21  17.241   3.563  13.418
  144    HE1  HIS  21           HE1      HIS  21  20.470   5.149  11.130
  145    H    LEU  22           H        LEU  22  17.448   0.570   8.665
  146    HA   LEU  22           HA       LEU  22  17.914   2.898   7.130
  147   1HB   LEU  22          HB2       LEU  22  17.408  -0.027   6.495
  148   2HB   LEU  22          HB3       LEU  22  17.580   1.118   5.195
  149    HG   LEU  22           HG       LEU  22  19.686   0.844   7.387
  150   1HD1  LEU  22          HD11      LEU  22  20.897  -0.703   5.936
  151   2HD1  LEU  22          HD12      LEU  22  19.334  -1.363   6.345
  152   3HD1  LEU  22          HD13      LEU  22  19.579  -0.655   4.735
  153   1HD2  LEU  22          HD21      LEU  22  19.790   1.930   4.536
  154   2HD2  LEU  22          HD22      LEU  22  19.857   2.885   6.031
  155   3HD2  LEU  22          HD23      LEU  22  21.180   1.790   5.631
  156    H    ALA  23           H        ALA  23  15.185   0.597   6.973
  157    HA   ALA  23           HA       ALA  23  13.506   1.910   5.189
  158   1HB   ALA  23          HB1       ALA  23  12.976  -0.299   5.955
  159   2HB   ALA  23          HB2       ALA  23  12.903   0.220   7.646
  160   3HB   ALA  23          HB3       ALA  23  11.662   0.749   6.529
  161    H    GLU  24           H        GLU  24  13.616   2.405   8.788
  162    HA   GLU  24           HA       GLU  24  11.582   4.312   8.942
  163   1HB   GLU  24          HB2       GLU  24  12.934   3.178  10.816
  164   2HB   GLU  24          HB3       GLU  24  14.134   4.435  10.616
  165   1HG   GLU  24          HG2       GLU  24  12.431   6.148  11.066
  166   2HG   GLU  24          HG3       GLU  24  11.187   4.908  11.231
  167    H    LYS  25           H        LYS  25  15.112   4.950   8.655
  168    HA   LYS  25           HA       LYS  25  14.904   7.742   8.314
  169   1HB   LYS  25          HB2       LYS  25  16.940   5.712   7.286
  170   2HB   LYS  25          HB3       LYS  25  17.179   7.441   7.220
  171   1HG   LYS  25          HG2       LYS  25  16.818   5.720   9.728
  172   2HG   LYS  25          HG3       LYS  25  18.292   6.429   9.167
  173   1HD   LYS  25          HD2       LYS  25  15.921   7.755  10.460
  174   2HD   LYS  25          HD3       LYS  25  17.593   7.716  11.008
  175   1HE   LYS  25          HE2       LYS  25  18.183   9.148   8.970
  176   2HE   LYS  25          HE3       LYS  25  16.440   9.315   8.681
  177   1HZ   LYS  25          HZ1       LYS  25  16.248  10.340  10.878
  178   2HZ   LYS  25          HZ2       LYS  25  17.857  10.201  11.128
  179   3HZ   LYS  25          HZ3       LYS  25  17.297  11.173   9.951
  180    H    LEU  26           H        LEU  26  14.824   5.201   5.820
  181    HA   LEU  26           HA       LEU  26  14.724   7.004   3.592
  182   1HB   LEU  26          HB2       LEU  26  13.825   4.138   3.982
  183   2HB   LEU  26          HB3       LEU  26  13.679   4.955   2.427
  184    HG   LEU  26           HG       LEU  26  16.338   4.690   3.899
  185   1HD1  LEU  26          HD11      LEU  26  16.841   2.807   2.420
  186   2HD1  LEU  26          HD12      LEU  26  15.429   2.447   3.420
  187   3HD1  LEU  26          HD13      LEU  26  15.212   2.890   1.713
  188   1HD2  LEU  26          HD21      LEU  26  17.298   5.107   1.667
  189   2HD2  LEU  26          HD22      LEU  26  15.661   5.343   1.005
  190   3HD2  LEU  26          HD23      LEU  26  16.321   6.469   2.209
  191    H    GLU  27           H        GLU  27  12.061   5.707   5.703
  192    HA   GLU  27           HA       GLU  27  10.048   6.903   4.041
  193   1HB   GLU  27          HB2       GLU  27  10.030   5.867   6.905
  194   2HB   GLU  27          HB3       GLU  27   8.626   6.509   6.051
  195   1HG   GLU  27          HG2       GLU  27   9.186   4.828   4.176
  196   2HG   GLU  27          HG3       GLU  27  10.246   4.060   5.327
  197    H    GLU  28           H        GLU  28  11.930   8.032   6.915
  198    HA   GLU  28           HA       GLU  28  10.672  10.573   7.133
  199   1HB   GLU  28          HB2       GLU  28  13.478   9.555   7.745
  200   2HB   GLU  28          HB3       GLU  28  12.960  11.180   8.099
  201   1HG   GLU  28          HG2       GLU  28  11.622   8.695   9.231
  202   2HG   GLU  28          HG3       GLU  28  12.903   9.599  10.027
  203    H    ALA  29           H        ALA  29  13.092   9.300   4.843
  204    HA   ALA  29           HA       ALA  29  13.844  11.862   3.770
  205   1HB   ALA  29          HB1       ALA  29  14.938  10.592   2.025
  206   2HB   ALA  29          HB2       ALA  29  15.264   9.815   3.581
  207   3HB   ALA  29          HB3       ALA  29  14.073   9.122   2.453
  208    H    GLY  30           H        GLY  30  11.007   9.884   3.362
  209   1HA   GLY  30          HA2       GLY  30   9.184  11.325   2.575
  210   2HA   GLY  30          HA3       GLY  30  10.122  11.652   1.116
  211    H    PHE  31           H        PHE  31  10.631   8.360   1.816
  212    HA   PHE  31           HA       PHE  31   8.633   7.701  -0.303
  213   1HB   PHE  31          HB2       PHE  31  10.921   5.929   0.508
  214   2HB   PHE  31          HB3       PHE  31  10.032   5.981  -0.990
  215    HD1  PHE  31           HD1      PHE  31  12.989   7.145   0.703
  216    HD2  PHE  31           HD2      PHE  31  10.272   8.062  -2.520
  217    HE1  PHE  31           HE1      PHE  31  14.686   8.637  -0.303
  218    HE2  PHE  31           HE2      PHE  31  11.987   9.539  -3.540
  219    HZ   PHE  31           HZ       PHE  31  14.199   9.825  -2.442
  220    H    THR  32           H        THR  32   8.404   4.971   0.007
  221    HA   THR  32           HA       THR  32   7.643   4.428   2.804
  222    HB   THR  32           HB       THR  32   5.819   2.948   1.808
  223    HG1  THR  32           HG1      THR  32   4.928   3.813  -0.145
  224   1HG2  THR  32          HG21      THR  32   4.170   4.765   1.928
  225   2HG2  THR  32          HG22      THR  32   5.408   4.932   3.187
  226   3HG2  THR  32          HG23      THR  32   5.464   5.977   1.747
  227    H    THR  33           H        THR  33   8.090   2.258   3.393
  228    HA   THR  33           HA       THR  33   9.716   0.742   1.392
  229    HB   THR  33           HB       THR  33  11.475   0.551   3.033
  230    HG1  THR  33           HG1      THR  33  10.139   0.851   4.916
  231   1HG2  THR  33          HG21      THR  33  11.435   2.581   1.475
  232   2HG2  THR  33          HG22      THR  33  10.792   3.512   2.836
  233   3HG2  THR  33          HG23      THR  33  12.394   2.748   2.951
  234    H    GLU  34           H        GLU  34  10.010  -1.483   1.760
  235    HA   GLU  34           HA       GLU  34   8.202  -2.761   3.723
  236   1HB   GLU  34          HB2       GLU  34   8.294  -2.833   0.928
  237   2HB   GLU  34          HB3       GLU  34   9.167  -4.270   1.381
  238   1HG   GLU  34          HG2       GLU  34   6.947  -4.800   1.146
  239   2HG   GLU  34          HG3       GLU  34   7.303  -4.915   2.861
  240    H    THR  35           H        THR  35   9.579  -3.152   5.505
  241    HA   THR  35           HA       THR  35  12.343  -4.021   5.145
  242    HB   THR  35           HB       THR  35  10.664  -4.174   7.678
  243    HG1  THR  35           HG1      THR  35  10.641  -2.044   7.079
  244   1HG2  THR  35          HG21      THR  35  12.865  -4.045   8.768
  245   2HG2  THR  35          HG22      THR  35  12.852  -5.409   7.641
  246   3HG2  THR  35          HG23      THR  35  13.664  -3.901   7.183
  247    H    LEU  36           H        LEU  36  12.915  -6.066   4.631
  248    HA   LEU  36           HA       LEU  36  11.150  -8.362   5.355
  249   1HB   LEU  36          HB2       LEU  36  12.209  -7.614   2.593
  250   2HB   LEU  36          HB3       LEU  36  11.396  -9.122   2.960
  251    HG   LEU  36           HG       LEU  36  10.061  -6.408   3.241
  252   1HD1  LEU  36          HD11      LEU  36  10.761  -6.841   0.940
  253   2HD1  LEU  36          HD12      LEU  36   9.893  -8.392   0.952
  254   3HD1  LEU  36          HD13      LEU  36   9.000  -6.853   1.130
  255   1HD2  LEU  36          HD21      LEU  36   7.970  -7.694   3.228
  256   2HD2  LEU  36          HD22      LEU  36   8.874  -9.219   3.115
  257   3HD2  LEU  36          HD23      LEU  36   8.983  -8.216   4.577
  258    H    HIS  37           H        HIS  37  12.187 -10.436   4.798
  259    HA   HIS  37           HA       HIS  37  15.155 -10.419   4.665
  260   1HB   HIS  37          HB2       HIS  37  15.019 -12.628   5.895
  261   2HB   HIS  37          HB3       HIS  37  14.674 -11.183   6.823
  262    HD1  HIS  37           HD1      HIS  37  12.458 -11.161   8.142
  263    HD2  HIS  37           HD2      HIS  37  12.639 -14.072   5.094
  264    HE1  HIS  37           HE1      HIS  37  10.319 -12.553   8.335
  265    H    GLY  38           H        GLY  38  13.652 -10.094   2.447
  266   1HA   GLY  38          HA2       GLY  38  12.902 -10.924   0.448
  267   2HA   GLY  38          HA3       GLY  38  14.364 -11.910   0.562
  268    HA   PRO  39           HA       PRO  39  11.173 -14.944   2.318
  269   1HB   PRO  39          HB2       PRO  39   8.512 -14.328   2.647
  270   2HB   PRO  39          HB3       PRO  39   9.767 -13.996   3.878
  271   1HG   PRO  39          HG2       PRO  39   8.645 -12.090   1.801
  272   2HG   PRO  39          HG3       PRO  39   8.869 -11.808   3.558
  273   1HD   PRO  39          HD2       PRO  39  10.695 -10.949   1.729
  274   2HD   PRO  39          HD3       PRO  39  11.202 -11.597   3.323
  275    H    LEU  40           H        LEU  40  10.109 -12.838  -0.324
  276    HA   LEU  40           HA       LEU  40   9.451 -15.197  -1.981
  277   1HB   LEU  40          HB2       LEU  40   8.224 -12.404  -1.723
  278   2HB   LEU  40          HB3       LEU  40   7.974 -13.410  -3.117
  279    HG   LEU  40           HG       LEU  40   7.145 -14.157  -0.286
  280   1HD1  LEU  40          HD11      LEU  40   4.853 -13.727  -1.067
  281   2HD1  LEU  40          HD12      LEU  40   5.850 -12.271  -1.198
  282   3HD1  LEU  40          HD13      LEU  40   5.473 -13.217  -2.654
  283   1HD2  LEU  40          HD21      LEU  40   6.589 -15.548  -2.948
  284   2HD2  LEU  40          HD22      LEU  40   7.541 -16.194  -1.591
  285   3HD2  LEU  40          HD23      LEU  40   5.807 -15.948  -1.402
  286    H    LEU  41           H        LEU  41  11.966 -13.566  -1.326
  287    HA   LEU  41           HA       LEU  41  13.689 -12.458  -2.142
  288   1HB   LEU  41          HB2       LEU  41  13.553 -14.415  -3.788
  289   2HB   LEU  41          HB3       LEU  41  12.828 -13.273  -4.919
  290    HG   LEU  41           HG       LEU  41  14.937 -11.812  -4.583
  291   1HD1  LEU  41          HD11      LEU  41  15.907 -14.380  -3.280
  292   2HD1  LEU  41          HD12      LEU  41  16.962 -13.075  -3.869
  293   3HD1  LEU  41          HD13      LEU  41  15.840 -12.763  -2.546
  294   1HD2  LEU  41          HD21      LEU  41  14.581 -13.034  -6.616
  295   2HD2  LEU  41          HD22      LEU  41  16.280 -13.172  -6.149
  296   3HD2  LEU  41          HD23      LEU  41  15.174 -14.537  -5.884
  297    H    GLU  42           H        GLU  42  10.622 -11.501  -3.555
  298    HA   GLU  42           HA       GLU  42  11.549  -8.740  -3.933
  299   1HB   GLU  42          HB2       GLU  42  10.955  -8.818  -6.362
  300   2HB   GLU  42          HB3       GLU  42  12.391  -9.715  -5.913
  301   1HG   GLU  42          HG2       GLU  42  11.041 -11.849  -6.009
  302   2HG   GLU  42          HG3       GLU  42   9.698 -10.919  -6.663
  303    H    ASP  43           H        ASP  43   9.943  -8.341  -2.292
  304    HA   ASP  43           HA       ASP  43   7.157  -9.024  -2.725
  305   1HB   ASP  43          HB2       ASP  43   7.948  -8.378  -0.510
  306   2HB   ASP  43          HB3       ASP  43   8.368  -6.760  -1.111
  307    H    LEU  44           H        LEU  44   9.224  -6.166  -3.521
  308    HA   LEU  44           HA       LEU  44   7.017  -5.074  -5.183
  309   1HB   LEU  44          HB2       LEU  44   9.847  -4.046  -4.838
  310   2HB   LEU  44          HB3       LEU  44   8.639  -3.281  -5.790
  311    HG   LEU  44           HG       LEU  44   8.537  -3.588  -2.770
  312   1HD1  LEU  44          HD11      LEU  44   8.748  -1.184  -2.757
  313   2HD1  LEU  44          HD12      LEU  44  10.057  -1.834  -3.764
  314   3HD1  LEU  44          HD13      LEU  44   8.640  -1.100  -4.527
  315   1HD2  LEU  44          HD21      LEU  44   6.480  -2.181  -2.887
  316   2HD2  LEU  44          HD22      LEU  44   6.453  -2.394  -4.649
  317   3HD2  LEU  44          HD23      LEU  44   6.242  -3.789  -3.561
  318    HA   PRO  45           HA       PRO  45   8.298  -7.284  -8.734
  319   1HB   PRO  45          HB2       PRO  45   7.640  -5.535 -10.811
  320   2HB   PRO  45          HB3       PRO  45   6.499  -6.483  -9.857
  321   1HG   PRO  45          HG2       PRO  45   7.364  -3.594  -9.518
  322   2HG   PRO  45          HG3       PRO  45   5.710  -4.251  -9.434
  323   1HD   PRO  45          HD2       PRO  45   7.216  -3.692  -7.199
  324   2HD   PRO  45          HD3       PRO  45   6.019  -5.028  -7.252
  325    H    ALA  46           H        ALA  46   9.316  -6.845 -10.961
  326    HA   ALA  46           HA       ALA  46  12.081  -6.039 -10.615
  327   1HB   ALA  46          HB1       ALA  46  12.296  -6.857 -12.964
  328   2HB   ALA  46          HB2       ALA  46  11.428  -8.030 -11.964
  329   3HB   ALA  46          HB3       ALA  46  10.535  -6.975 -13.089
  330    H    SER  47           H        SER  47  10.328  -3.845 -10.203
  331    HA   SER  47           HA       SER  47  11.369  -1.842 -11.951
  332   1HB   SER  47          HB2       SER  47   8.393  -2.381 -12.041
  333   2HB   SER  47          HB3       SER  47   9.189  -0.953 -12.723
  334    HG   SER  47           HG       SER  47  10.313  -3.302 -13.544
  335    H    GLY  48           H        GLY  48  11.809  -0.261 -10.437
  336   1HA   GLY  48          HA2       GLY  48  10.372   1.153  -8.687
  337   2HA   GLY  48          HA3       GLY  48  10.435  -0.397  -7.833
  338    H    ILE  49           H        ILE  49  11.763   0.240  -6.181
  339    HA   ILE  49           HA       ILE  49  14.633   0.595  -6.887
  340    HB   ILE  49           HB       ILE  49  13.317   1.481  -4.316
  341   1HG1  ILE  49          HG12      ILE  49  12.297   2.927  -5.994
  342   2HG1  ILE  49          HG13      ILE  49  13.345   3.795  -4.898
  343   1HG2  ILE  49          HG21      ILE  49  15.397   2.795  -4.003
  344   2HG2  ILE  49          HG22      ILE  49  15.728   1.067  -4.165
  345   3HG2  ILE  49          HG23      ILE  49  16.034   2.145  -5.528
  346   1HD1  ILE  49          HD11      ILE  49  14.142   2.991  -7.720
  347   2HD1  ILE  49          HD12      ILE  49  13.541   4.583  -7.230
  348   3HD1  ILE  49          HD13      ILE  49  15.083   3.998  -6.588
  349    H    TRP  50           H        TRP  50  15.896  -1.029  -5.985
  350    HA   TRP  50           HA       TRP  50  14.687  -2.867  -3.952
  351   1HB   TRP  50          HB2       TRP  50  16.440  -3.394  -6.380
  352   2HB   TRP  50          HB3       TRP  50  16.517  -4.431  -4.989
  353    HD1  TRP  50           HD1      TRP  50  13.056  -3.262  -6.212
  354    HE1  TRP  50           HE1      TRP  50  11.812  -5.179  -7.327
  355    HE3  TRP  50           HE3      TRP  50  16.806  -6.741  -6.125
  356    HZ2  TRP  50           HZ2      TRP  50  12.378  -7.923  -8.069
  357    HZ3  TRP  50           HZ3      TRP  50  16.409  -9.018  -7.025
  358    HH2  TRP  50           HH2      TRP  50  14.203  -9.619  -7.991
  359    H    LEU  51           H        LEU  51  15.959  -3.044  -2.099
  360    HA   LEU  51           HA       LEU  51  18.789  -2.110  -2.238
  361   1HB   LEU  51          HB2       LEU  51  16.716  -1.468  -0.105
  362   2HB   LEU  51          HB3       LEU  51  18.451  -1.291   0.134
  363    HG   LEU  51           HG       LEU  51  16.752   0.272  -1.861
  364   1HD1  LEU  51          HD11      LEU  51  18.216   1.238   0.635
  365   2HD1  LEU  51          HD12      LEU  51  17.122   2.161  -0.406
  366   3HD1  LEU  51          HD13      LEU  51  16.501   0.834   0.592
  367   1HD2  LEU  51          HD21      LEU  51  19.748   0.423  -1.271
  368   2HD2  LEU  51          HD22      LEU  51  18.973   0.048  -2.825
  369   3HD2  LEU  51          HD23      LEU  51  18.832   1.665  -2.147
  370    H    VAL  52           H        VAL  52  20.162  -3.537  -1.254
  371    HA   VAL  52           HA       VAL  52  18.907  -5.895   0.086
  372    HB   VAL  52           HB       VAL  52  21.410  -5.803  -1.637
  373   1HG1  VAL  52          HG11      VAL  52  21.220  -8.284  -1.596
  374   2HG1  VAL  52          HG12      VAL  52  21.478  -7.627   0.022
  375   3HG1  VAL  52          HG13      VAL  52  19.861  -8.150  -0.461
  376   1HG2  VAL  52          HG21      VAL  52  18.594  -6.780  -2.285
  377   2HG2  VAL  52          HG22      VAL  52  19.445  -5.437  -3.066
  378   3HG2  VAL  52          HG23      VAL  52  20.025  -7.085  -3.295
  379    H    ILE  53           H        ILE  53  19.788  -6.599   2.006
  380    HA   ILE  53           HA       ILE  53  21.952  -4.937   3.198
  381    HB   ILE  53           HB       ILE  53  19.487  -5.823   4.743
  382   1HG1  ILE  53          HG12      ILE  53  18.948  -3.237   4.645
  383   2HG1  ILE  53          HG13      ILE  53  19.793  -3.292   3.103
  384   1HG2  ILE  53          HG21      ILE  53  21.578  -3.655   5.243
  385   2HG2  ILE  53          HG22      ILE  53  20.258  -4.126   6.337
  386   3HG2  ILE  53          HG23      ILE  53  21.561  -5.265   5.996
  387   1HD1  ILE  53          HD11      ILE  53  17.361  -3.545   2.837
  388   2HD1  ILE  53          HD12      ILE  53  18.127  -5.040   2.340
  389   3HD1  ILE  53          HD13      ILE  53  17.349  -4.941   3.931
  390    H    SER  54           H        SER  54  23.605  -6.293   3.679
  391    HA   SER  54           HA       SER  54  23.233  -8.691   5.224
  392   1HB   SER  54          HB2       SER  54  24.060  -8.910   2.289
  393   2HB   SER  54          HB3       SER  54  24.372 -10.181   3.481
  394    HG   SER  54           HG       SER  54  21.787  -9.177   3.341
  395    H    SER  55           H        SER  55  25.646  -9.800   5.222
  396    HA   SER  55           HA       SER  55  27.751  -7.723   4.938
  397   1HB   SER  55          HB2       SER  55  27.400  -9.611   7.309
  398   2HB   SER  55          HB3       SER  55  28.749  -8.489   7.051
  399    HG   SER  55           HG       SER  55  27.126  -7.665   8.473
  400    H    THR  56           H        THR  56  29.237  -8.562   3.558
  401    HA   THR  56           HA       THR  56  29.299 -11.493   3.109
  402    HB   THR  56           HB       THR  56  29.903 -10.678   0.753
  403    HG1  THR  56           HG1      THR  56  29.583  -8.652   0.267
  404   1HG2  THR  56          HG21      THR  56  27.620 -11.497   1.357
  405   2HG2  THR  56          HG22      THR  56  27.171  -9.841   1.824
  406   3HG2  THR  56          HG23      THR  56  27.587 -10.214   0.138
  407    H    HIS  57           H        HIS  57  31.228  -9.261   4.586
  408    HA   HIS  57           HA       HIS  57  33.563 -10.980   4.212
  409   1HB   HIS  57          HB2       HIS  57  33.918  -9.067   2.624
  410   2HB   HIS  57          HB3       HIS  57  33.695  -7.939   3.961
  411    HD1  HIS  57           HD1      HIS  57  35.944  -7.159   5.006
  412    HD2  HIS  57           HD2      HIS  57  36.141 -10.812   2.929
  413    HE1  HIS  57           HE1      HIS  57  38.363  -7.897   5.100
  414    H    GLY  58           H        GLY  58  34.781 -10.983   6.186
  415   1HA   GLY  58          HA2       GLY  58  35.287 -10.654   8.375
  416   2HA   GLY  58          HA3       GLY  58  34.347  -9.161   8.329
  417    H    ALA  59           H        ALA  59  31.800 -10.435   7.641
  418    HA   ALA  59           HA       ALA  59  31.107 -11.986  10.080
  419   1HB   ALA  59          HB1       ALA  59  29.344 -10.328  10.573
  420   2HB   ALA  59          HB2       ALA  59  30.944  -9.568  10.597
  421   3HB   ALA  59          HB3       ALA  59  29.873  -9.333   9.198
  422    H    GLY  60           H        GLY  60  31.274 -13.177   7.614
  423   1HA   GLY  60          HA2       GLY  60  28.472 -13.909   7.097
  424   2HA   GLY  60          HA3       GLY  60  29.385 -13.347   5.700
  425    H    ASP  61           H        ASP  61  29.217 -15.407   4.758
  426    HA   ASP  61           HA       ASP  61  31.052 -17.510   5.657
  427   1HB   ASP  61          HB2       ASP  61  29.017 -18.065   6.927
  428   2HB   ASP  61          HB3       ASP  61  28.044 -17.975   5.458
  429    H    ILE  62           H        ILE  62  31.994 -16.590   3.719
  430    HA   ILE  62           HA       ILE  62  30.762 -16.015   1.408
  431    HB   ILE  62           HB       ILE  62  32.868 -16.059   0.274
  432   1HG1  ILE  62          HG12      ILE  62  33.987 -17.558   2.679
  433   2HG1  ILE  62          HG13      ILE  62  33.779 -18.199   1.040
  434   1HG2  ILE  62          HG21      ILE  62  32.235 -14.277   1.943
  435   2HG2  ILE  62          HG22      ILE  62  33.265 -15.095   3.139
  436   3HG2  ILE  62          HG23      ILE  62  33.965 -14.428   1.655
  437   1HD1  ILE  62          HD11      ILE  62  35.703 -16.029   1.912
  438   2HD1  ILE  62          HD12      ILE  62  36.082 -17.647   1.313
  439   3HD1  ILE  62          HD13      ILE  62  35.382 -16.450   0.206
  440    HA   PRO  63           HA       PRO  63  31.159 -20.380  -0.607
  441   1HB   PRO  63          HB2       PRO  63  29.909 -21.900   1.684
  442   2HB   PRO  63          HB3       PRO  63  31.008 -22.494   0.399
  443   1HG   PRO  63          HG2       PRO  63  31.984 -21.981   2.866
  444   2HG   PRO  63          HG3       PRO  63  32.896 -21.417   1.424
  445   1HD   PRO  63          HD2       PRO  63  30.986 -19.856   3.169
  446   2HD   PRO  63          HD3       PRO  63  32.619 -19.389   2.626
  447    H    ASP  64           H        ASP  64  28.632 -19.231   1.674
  448    HA   ASP  64           HA       ASP  64  26.562 -19.328  -0.391
  449   1HB   ASP  64          HB2       ASP  64  26.725 -21.700   0.442
  450   2HB   ASP  64          HB3       ASP  64  26.326 -21.124   2.060
  451    H    ASN  65           H        ASN  65  27.673 -17.236   0.840
  452    HA   ASN  65           HA       ASN  65  26.970 -16.380   3.352
  453   1HB   ASN  65          HB2       ASN  65  28.568 -15.442   1.553
  454   2HB   ASN  65          HB3       ASN  65  27.207 -14.433   1.069
  455   1HD2  ASN  65          HD22      ASN  65  26.145 -13.582   3.526
  456   2HD2  ASN  65          HD21      ASN  65  27.439 -12.680   4.301
  457    H    LEU  66           H        LEU  66  24.900 -16.140   0.466
  458    HA   LEU  66           HA       LEU  66  22.693 -15.124   2.177
  459   1HB   LEU  66          HB2       LEU  66  23.338 -14.105  -0.631
  460   2HB   LEU  66          HB3       LEU  66  21.794 -13.992   0.198
  461    HG   LEU  66           HG       LEU  66  22.903 -12.628   2.009
  462   1HD1  LEU  66          HD11      LEU  66  25.101 -12.485  -0.101
  463   2HD1  LEU  66          HD12      LEU  66  24.905 -11.316   1.224
  464   3HD1  LEU  66          HD13      LEU  66  25.252 -13.002   1.585
  465   1HD2  LEU  66          HD21      LEU  66  21.379 -11.655   0.443
  466   2HD2  LEU  66          HD22      LEU  66  22.761 -10.566   0.550
  467   3HD2  LEU  66          HD23      LEU  66  22.590 -11.638  -0.850
  468    H    SER  67           H        SER  67  21.773 -17.155   2.344
  469    HA   SER  67           HA       SER  67  22.318 -19.182   0.395
  470   1HB   SER  67          HB2       SER  67  20.602 -20.331   2.138
  471   2HB   SER  67          HB3       SER  67  22.338 -20.140   2.417
  472    HG   SER  67           HG       SER  67  21.105 -19.444   4.185
  473    HA   PRO  68           HA       PRO  68  17.663 -19.024  -0.558
  474   1HB   PRO  68          HB2       PRO  68  16.142 -16.845   0.151
  475   2HB   PRO  68          HB3       PRO  68  16.405 -18.242   1.231
  476   1HG   PRO  68          HG2       PRO  68  17.857 -15.587   1.273
  477   2HG   PRO  68          HG3       PRO  68  17.194 -16.493   2.659
  478   1HD   PRO  68          HD2       PRO  68  19.775 -16.617   2.020
  479   2HD   PRO  68          HD3       PRO  68  18.917 -18.043   2.654
  480    H    PHE  69           H        PHE  69  19.313 -15.932  -0.335
  481    HA   PHE  69           HA       PHE  69  18.080 -14.670  -2.545
  482   1HB   PHE  69          HB2       PHE  69  19.834 -13.958  -0.580
  483   2HB   PHE  69          HB3       PHE  69  20.913 -13.916  -1.927
  484    HD1  PHE  69           HD1      PHE  69  18.770 -11.894  -0.058
  485    HD2  PHE  69           HD2      PHE  69  19.909 -12.720  -4.129
  486    HE1  PHE  69           HE1      PHE  69  18.038  -9.634  -0.727
  487    HE2  PHE  69           HE2      PHE  69  19.094 -10.477  -4.813
  488    HZ   PHE  69           HZ       PHE  69  18.140  -8.934  -3.115
  489    H    TYR  70           H        TYR  70  21.336 -16.022  -2.287
  490    HA   TYR  70           HA       TYR  70  22.060 -15.612  -4.937
  491   1HB   TYR  70          HB2       TYR  70  23.624 -16.163  -3.085
  492   2HB   TYR  70          HB3       TYR  70  23.107 -17.839  -3.197
  493    HD1  TYR  70           HD1      TYR  70  24.233 -15.108  -5.570
  494    HD2  TYR  70           HD2      TYR  70  24.607 -19.236  -4.364
  495    HE1  TYR  70           HE1      TYR  70  25.930 -15.463  -7.339
  496    HE2  TYR  70           HE2      TYR  70  26.312 -19.596  -6.117
  497    HH   TYR  70           HH       TYR  70  27.516 -18.650  -7.856
  498    H    GLU  71           H        GLU  71  20.684 -18.705  -3.590
  499    HA   GLU  71           HA       GLU  71  20.688 -20.020  -6.102
  500   1HB   GLU  71          HB2       GLU  71  18.854 -20.455  -3.702
  501   2HB   GLU  71          HB3       GLU  71  19.083 -21.564  -5.066
  502   1HG   GLU  71          HG2       GLU  71  21.598 -21.457  -4.444
  503   2HG   GLU  71          HG3       GLU  71  21.088 -20.773  -2.921
  504    H    ALA  72           H        ALA  72  18.057 -18.127  -4.455
  505    HA   ALA  72           HA       ALA  72  16.155 -18.599  -6.534
  506   1HB   ALA  72          HB1       ALA  72  15.590 -17.857  -4.218
  507   2HB   ALA  72          HB2       ALA  72  16.341 -16.277  -4.582
  508   3HB   ALA  72          HB3       ALA  72  14.878 -16.806  -5.455
  509    H    LEU  73           H        LEU  73  18.742 -16.142  -6.339
  510    HA   LEU  73           HA       LEU  73  17.810 -14.543  -8.524
  511   1HB   LEU  73          HB2       LEU  73  20.561 -15.220  -7.409
  512   2HB   LEU  73          HB3       LEU  73  20.374 -14.256  -8.847
  513    HG   LEU  73           HG       LEU  73  19.242 -13.530  -6.127
  514   1HD1  LEU  73          HD11      LEU  73  21.076 -11.904  -6.039
  515   2HD1  LEU  73          HD12      LEU  73  21.725 -13.534  -6.270
  516   3HD1  LEU  73          HD13      LEU  73  21.646 -12.414  -7.641
  517   1HD2  LEU  73          HD21      LEU  73  17.909 -12.492  -7.940
  518   2HD2  LEU  73          HD22      LEU  73  18.881 -11.294  -7.104
  519   3HD2  LEU  73          HD23      LEU  73  19.398 -11.888  -8.699
  520    H    GLN  74           H        GLN  74  20.233 -17.239  -8.501
  521    HA   GLN  74           HA       GLN  74  20.383 -17.197 -11.348
  522   1HB   GLN  74          HB2       GLN  74  21.247 -19.525  -9.604
  523   2HB   GLN  74          HB3       GLN  74  21.840 -19.073 -11.206
  524   1HG   GLN  74          HG2       GLN  74  22.601 -16.872 -10.145
  525   2HG   GLN  74          HG3       GLN  74  22.188 -17.589  -8.594
  526   1HE2  GLN  74          HE21      GLN  74  24.552 -17.289 -10.997
  527   2HE2  GLN  74          HE22      GLN  74  25.736 -18.434 -10.353
  528    H    GLU  75           H        GLU  75  18.159 -18.716  -9.276
  529    HA   GLU  75           HA       GLU  75  17.332 -20.856 -10.934
  530   1HB   GLU  75          HB2       GLU  75  16.796 -20.661  -8.545
  531   2HB   GLU  75          HB3       GLU  75  15.748 -19.281  -8.892
  532   1HG   GLU  75          HG2       GLU  75  14.223 -20.719 -10.171
  533   2HG   GLU  75          HG3       GLU  75  15.328 -22.087  -9.998
  534    H    GLN  76           H        GLN  76  16.419 -17.441 -10.898
  535    HA   GLN  76           HA       GLN  76  14.680 -17.901 -13.293
  536   1HB   GLN  76          HB2       GLN  76  13.256 -16.010 -12.327
  537   2HB   GLN  76          HB3       GLN  76  13.112 -17.607 -11.603
  538   1HG   GLN  76          HG2       GLN  76  14.141 -17.004  -9.632
  539   2HG   GLN  76          HG3       GLN  76  15.091 -15.716 -10.372
  540   1HE2  GLN  76          HE22      GLN  76  14.476 -14.470  -8.485
  541   2HE2  GLN  76          HE21      GLN  76  13.007 -13.507  -8.587
  542    H    LYS  77           H        LYS  77  17.152 -15.862 -11.939
  543    HA   LYS  77           HA       LYS  77  17.892 -13.747 -12.465
  544   1HB   LYS  77          HB2       LYS  77  18.266 -15.310 -15.014
  545   2HB   LYS  77          HB3       LYS  77  19.106 -13.800 -14.622
  546   1HG   LYS  77          HG2       LYS  77  20.039 -14.837 -12.608
  547   2HG   LYS  77          HG3       LYS  77  19.230 -16.363 -12.982
  548   1HD   LYS  77          HD2       LYS  77  21.280 -15.078 -14.815
  549   2HD   LYS  77          HD3       LYS  77  21.685 -16.260 -13.559
  550   1HE   LYS  77          HE2       LYS  77  20.133 -17.871 -14.620
  551   2HE   LYS  77          HE3       LYS  77  19.761 -16.705 -15.893
  552   1HZ   LYS  77          HZ1       LYS  77  22.092 -16.801 -16.569
  553   2HZ   LYS  77          HZ2       LYS  77  22.440 -17.876 -15.385
  554   3HZ   LYS  77          HZ3       LYS  77  21.440 -18.290 -16.601
  555    HA   PRO  78           HA       PRO  78  13.946 -12.488 -14.575
  556   1HB   PRO  78          HB2       PRO  78  13.081 -10.558 -12.753
  557   2HB   PRO  78          HB3       PRO  78  12.673 -12.286 -12.728
  558   1HG   PRO  78          HG2       PRO  78  14.786 -10.811 -11.169
  559   2HG   PRO  78          HG3       PRO  78  13.699 -12.104 -10.595
  560   1HD   PRO  78          HD2       PRO  78  16.316 -12.555 -11.290
  561   2HD   PRO  78          HD3       PRO  78  15.033 -13.771 -11.557
  562    H    ASP  79           H        ASP  79  13.119 -10.386 -15.300
  563    HA   ASP  79           HA       ASP  79  15.331  -8.944 -16.529
  564   1HB   ASP  79          HB2       ASP  79  13.440  -9.735 -17.871
  565   2HB   ASP  79          HB3       ASP  79  12.321  -8.746 -16.926
  566    H    LEU  80           H        LEU  80  15.903  -8.206 -14.300
  567    HA   LEU  80           HA       LEU  80  14.439  -6.065 -13.028
  568   1HB   LEU  80          HB2       LEU  80  17.293  -7.032 -12.821
  569   2HB   LEU  80          HB3       LEU  80  16.696  -5.716 -11.876
  570    HG   LEU  80           HG       LEU  80  16.202  -6.992 -10.236
  571   1HD1  LEU  80          HD11      LEU  80  14.290  -8.544 -10.265
  572   2HD1  LEU  80          HD12      LEU  80  13.943  -6.964 -10.948
  573   3HD1  LEU  80          HD13      LEU  80  14.180  -8.376 -12.024
  574   1HD2  LEU  80          HD21      LEU  80  16.661  -9.430 -11.966
  575   2HD2  LEU  80          HD22      LEU  80  17.889  -8.547 -11.023
  576   3HD2  LEU  80          HD23      LEU  80  16.578  -9.388 -10.192
  577    H    SER  81           H        SER  81  15.565  -5.714 -16.023
  578    HA   SER  81           HA       SER  81  17.458  -3.702 -16.117
  579   1HB   SER  81          HB2       SER  81  15.257  -4.509 -18.065
  580   2HB   SER  81          HB3       SER  81  16.856  -3.867 -18.422
  581    HG   SER  81           HG       SER  81  16.079  -6.386 -18.146
  582    H    ALA  82           H        ALA  82  14.397  -3.470 -14.880
  583    HA   ALA  82           HA       ALA  82  14.054  -0.607 -15.639
  584   1HB   ALA  82          HB1       ALA  82  11.613  -0.962 -15.415
  585   2HB   ALA  82          HB2       ALA  82  12.307  -1.966 -16.702
  586   3HB   ALA  82          HB3       ALA  82  11.895  -2.694 -15.134
  587    H    VAL  83           H        VAL  83  15.221  -2.488 -13.221
  588    HA   VAL  83           HA       VAL  83  14.254  -0.490 -11.240
  589    HB   VAL  83           HB       VAL  83  13.145  -2.385 -10.561
  590   1HG1  VAL  83          HG11      VAL  83  14.193  -4.166 -11.813
  591   2HG1  VAL  83          HG12      VAL  83  15.679  -4.010 -10.840
  592   3HG1  VAL  83          HG13      VAL  83  14.173  -4.600 -10.100
  593   1HG2  VAL  83          HG21      VAL  83  13.870  -2.858  -8.415
  594   2HG2  VAL  83          HG22      VAL  83  15.587  -2.622  -8.795
  595   3HG2  VAL  83          HG23      VAL  83  14.483  -1.243  -8.708
  596    H    ARG  84           H        ARG  84  15.659   0.281  -9.728
  597    HA   ARG  84           HA       ARG  84  18.536  -0.127 -10.354
  598   1HB   ARG  84          HB2       ARG  84  18.995   1.951  -9.149
  599   2HB   ARG  84          HB3       ARG  84  17.981   2.190 -10.570
  600   1HG   ARG  84          HG2       ARG  84  15.975   2.343  -9.121
  601   2HG   ARG  84          HG3       ARG  84  16.988   2.173  -7.680
  602   1HD   ARG  84          HD2       ARG  84  17.431   4.337  -9.769
  603   2HD   ARG  84          HD3       ARG  84  16.299   4.554  -8.441
  604    HE   ARG  84           HE       ARG  84  18.533   3.862  -7.072
  605   1HH1  ARG  84          HH11      ARG  84  18.066   6.208  -9.697
  606   2HH1  ARG  84          HH12      ARG  84  19.204   7.346  -9.093
  607   1HH2  ARG  84          HH21      ARG  84  19.925   5.491  -6.148
  608   2HH2  ARG  84          HH22      ARG  84  20.323   6.896  -7.055
  609    H    PHE  85           H        PHE  85  19.878  -0.738  -8.790
  610    HA   PHE  85           HA       PHE  85  18.689  -2.034  -6.373
  611   1HB   PHE  85          HB2       PHE  85  19.289  -3.803  -7.673
  612   2HB   PHE  85          HB3       PHE  85  20.498  -2.905  -8.571
  613    HD1  PHE  85           HD1      PHE  85  22.611  -3.753  -8.483
  614    HD2  PHE  85           HD2      PHE  85  20.092  -4.108  -4.995
  615    HE1  PHE  85           HE1      PHE  85  24.431  -4.929  -7.281
  616    HE2  PHE  85           HE2      PHE  85  21.943  -5.239  -3.793
  617    HZ   PHE  85           HZ       PHE  85  24.102  -5.675  -4.938
  618    H    GLY  86           H        GLY  86  20.030  -1.934  -4.442
  619   1HA   GLY  86          HA2       GLY  86  22.604  -0.523  -4.596
  620   2HA   GLY  86          HA3       GLY  86  21.383   0.141  -3.492
  621    H    ALA  87           H        ALA  87  23.955  -1.144  -2.840
  622    HA   ALA  87           HA       ALA  87  23.089  -3.614  -1.393
  623   1HB   ALA  87          HB1       ALA  87  25.748  -2.838  -2.697
  624   2HB   ALA  87          HB2       ALA  87  25.535  -4.236  -1.631
  625   3HB   ALA  87          HB3       ALA  87  24.668  -4.163  -3.173
  626    H    ILE  88           H        ILE  88  23.383  -3.526   0.806
  627    HA   ILE  88           HA       ILE  88  24.787  -1.163   1.940
  628    HB   ILE  88           HB       ILE  88  22.110  -2.336   2.819
  629   1HG1  ILE  88          HG12      ILE  88  22.643   0.137   1.120
  630   2HG1  ILE  88          HG13      ILE  88  21.767  -1.312   0.657
  631   1HG2  ILE  88          HG21      ILE  88  22.107  -0.142   4.180
  632   2HG2  ILE  88          HG22      ILE  88  23.216  -1.402   4.692
  633   3HG2  ILE  88          HG23      ILE  88  23.820  -0.012   3.781
  634   1HD1  ILE  88          HD11      ILE  88  20.198   0.397   1.060
  635   2HD1  ILE  88          HD12      ILE  88  20.023  -0.802   2.356
  636   3HD1  ILE  88          HD13      ILE  88  20.839   0.762   2.656
  637    H    GLY  89           H        GLY  89  26.213  -1.679   3.478
  638   1HA   GLY  89          HA2       GLY  89  27.155  -2.755   5.321
  639   2HA   GLY  89          HA3       GLY  89  25.825  -3.928   5.325
  640    H    ILE  90           H        ILE  90  26.124  -4.612   2.533
  641    HA   ILE  90           HA       ILE  90  27.718  -6.806   2.437
  642    HB   ILE  90           HB       ILE  90  26.683  -4.920   0.316
  643   1HG1  ILE  90          HG12      ILE  90  25.842  -7.643   1.339
  644   2HG1  ILE  90          HG13      ILE  90  25.042  -6.129   1.698
  645   1HG2  ILE  90          HG21      ILE  90  27.764  -7.678  -0.332
  646   2HG2  ILE  90          HG22      ILE  90  27.134  -6.457  -1.446
  647   3HG2  ILE  90          HG23      ILE  90  28.667  -6.175  -0.641
  648   1HD1  ILE  90          HD11      ILE  90  24.324  -5.906  -0.643
  649   2HD1  ILE  90          HD12      ILE  90  25.113  -7.459  -1.037
  650   3HD1  ILE  90          HD13      ILE  90  23.765  -7.410   0.100
  651    H    GLY  91           H        GLY  91  29.780  -7.203   2.438
  652   1HA   GLY  91          HA2       GLY  91  31.644  -5.054   3.012
  653   2HA   GLY  91          HA3       GLY  91  31.915  -6.788   3.133
  654    H    SER  92           H        SER  92  31.127  -7.544   0.571
  655    HA   SER  92           HA       SER  92  33.473  -7.417  -0.924
  656   1HB   SER  92          HB2       SER  92  31.818  -8.211  -2.797
  657   2HB   SER  92          HB3       SER  92  32.173  -9.221  -1.392
  658    HG   SER  92           HG       SER  92  29.846  -7.977  -2.157
  659    H    ARG  93           H        ARG  93  34.387  -5.635  -1.650
  660    HA   ARG  93           HA       ARG  93  32.979  -3.724  -3.388
  661   1HB   ARG  93          HB2       ARG  93  34.205  -3.008  -0.672
  662   2HB   ARG  93          HB3       ARG  93  34.002  -1.813  -1.946
  663   1HG   ARG  93          HG2       ARG  93  31.592  -2.246  -2.000
  664   2HG   ARG  93          HG3       ARG  93  31.754  -3.334  -0.604
  665   1HD   ARG  93          HD2       ARG  93  32.321  -0.355  -0.693
  666   2HD   ARG  93          HD3       ARG  93  31.007  -1.154   0.167
  667    HE   ARG  93           HE       ARG  93  33.829  -0.956   0.934
  668   1HH1  ARG  93          HH11      ARG  93  30.798  -2.762   1.682
  669   2HH1  ARG  93          HH12      ARG  93  31.202  -2.902   3.344
  670   1HH2  ARG  93          HH21      ARG  93  34.346  -1.376   3.125
  671   2HH2  ARG  93          HH22      ARG  93  33.441  -2.570   3.969
  672    H    GLU  94           H        GLU  94  34.877  -1.943  -3.749
  673    HA   GLU  94           HA       GLU  94  37.109  -3.121  -5.049
  674   1HB   GLU  94          HB2       GLU  94  36.834  -0.355  -3.891
  675   2HB   GLU  94          HB3       GLU  94  37.895  -0.836  -5.225
  676   1HG   GLU  94          HG2       GLU  94  35.787  -1.431  -6.534
  677   2HG   GLU  94          HG3       GLU  94  34.835  -0.715  -5.227
  678    H    TYR  95           H        TYR  95  36.484  -2.435  -1.728
  679    HA   TYR  95           HA       TYR  95  39.138  -3.313  -0.804
  680   1HB   TYR  95          HB2       TYR  95  39.081  -1.464   0.913
  681   2HB   TYR  95          HB3       TYR  95  39.257  -0.869  -0.720
  682    HD1  TYR  95           HD1      TYR  95  37.065  -0.911   2.249
  683    HD2  TYR  95           HD2      TYR  95  37.421   0.320  -1.864
  684    HE1  TYR  95           HE1      TYR  95  35.094   0.589   2.519
  685    HE2  TYR  95           HE2      TYR  95  35.411   1.737  -1.633
  686    HH   TYR  95           HH       TYR  95  33.773   2.509  -0.214
  687    H    ASP  96           H        ASP  96  38.688  -3.327   1.891
  688    HA   ASP  96           HA       ASP  96  37.845  -4.737   3.462
  689   1HB   ASP  96          HB2       ASP  96  36.299  -2.846   3.595
  690   2HB   ASP  96          HB3       ASP  96  35.235  -3.635   2.426
  691    H    THR  97           H        THR  97  38.624  -6.038   1.311
  692    HA   THR  97           HA       THR  97  36.948  -8.431   0.983
  693    HB   THR  97           HB       THR  97  37.829  -6.631  -1.291
  694    HG1  THR  97           HG1      THR  97  36.021  -5.800  -0.348
  695   1HG2  THR  97          HG21      THR  97  37.863  -8.995  -1.990
  696   2HG2  THR  97          HG22      THR  97  36.200  -9.200  -1.388
  697   3HG2  THR  97          HG23      THR  97  36.543  -8.115  -2.764
  698    H    PHE  98           H        PHE  98  38.866  -8.785   2.515
  699    HA   PHE  98           HA       PHE  98  41.463  -9.073   1.050
  700   1HB   PHE  98          HB2       PHE  98  41.072  -8.209   3.925
  701   2HB   PHE  98          HB3       PHE  98  42.588  -8.283   3.041
  702    HD1  PHE  98           HD1      PHE  98  40.542  -5.983   4.425
  703    HD2  PHE  98           HD2      PHE  98  42.194  -6.895   0.541
  704    HE1  PHE  98           HE1      PHE  98  40.383  -3.594   3.792
  705    HE2  PHE  98           HE2      PHE  98  41.999  -4.510  -0.097
  706    HZ   PHE  98           HZ       PHE  98  41.120  -2.847   1.530
  707    H    CYS  99           H        CYS  99  39.170 -10.694   3.162
  708    HA   CYS  99           HA       CYS  99  40.992 -13.026   3.100
  709   1HB   CYS  99          HB2       CYS  99  40.441 -13.619   5.403
  710   2HB   CYS  99          HB3       CYS  99  41.192 -12.022   5.341
  711    HG   CYS  99           HG       CYS  99  38.760 -10.759   5.242
  712    H    GLY 100           H        GLY 100  38.545 -12.025   1.630
  713   1HA   GLY 100          HA2       GLY 100  37.500 -14.449   0.837
  714   2HA   GLY 100          HA3       GLY 100  36.399 -13.871   2.109
  715    H    ALA 101           H        ALA 101  35.475 -14.163  -0.488
  716    HA   ALA 101           HA       ALA 101  34.398 -11.519  -0.903
  717   1HB   ALA 101          HB1       ALA 101  35.873 -12.923  -3.194
  718   2HB   ALA 101          HB2       ALA 101  34.900 -11.444  -3.331
  719   3HB   ALA 101          HB3       ALA 101  36.410 -11.427  -2.402
  720    H    ILE 102           H        ILE 102  32.370 -11.708  -1.937
  721    HA   ILE 102           HA       ILE 102  31.555 -14.152  -3.273
  722    HB   ILE 102           HB       ILE 102  31.200 -14.604  -0.885
  723   1HG1  ILE 102          HG12      ILE 102  29.914 -15.857  -2.463
  724   2HG1  ILE 102          HG13      ILE 102  29.133 -15.637  -0.909
  725   1HG2  ILE 102          HG21      ILE 102  30.739 -12.438  -0.032
  726   2HG2  ILE 102          HG22      ILE 102  29.164 -12.377  -0.867
  727   3HG2  ILE 102          HG23      ILE 102  29.466 -13.557   0.425
  728   1HD1  ILE 102          HD11      ILE 102  27.428 -15.557  -2.513
  729   2HD1  ILE 102          HD12      ILE 102  27.646 -13.887  -1.966
  730   3HD1  ILE 102          HD13      ILE 102  28.301 -14.428  -3.545
  731    H    ASP 103           H        ASP 103  32.291 -11.710  -4.202
  732    HA   ASP 103           HA       ASP 103  30.331  -9.711  -4.586
  733   1HB   ASP 103          HB2       ASP 103  32.665  -9.375  -5.118
  734   2HB   ASP 103          HB3       ASP 103  32.648 -10.698  -6.282
  735    H    LYS 104           H        LYS 104  30.580 -12.915  -5.961
  736    HA   LYS 104           HA       LYS 104  29.154 -12.695  -8.336
  737   1HB   LYS 104          HB2       LYS 104  29.053 -14.981  -6.336
  738   2HB   LYS 104          HB3       LYS 104  28.532 -15.052  -8.021
  739   1HG   LYS 104          HG2       LYS 104  30.885 -14.427  -8.670
  740   2HG   LYS 104          HG3       LYS 104  31.351 -14.548  -6.976
  741   1HD   LYS 104          HD2       LYS 104  31.981 -16.618  -7.982
  742   2HD   LYS 104          HD3       LYS 104  30.581 -16.934  -6.965
  743   1HE   LYS 104          HE2       LYS 104  30.283 -18.170  -8.987
  744   2HE   LYS 104          HE3       LYS 104  29.114 -16.851  -9.011
  745   1HZ   LYS 104          HZ1       LYS 104  31.695 -16.886 -10.478
  746   2HZ   LYS 104          HZ2       LYS 104  30.228 -17.121 -11.140
  747   3HZ   LYS 104          HZ3       LYS 104  30.610 -15.661 -10.528
  748    H    LEU 105           H        LEU 105  27.838 -12.501  -5.033
  749    HA   LEU 105           HA       LEU 105  25.104 -13.003  -5.679
  750   1HB   LEU 105          HB2       LEU 105  26.048 -12.895  -3.398
  751   2HB   LEU 105          HB3       LEU 105  26.385 -11.186  -3.575
  752    HG   LEU 105           HG       LEU 105  24.463 -11.693  -2.161
  753   1HD1  LEU 105          HD11      LEU 105  24.522  -9.519  -3.446
  754   2HD1  LEU 105          HD12      LEU 105  23.356 -10.247  -4.581
  755   3HD1  LEU 105          HD13      LEU 105  22.931 -10.051  -2.881
  756   1HD2  LEU 105          HD21      LEU 105  23.643 -13.717  -3.278
  757   2HD2  LEU 105          HD22      LEU 105  22.347 -12.522  -3.083
  758   3HD2  LEU 105          HD23      LEU 105  23.104 -12.741  -4.665
  759    H    GLU 106           H        GLU 106  26.986  -9.976  -5.524
  760    HA   GLU 106           HA       GLU 106  24.863  -8.241  -6.380
  761   1HB   GLU 106          HB2       GLU 106  27.886  -7.802  -6.471
  762   2HB   GLU 106          HB3       GLU 106  26.645  -6.561  -6.487
  763   1HG   GLU 106          HG2       GLU 106  26.044  -6.971  -4.210
  764   2HG   GLU 106          HG3       GLU 106  26.948  -8.473  -4.126
  765    H    ALA 107           H        ALA 107  27.529  -9.995  -7.929
  766    HA   ALA 107           HA       ALA 107  27.395  -8.768 -10.481
  767   1HB   ALA 107          HB1       ALA 107  28.163 -11.661  -9.934
  768   2HB   ALA 107          HB2       ALA 107  28.648 -10.654 -11.302
  769   3HB   ALA 107          HB3       ALA 107  29.258 -10.275  -9.679
  770    H    GLU 108           H        GLU 108  25.711 -11.776  -9.221
  771    HA   GLU 108           HA       GLU 108  24.397 -12.282 -11.690
  772   1HB   GLU 108          HB2       GLU 108  23.869 -13.117  -8.838
  773   2HB   GLU 108          HB3       GLU 108  22.880 -13.653 -10.187
  774   1HG   GLU 108          HG2       GLU 108  25.871 -14.162  -9.906
  775   2HG   GLU 108          HG3       GLU 108  24.582 -15.315  -9.590
  776    H    LEU 109           H        LEU 109  23.438 -10.212  -8.906
  777    HA   LEU 109           HA       LEU 109  20.800  -9.619  -9.837
  778   1HB   LEU 109          HB2       LEU 109  22.860  -8.272  -8.081
  779   2HB   LEU 109          HB3       LEU 109  21.523  -7.284  -8.649
  780    HG   LEU 109           HG       LEU 109  21.108  -9.939  -7.260
  781   1HD1  LEU 109          HD11      LEU 109  21.110  -7.162  -6.014
  782   2HD1  LEU 109          HD12      LEU 109  20.723  -8.683  -5.182
  783   3HD1  LEU 109          HD13      LEU 109  22.364  -8.394  -5.774
  784   1HD2  LEU 109          HD21      LEU 109  18.845  -8.930  -6.769
  785   2HD2  LEU 109          HD22      LEU 109  19.285  -7.521  -7.745
  786   3HD2  LEU 109          HD23      LEU 109  19.125  -9.117  -8.504
  787    H    LYS 110           H        LYS 110  23.929  -7.971 -10.476
  788    HA   LYS 110           HA       LYS 110  22.780  -5.953 -12.130
  789   1HB   LYS 110          HB2       LYS 110  25.637  -6.971 -11.804
  790   2HB   LYS 110          HB3       LYS 110  25.200  -5.472 -12.640
  791   1HG   LYS 110          HG2       LYS 110  24.343  -4.472 -10.624
  792   2HG   LYS 110          HG3       LYS 110  24.328  -5.965  -9.758
  793   1HD   LYS 110          HD2       LYS 110  26.154  -5.029  -8.804
  794   2HD   LYS 110          HD3       LYS 110  26.924  -6.001 -10.046
  795   1HE   LYS 110          HE2       LYS 110  27.325  -4.086 -11.444
  796   2HE   LYS 110          HE3       LYS 110  26.186  -3.087 -10.536
  797   1HZ   LYS 110          HZ1       LYS 110  27.689  -3.124  -8.647
  798   2HZ   LYS 110          HZ2       LYS 110  28.751  -4.092  -9.449
  799   3HZ   LYS 110          HZ3       LYS 110  28.483  -2.573  -9.968
  800    H    ASN 111           H        ASN 111  24.163  -9.139 -12.798
  801    HA   ASN 111           HA       ASN 111  24.082  -9.034 -15.664
  802   1HB   ASN 111          HB2       ASN 111  25.377 -10.769 -15.041
  803   2HB   ASN 111          HB3       ASN 111  24.602 -10.985 -13.507
  804   1HD2  ASN 111          HD21      ASN 111  22.692 -12.257 -13.244
  805   2HD2  ASN 111          HD22      ASN 111  22.478 -13.593 -14.335
  806    H    SER 112           H        SER 112  21.694  -9.946 -13.146
  807    HA   SER 112           HA       SER 112  19.769 -11.001 -14.980
  808   1HB   SER 112          HB2       SER 112  19.353  -9.825 -12.231
  809   2HB   SER 112          HB3       SER 112  18.171 -10.774 -13.146
  810    HG   SER 112           HG       SER 112  20.673 -11.603 -12.112
  811    H    GLY 113           H        GLY 113  20.387  -7.725 -13.655
  812   1HA   GLY 113          HA2       GLY 113  20.027  -6.338 -15.900
  813   2HA   GLY 113          HA3       GLY 113  18.339  -6.544 -15.431
  814    H    ALA 114           H        ALA 114  19.432  -6.310 -12.394
  815    HA   ALA 114           HA       ALA 114  18.388  -3.669 -12.327
  816   1HB   ALA 114          HB1       ALA 114  18.137  -5.274 -10.394
  817   2HB   ALA 114          HB2       ALA 114  19.861  -5.021 -10.037
  818   3HB   ALA 114          HB3       ALA 114  18.699  -3.660  -9.986
  819    H    LYS 115           H        LYS 115  19.352  -1.684 -12.136
  820    HA   LYS 115           HA       LYS 115  22.256  -1.635 -12.807
  821   1HB   LYS 115          HB2       LYS 115  21.923   0.792 -13.169
  822   2HB   LYS 115          HB3       LYS 115  21.001  -0.255 -14.240
  823   1HG   LYS 115          HG2       LYS 115  18.933   0.203 -12.912
  824   2HG   LYS 115          HG3       LYS 115  19.871   1.258 -11.848
  825   1HD   LYS 115          HD2       LYS 115  18.681   2.626 -13.393
  826   2HD   LYS 115          HD3       LYS 115  20.406   2.729 -13.769
  827   1HE   LYS 115          HE2       LYS 115  20.093   1.103 -15.631
  828   2HE   LYS 115          HE3       LYS 115  18.378   0.961 -15.224
  829   1HZ   LYS 115          HZ1       LYS 115  18.123   3.311 -15.783
  830   2HZ   LYS 115          HZ2       LYS 115  19.711   3.442 -16.153
  831   3HZ   LYS 115          HZ3       LYS 115  18.738   2.497 -17.051
  832    H    GLN 116           H        GLN 116  23.652  -1.641 -11.054
  833    HA   GLN 116           HA       GLN 116  22.672  -0.922  -8.431
  834   1HB   GLN 116          HB2       GLN 116  24.629  -2.431  -8.677
  835   2HB   GLN 116          HB3       GLN 116  25.567  -1.051  -9.284
  836   1HG   GLN 116          HG2       GLN 116  25.068   0.189  -7.164
  837   2HG   GLN 116          HG3       GLN 116  24.148  -1.194  -6.576
  838   1HE2  GLN 116          HE22      GLN 116  26.138  -0.102  -5.052
  839   2HE2  GLN 116          HE21      GLN 116  27.412  -1.294  -4.859
  840    H    THR 117           H        THR 117  22.056   1.167  -7.976
  841    HA   THR 117           HA       THR 117  23.886   3.315  -8.888
  842    HB   THR 117           HB       THR 117  20.893   3.655  -8.607
  843    HG1  THR 117           HG1      THR 117  21.362   2.350 -10.402
  844   1HG2  THR 117          HG21      THR 117  22.454   5.622  -8.224
  845   2HG2  THR 117          HG22      THR 117  23.143   5.359  -9.824
  846   3HG2  THR 117          HG23      THR 117  21.436   5.849  -9.674
  847    H    GLY 118           H        GLY 118  24.840   3.973  -7.167
  848   1HA   GLY 118          HA2       GLY 118  24.705   4.945  -4.896
  849   2HA   GLY 118          HA3       GLY 118  23.625   3.625  -4.449
  850    H    GLU 119           H        GLU 119  26.693   4.641  -4.816
  851    HA   GLU 119           HA       GLU 119  28.253   2.233  -5.010
  852   1HB   GLU 119          HB2       GLU 119  29.962   3.516  -3.674
  853   2HB   GLU 119          HB3       GLU 119  29.492   4.215  -5.208
  854   1HG   GLU 119          HG2       GLU 119  28.113   5.199  -2.732
  855   2HG   GLU 119          HG3       GLU 119  29.773   5.674  -3.039
  856    H    THR 120           H        THR 120  28.775   0.762  -3.518
  857    HA   THR 120           HA       THR 120  26.852  -0.123  -1.868
  858    HB   THR 120           HB       THR 120  29.803  -0.729  -1.665
  859    HG1  THR 120           HG1      THR 120  29.309  -2.207  -3.307
  860   1HG2  THR 120          HG21      THR 120  29.013  -3.021  -1.044
  861   2HG2  THR 120          HG22      THR 120  28.532  -1.812   0.161
  862   3HG2  THR 120          HG23      THR 120  27.344  -2.419  -1.003
  863    H    LEU 121           H        LEU 121  26.026   0.318  -0.003
  864    HA   LEU 121           HA       LEU 121  26.959   2.694   1.413
  865   1HB   LEU 121          HB2       LEU 121  24.596   2.013   0.463
  866   2HB   LEU 121          HB3       LEU 121  24.456   1.040   1.901
  867    HG   LEU 121           HG       LEU 121  25.211   3.904   2.314
  868   1HD1  LEU 121          HD11      LEU 121  22.392   3.078   1.470
  869   2HD1  LEU 121          HD12      LEU 121  22.893   4.697   2.001
  870   3HD1  LEU 121          HD13      LEU 121  23.511   4.040   0.488
  871   1HD2  LEU 121          HD21      LEU 121  24.743   2.317   4.221
  872   2HD2  LEU 121          HD22      LEU 121  23.774   3.788   4.215
  873   3HD2  LEU 121          HD23      LEU 121  23.053   2.259   3.681
  874    H    LYS 122           H        LYS 122  27.120   2.637   3.822
  875    HA   LYS 122           HA       LYS 122  27.708  -0.067   4.943
  876   1HB   LYS 122          HB2       LYS 122  29.390   2.451   5.076
  877   2HB   LYS 122          HB3       LYS 122  29.622   1.096   6.165
  878   1HG   LYS 122          HG2       LYS 122  30.399  -0.331   4.503
  879   2HG   LYS 122          HG3       LYS 122  29.702   0.585   3.172
  880   1HD   LYS 122          HD2       LYS 122  31.948   1.652   4.922
  881   2HD   LYS 122          HD3       LYS 122  32.242   0.752   3.439
  882   1HE   LYS 122          HE2       LYS 122  30.550   3.294   3.529
  883   2HE   LYS 122          HE3       LYS 122  32.291   3.302   3.260
  884   1HZ   LYS 122          HZ1       LYS 122  30.364   1.899   1.470
  885   2HZ   LYS 122          HZ2       LYS 122  31.031   3.353   1.201
  886   3HZ   LYS 122          HZ3       LYS 122  32.003   2.043   1.267
  887    H    ILE 123           H        ILE 123  27.191  -0.234   7.101
  888    HA   ILE 123           HA       ILE 123  25.597   1.950   8.310
  889    HB   ILE 123           HB       ILE 123  24.016  -0.056   8.946
  890   1HG1  ILE 123          HG12      ILE 123  23.676  -1.701   7.153
  891   2HG1  ILE 123          HG13      ILE 123  25.118  -1.173   6.321
  892   1HG2  ILE 123          HG21      ILE 123  23.286   1.846   7.660
  893   2HG2  ILE 123          HG22      ILE 123  24.010   1.184   6.175
  894   3HG2  ILE 123          HG23      ILE 123  22.637   0.375   6.960
  895   1HD1  ILE 123          HD11      ILE 123  25.106  -2.358   9.137
  896   2HD1  ILE 123          HD12      ILE 123  25.348  -3.295   7.649
  897   3HD1  ILE 123          HD13      ILE 123  26.522  -2.054   8.097
  898    H    ASN 124           H        ASN 124  25.042   1.634  10.466
  899    HA   ASN 124           HA       ASN 124  25.404   1.576  12.566
  900   1HB   ASN 124          HB2       ASN 124  25.295  -0.347  13.612
  901   2HB   ASN 124          HB3       ASN 124  25.161  -1.025  12.004
  902   1HD2  ASN 124          HD22      ASN 124  27.568  -1.461  11.010
  903   2HD2  ASN 124          HD21      ASN 124  28.443  -2.561  12.083
  904    H    ILE 125           H        ILE 125  26.690   2.242  14.178
  905    HA   ILE 125           HA       ILE 125  29.609   2.242  13.857
  906    HB   ILE 125           HB       ILE 125  28.678   4.082  12.469
  907   1HG1  ILE 125          HG12      ILE 125  30.027   5.931  13.152
  908   2HG1  ILE 125          HG13      ILE 125  30.213   5.308  14.780
  909   1HG2  ILE 125          HG21      ILE 125  27.640   6.068  13.492
  910   2HG2  ILE 125          HG22      ILE 125  26.644   4.630  13.710
  911   3HG2  ILE 125          HG23      ILE 125  27.612   5.259  15.063
  912   1HD1  ILE 125          HD11      ILE 125  31.209   3.925  12.251
  913   2HD1  ILE 125          HD12      ILE 125  32.203   4.922  13.332
  914   3HD1  ILE 125          HD13      ILE 125  31.522   3.398  13.924
  915    H    LEU 126           H        LEU 126  27.264   1.409  15.819
  916    HA   LEU 126           HA       LEU 126  27.491   2.985  18.172
  917   1HB   LEU 126          HB2       LEU 126  25.610   1.461  17.656
  918   2HB   LEU 126          HB3       LEU 126  26.691   0.070  17.782
  919    HG   LEU 126           HG       LEU 126  27.021   0.513  20.195
  920   1HD1  LEU 126          HD11      LEU 126  25.025   2.791  19.783
  921   2HD1  LEU 126          HD12      LEU 126  25.555   2.162  21.358
  922   3HD1  LEU 126          HD13      LEU 126  26.719   2.955  20.299
  923   1HD2  LEU 126          HD21      LEU 126  24.092   0.413  19.370
  924   2HD2  LEU 126          HD22      LEU 126  25.208  -0.968  19.442
  925   3HD2  LEU 126          HD23      LEU 126  24.767  -0.115  20.928
  926    H    ASP 127           H        ASP 127  29.466   0.396  16.870
  927    HA   ASP 127           HA       ASP 127  31.555   0.817  18.845
  928   1HB   ASP 127          HB2       ASP 127  30.161  -1.002  19.858
  929   2HB   ASP 127          HB3       ASP 127  30.329  -1.937  18.372
  930    H    HIS 128           H        HIS 128  33.524  -0.466  17.976
  931    HA   HIS 128           HA       HIS 128  33.921  -0.034  15.173
  932   1HB   HIS 128          HB2       HIS 128  36.034  -1.060  15.455
  933   2HB   HIS 128          HB3       HIS 128  35.746  -0.098  16.894
  934    HD1  HIS 128           HD1      HIS 128  34.578  -1.925  19.012
  935    HD2  HIS 128           HD2      HIS 128  37.080  -3.344  15.922
  936    HE1  HIS 128           HE1      HIS 128  35.546  -4.127  19.824
  937    H    ASP 129           H        ASP 129  34.121  -1.640  13.477
  938    HA   ASP 129           HA       ASP 129  32.937  -4.260  13.897
  939   1HB   ASP 129          HB2       ASP 129  31.007  -2.522  13.696
  940   2HB   ASP 129          HB3       ASP 129  31.398  -2.313  12.090
  941    H    ILE 130           H        ILE 130  32.068  -3.384  11.044
  942    HA   ILE 130           HA       ILE 130  34.590  -3.920   9.527
  943    HB   ILE 130           HB       ILE 130  32.096  -5.644   9.382
  944   1HG1  ILE 130          HG12      ILE 130  33.686  -6.326  11.119
  945   2HG1  ILE 130          HG13      ILE 130  33.469  -7.513   9.858
  946   1HG2  ILE 130          HG21      ILE 130  34.416  -5.541   7.423
  947   2HG2  ILE 130          HG22      ILE 130  33.237  -6.864   7.521
  948   3HG2  ILE 130          HG23      ILE 130  32.703  -5.246   7.078
  949   1HD1  ILE 130          HD11      ILE 130  35.882  -5.657  10.070
  950   2HD1  ILE 130          HD12      ILE 130  35.816  -7.352  10.577
  951   3HD1  ILE 130          HD13      ILE 130  35.651  -6.944   8.864
  952    HA   PRO 131           HA       PRO 131  31.591  -1.647   6.563
  953   1HB   PRO 131          HB2       PRO 131  29.039  -0.999   7.384
  954   2HB   PRO 131          HB3       PRO 131  29.447  -2.484   6.470
  955   1HG   PRO 131          HG2       PRO 131  29.126  -2.178   9.476
  956   2HG   PRO 131          HG3       PRO 131  28.420  -3.425   8.419
  957   1HD   PRO 131          HD2       PRO 131  30.652  -3.917   9.819
  958   2HD   PRO 131          HD3       PRO 131  30.502  -4.503   8.140
  959    H    GLU 132           H        GLU 132  30.543  -1.031   9.902
  960    HA   GLU 132           HA       GLU 132  30.806   0.686  11.353
  961   1HB   GLU 132          HB2       GLU 132  32.953  -0.604  11.212
  962   2HB   GLU 132          HB3       GLU 132  33.614   0.679  10.204
  963   1HG   GLU 132          HG2       GLU 132  33.137   2.290  12.118
  964   2HG   GLU 132          HG3       GLU 132  32.640   0.900  13.087
  965    H    ASP 133           H        ASP 133  29.256   2.063  10.002
  966    HA   ASP 133           HA       ASP 133  30.520   4.648   9.467
  967   1HB   ASP 133          HB2       ASP 133  30.666   3.442   7.275
  968   2HB   ASP 133          HB3       ASP 133  28.906   3.306   7.282
  969    HA   PRO 134           HA       PRO 134  26.633   5.906  11.335
  970   1HB   PRO 134          HB2       PRO 134  27.038   8.388   9.659
  971   2HB   PRO 134          HB3       PRO 134  26.575   8.261  11.384
  972   1HG   PRO 134          HG2       PRO 134  29.127   8.846  10.686
  973   2HG   PRO 134          HG3       PRO 134  28.801   7.686  12.013
  974   1HD   PRO 134          HD2       PRO 134  29.558   7.111   9.148
  975   2HD   PRO 134          HD3       PRO 134  30.122   6.328  10.655
  976    H    ALA 135           H        ALA 135  26.970   5.799   7.848
  977    HA   ALA 135           HA       ALA 135  25.632   5.327   6.176
  978   1HB   ALA 135          HB1       ALA 135  24.577   3.706   7.738
  979   2HB   ALA 135          HB2       ALA 135  23.323   4.907   8.106
  980   3HB   ALA 135          HB3       ALA 135  23.496   4.285   6.458
  981    H    GLU 136           H        GLU 136  24.119   7.616   8.455
  982    HA   GLU 136           HA       GLU 136  22.105   8.533   6.829
  983   1HB   GLU 136          HB2       GLU 136  21.976  10.482   8.272
  984   2HB   GLU 136          HB3       GLU 136  22.259   9.010   9.199
  985   1HG   GLU 136          HG2       GLU 136  24.680   9.614   9.394
  986   2HG   GLU 136          HG3       GLU 136  24.367  11.104   8.502
  987    H    GLU 137           H        GLU 137  25.503   9.572   6.675
  988    HA   GLU 137           HA       GLU 137  25.003  11.815   4.917
  989   1HB   GLU 137          HB2       GLU 137  27.529  10.181   5.434
  990   2HB   GLU 137          HB3       GLU 137  27.454  11.666   4.475
  991   1HG   GLU 137          HG2       GLU 137  26.556  12.877   6.485
  992   2HG   GLU 137          HG3       GLU 137  26.792  11.412   7.441
  993    H    TRP 138           H        TRP 138  25.631   8.333   4.417
  994    HA   TRP 138           HA       TRP 138  26.021   8.508   1.575
  995   1HB   TRP 138          HB2       TRP 138  26.180   6.463   3.563
  996   2HB   TRP 138          HB3       TRP 138  24.871   6.003   2.548
  997    HD1  TRP 138           HD1      TRP 138  25.399   5.347   0.014
  998    HE1  TRP 138           HE1      TRP 138  27.505   4.506  -1.144
  999    HE3  TRP 138           HE3      TRP 138  28.853   6.865   3.480
 1000    HZ2  TRP 138           HZ2      TRP 138  30.377   4.762  -0.775
 1001    HZ3  TRP 138           HZ3      TRP 138  31.275   6.609   3.018
 1002    HH2  TRP 138           HH2      TRP 138  32.054   5.600   0.884
 1003    H    LEU 139           H        LEU 139  23.234   7.758   3.733
 1004    HA   LEU 139           HA       LEU 139  21.274   7.375   1.682
 1005   1HB   LEU 139          HB2       LEU 139  21.167   8.194   4.615
 1006   2HB   LEU 139          HB3       LEU 139  19.771   8.421   3.591
 1007    HG   LEU 139           HG       LEU 139  19.973   5.939   2.931
 1008   1HD1  LEU 139          HD11      LEU 139  22.268   5.615   3.938
 1009   2HD1  LEU 139          HD12      LEU 139  21.556   5.836   5.540
 1010   3HD1  LEU 139          HD13      LEU 139  21.065   4.462   4.522
 1011   1HD2  LEU 139          HD21      LEU 139  18.708   5.228   4.932
 1012   2HD2  LEU 139          HD22      LEU 139  19.231   6.696   5.791
 1013   3HD2  LEU 139          HD23      LEU 139  18.177   6.818   4.364
 1014    H    GLY 140           H        GLY 140  22.166  10.400   3.522
 1015   1HA   GLY 140          HA2       GLY 140  20.371  12.091   2.202
 1016   2HA   GLY 140          HA3       GLY 140  21.908  12.596   2.923
 1017    H    SER 141           H        SER 141  23.787  11.235   1.201
 1018    HA   SER 141           HA       SER 141  23.995  12.875  -1.031
 1019   1HB   SER 141          HB2       SER 141  25.104  10.176  -0.123
 1020   2HB   SER 141          HB3       SER 141  25.666  11.041  -1.509
 1021    HG   SER 141           HG       SER 141  25.835  11.668   1.212
 1022    H    TRP 142           H        TRP 142  23.239   9.359  -0.871
 1023    HA   TRP 142           HA       TRP 142  22.648   8.982  -3.568
 1024   1HB   TRP 142          HB2       TRP 142  23.180   7.262  -1.938
 1025   2HB   TRP 142          HB3       TRP 142  21.702   7.594  -1.059
 1026    HD1  TRP 142           HD1      TRP 142  22.806   6.119  -4.441
 1027    HE1  TRP 142           HE1      TRP 142  21.217   4.198  -5.023
 1028    HE3  TRP 142           HE3      TRP 142  19.458   6.693  -0.639
 1029    HZ2  TRP 142           HZ2      TRP 142  18.472   3.448  -4.314
 1030    HZ3  TRP 142           HZ3      TRP 142  17.309   5.426  -0.665
 1031    HH2  TRP 142           HH2      TRP 142  16.814   3.815  -2.478
 1032    H    VAL 143           H        VAL 143  20.352   9.764  -0.908
 1033    HA   VAL 143           HA       VAL 143  17.990   9.693  -2.477
 1034    HB   VAL 143           HB       VAL 143  18.715  11.063   0.142
 1035   1HG1  VAL 143          HG11      VAL 143  16.308  11.440   0.509
 1036   2HG1  VAL 143          HG12      VAL 143  16.914  12.404  -0.826
 1037   3HG1  VAL 143          HG13      VAL 143  15.972  10.928  -1.166
 1038   1HG2  VAL 143          HG21      VAL 143  17.228   9.289   1.082
 1039   2HG2  VAL 143          HG22      VAL 143  16.976   8.638  -0.556
 1040   3HG2  VAL 143          HG23      VAL 143  18.572   8.580   0.193
 1041    H    ASN 144           H        ASN 144  20.031  12.597  -1.513
 1042    HA   ASN 144           HA       ASN 144  18.279  14.246  -3.050
 1043   1HB   ASN 144          HB2       ASN 144  19.344  16.067  -2.356
 1044   2HB   ASN 144          HB3       ASN 144  19.847  14.961  -1.084
 1045   1HD2  ASN 144          HD22      ASN 144  22.010  13.868  -1.461
 1046   2HD2  ASN 144          HD21      ASN 144  23.237  14.742  -2.362
 1047    H    LEU 145           H        LEU 145  20.864  12.224  -4.038
 1048    HA   LEU 145           HA       LEU 145  21.317  13.573  -6.604
 1049   1HB   LEU 145          HB2       LEU 145  22.325  11.101  -5.230
 1050   2HB   LEU 145          HB3       LEU 145  22.194  11.010  -6.976
 1051    HG   LEU 145           HG       LEU 145  23.602  12.941  -7.300
 1052   1HD1  LEU 145          HD11      LEU 145  23.968  13.067  -4.280
 1053   2HD1  LEU 145          HD12      LEU 145  24.845  14.027  -5.485
 1054   3HD1  LEU 145          HD13      LEU 145  23.111  14.271  -5.262
 1055   1HD2  LEU 145          HD21      LEU 145  25.724  11.962  -6.521
 1056   2HD2  LEU 145          HD22      LEU 145  24.840  10.933  -5.371
 1057   3HD2  LEU 145          HD23      LEU 145  24.629  10.709  -7.121
 1058    H    LEU 146           H        LEU 146  19.457  10.623  -5.502
 1059    HA   LEU 146           HA       LEU 146  18.544  10.139  -8.161
 1060   1HB   LEU 146          HB2       LEU 146  17.404   8.372  -7.300
 1061   2HB   LEU 146          HB3       LEU 146  18.863   8.480  -6.346
 1062    HG   LEU 146           HG       LEU 146  17.224   9.664  -4.605
 1063   1HD1  LEU 146          HD11      LEU 146  14.977   8.610  -4.607
 1064   2HD1  LEU 146          HD12      LEU 146  15.165   9.663  -6.004
 1065   3HD1  LEU 146          HD13      LEU 146  15.304   7.907  -6.202
 1066   1HD2  LEU 146          HD21      LEU 146  18.473   7.580  -4.228
 1067   2HD2  LEU 146          HD22      LEU 146  16.836   7.452  -3.584
 1068   3HD2  LEU 146          HD23      LEU 146  17.246   6.664  -5.124
 1069    H    LYS 147           H        LYS 147  17.249  11.974  -5.481
 1070    HA   LYS 147           HA       LYS 147  14.614  12.450  -6.410
 1071   1HB   LYS 147          HB2       LYS 147  16.556  13.907  -4.593
 1072   2HB   LYS 147          HB3       LYS 147  15.060  14.696  -5.101
 1073   1HG   LYS 147          HG2       LYS 147  13.741  12.741  -4.268
 1074   2HG   LYS 147          HG3       LYS 147  15.235  12.024  -3.640
 1075   1HD   LYS 147          HD2       LYS 147  15.555  13.981  -2.161
 1076   2HD   LYS 147          HD3       LYS 147  14.107  14.750  -2.839
 1077   1HE   LYS 147          HE2       LYS 147  12.765  12.835  -2.038
 1078   2HE   LYS 147          HE3       LYS 147  14.199  12.103  -1.320
 1079   1HZ   LYS 147          HZ1       LYS 147  12.993  13.275   0.352
 1080   2HZ   LYS 147          HZ2       LYS 147  14.370  14.112   0.098
 1081   3HZ   LYS 147          HZ3       LYS 147  12.956  14.668  -0.510
  Start of MODEL   21
    1   1H    MET   1          H1        MET   1   1.431  -0.253   1.220
    2   2H    MET   1          H2        MET   1   0.668  -1.153   0.077
    3   3H    MET   1          H3        MET   1   2.121  -1.627   0.669
    4    HA   MET   1           HA       MET   1   2.420  -0.716  -1.504
    5   1HB   MET   1          HB2       MET   1   0.428   0.768  -1.461
    6   2HB   MET   1          HB3       MET   1   1.233   1.828  -0.304
    7   1HG   MET   1          HG2       MET   1   1.350   2.709  -2.594
    8   2HG   MET   1          HG3       MET   1   2.944   2.404  -1.930
    9   1HE   MET   1          HE1       MET   1   0.285   1.504  -4.619
   10   2HE   MET   1          HE2       MET   1   0.923   0.023  -5.365
   11   3HE   MET   1          HE3       MET   1   0.264  -0.031  -3.718
   12    H    ALA   2           H        ALA   2   4.546  -0.105  -1.889
   13    HA   ALA   2           HA       ALA   2   5.975   1.608  -0.022
   14   1HB   ALA   2          HB1       ALA   2   7.857  -0.041   0.197
   15   2HB   ALA   2          HB2       ALA   2   6.384  -0.557   1.040
   16   3HB   ALA   2          HB3       ALA   2   6.824  -1.281  -0.524
   17    H    ASP   3           H        ASP   3   8.003   2.296  -0.964
   18    HA   ASP   3           HA       ASP   3   8.108   2.142  -3.914
   19   1HB   ASP   3          HB2       ASP   3   7.951   4.391  -2.734
   20   2HB   ASP   3          HB3       ASP   3   9.493   4.033  -1.980
   21    H    ILE   4           H        ILE   4   9.800   1.325  -0.948
   22    HA   ILE   4           HA       ILE   4  12.073   0.215  -2.511
   23    HB   ILE   4           HB       ILE   4  12.270   1.507   0.230
   24   1HG1  ILE   4          HG12      ILE   4  13.269   2.747  -2.358
   25   2HG1  ILE   4          HG13      ILE   4  11.741   3.220  -1.625
   26   1HG2  ILE   4          HG21      ILE   4  14.689   1.328  -0.142
   27   2HG2  ILE   4          HG22      ILE   4  13.961  -0.257  -0.380
   28   3HG2  ILE   4          HG23      ILE   4  14.420   0.704  -1.787
   29   1HD1  ILE   4          HD11      ILE   4  13.439   4.819  -1.064
   30   2HD1  ILE   4          HD12      ILE   4  12.877   3.981   0.391
   31   3HD1  ILE   4          HD13      ILE   4  14.453   3.567  -0.334
   32    H    THR   5           H        THR   5  12.233  -1.937  -2.218
   33    HA   THR   5           HA       THR   5  10.945  -3.255   0.098
   34    HB   THR   5           HB       THR   5  10.613  -4.285  -2.111
   35    HG1  THR   5           HG1      THR   5  10.696  -5.723  -0.471
   36   1HG2  THR   5          HG21      THR   5  13.613  -4.614  -2.324
   37   2HG2  THR   5          HG22      THR   5  12.387  -5.346  -3.375
   38   3HG2  THR   5          HG23      THR   5  12.572  -3.590  -3.339
   39    H    LEU   6           H        LEU   6  12.182  -3.826   1.891
   40    HA   LEU   6           HA       LEU   6  15.133  -3.288   1.807
   41   1HB   LEU   6          HB2       LEU   6  13.066  -3.352   4.028
   42   2HB   LEU   6          HB3       LEU   6  14.768  -3.548   4.358
   43    HG   LEU   6           HG       LEU   6  13.841  -1.298   4.798
   44   1HD1  LEU   6          HD11      LEU   6  16.230  -1.607   4.574
   45   2HD1  LEU   6          HD12      LEU   6  16.130  -1.427   2.811
   46   3HD1  LEU   6          HD13      LEU   6  15.760  -0.053   3.869
   47   1HD2  LEU   6          HD21      LEU   6  13.448   0.307   3.035
   48   2HD2  LEU   6          HD22      LEU   6  13.818  -0.900   1.791
   49   3HD2  LEU   6          HD23      LEU   6  12.368  -1.083   2.801
   50    H    ILE   7           H        ILE   7  16.108  -5.174   1.299
   51    HA   ILE   7           HA       ILE   7  14.763  -7.715   2.000
   52    HB   ILE   7           HB       ILE   7  16.976  -7.234  -0.026
   53   1HG1  ILE   7          HG12      ILE   7  13.957  -7.403  -0.501
   54   2HG1  ILE   7          HG13      ILE   7  14.920  -5.938  -0.648
   55   1HG2  ILE   7          HG21      ILE   7  16.658  -9.584   0.880
   56   2HG2  ILE   7          HG22      ILE   7  14.986  -9.524   0.266
   57   3HG2  ILE   7          HG23      ILE   7  16.370  -9.445  -0.847
   58   1HD1  ILE   7          HD11      ILE   7  14.520  -6.803  -2.848
   59   2HD1  ILE   7          HD12      ILE   7  16.245  -6.976  -2.478
   60   3HD1  ILE   7          HD13      ILE   7  15.162  -8.389  -2.423
   61    H    SER   8           H        SER   8  15.365  -7.971   4.125
   62    HA   SER   8           HA       SER   8  18.229  -7.816   4.843
   63   1HB   SER   8          HB2       SER   8  16.080  -8.202   6.887
   64   2HB   SER   8          HB3       SER   8  17.534  -7.196   6.934
   65    HG   SER   8           HG       SER   8  15.027  -6.723   5.740
   66    H    GLY   9           H        GLY   9  16.817 -10.235   3.503
   67   1HA   GLY   9          HA2       GLY   9  16.774 -12.290   5.607
   68   2HA   GLY   9          HA3       GLY   9  16.301 -12.467   3.908
   69    H    SER  10           H        SER  10  19.359 -11.546   5.660
   70    HA   SER  10           HA       SER  10  21.129 -12.588   3.791
   71   1HB   SER  10          HB2       SER  10  21.728 -12.708   6.741
   72   2HB   SER  10          HB3       SER  10  22.773 -12.246   5.380
   73    HG   SER  10           HG       SER  10  21.758 -10.323   5.248
   74    H    THR  11           H        THR  11  20.751 -14.637   2.949
   75    HA   THR  11           HA       THR  11  20.505 -16.899   2.788
   76    HB   THR  11           HB       THR  11  21.650 -17.311   5.533
   77    HG1  THR  11           HG1      THR  11  23.080 -15.884   4.753
   78   1HG2  THR  11          HG21      THR  11  22.661 -19.234   4.562
   79   2HG2  THR  11          HG22      THR  11  20.984 -19.265   4.014
   80   3HG2  THR  11          HG23      THR  11  22.269 -18.719   2.911
   81    H    LEU  12           H        LEU  12  18.315 -15.383   3.517
   82    HA   LEU  12           HA       LEU  12  16.327 -15.269   4.422
   83   1HB   LEU  12          HB2       LEU  12  16.156 -17.452   3.216
   84   2HB   LEU  12          HB3       LEU  12  16.386 -18.278   4.756
   85    HG   LEU  12           HG       LEU  12  14.277 -17.277   5.620
   86   1HD1  LEU  12          HD11      LEU  12  14.063 -15.985   2.863
   87   2HD1  LEU  12          HD12      LEU  12  12.735 -16.109   4.036
   88   3HD1  LEU  12          HD13      LEU  12  14.154 -15.150   4.432
   89   1HD2  LEU  12          HD21      LEU  12  12.735 -18.531   4.193
   90   2HD2  LEU  12          HD22      LEU  12  13.950 -18.595   2.896
   91   3HD2  LEU  12          HD23      LEU  12  14.235 -19.437   4.433
   92    H    GLY  13           H        GLY  13  18.420 -14.708   6.004
   93   1HA   GLY  13          HA2       GLY  13  17.904 -15.497   8.786
   94   2HA   GLY  13          HA3       GLY  13  19.114 -14.357   8.178
   95    H    GLY  14           H        GLY  14  18.542 -12.616   9.564
   96   1HA   GLY  14          HA2       GLY  14  16.084 -11.153   8.912
   97   2HA   GLY  14          HA3       GLY  14  16.138 -11.873  10.529
   98    H    ALA  15           H        ALA  15  18.311  -9.997   8.332
   99    HA   ALA  15           HA       ALA  15  19.567  -8.506  10.495
  100   1HB   ALA  15          HB1       ALA  15  19.580  -8.061   7.473
  101   2HB   ALA  15          HB2       ALA  15  20.662  -7.296   8.652
  102   3HB   ALA  15          HB3       ALA  15  20.744  -9.045   8.384
  103    H    GLU  16           H        GLU  16  16.531  -8.386  10.214
  104    HA   GLU  16           HA       GLU  16  15.726  -6.004   8.930
  105   1HB   GLU  16          HB2       GLU  16  14.376  -7.694  11.073
  106   2HB   GLU  16          HB3       GLU  16  13.594  -6.351  10.227
  107   1HG   GLU  16          HG2       GLU  16  14.007  -7.488   8.053
  108   2HG   GLU  16          HG3       GLU  16  14.689  -8.872   8.912
  109    H    TYR  17           H        TYR  17  17.165  -6.438  12.101
  110    HA   TYR  17           HA       TYR  17  16.135  -4.185  13.452
  111   1HB   TYR  17          HB2       TYR  17  17.538  -5.919  14.491
  112   2HB   TYR  17          HB3       TYR  17  18.921  -5.412  13.529
  113    HD1  TYR  17           HD1      TYR  17  16.543  -4.302  16.199
  114    HD2  TYR  17           HD2      TYR  17  20.330  -3.599  14.248
  115    HE1  TYR  17           HE1      TYR  17  17.146  -2.670  17.964
  116    HE2  TYR  17           HE2      TYR  17  20.942  -1.970  16.004
  117    HH   TYR  17           HH       TYR  17  20.281  -0.904  17.970
  118    H    VAL  18           H        VAL  18  18.743  -4.403  10.988
  119    HA   VAL  18           HA       VAL  18  19.433  -1.566  11.164
  120    HB   VAL  18           HB       VAL  18  20.003  -3.709   9.069
  121   1HG1  VAL  18          HG11      VAL  18  21.774  -2.246   8.236
  122   2HG1  VAL  18          HG12      VAL  18  20.216  -1.447   8.079
  123   3HG1  VAL  18          HG13      VAL  18  21.312  -0.965   9.388
  124   1HG2  VAL  18          HG21      VAL  18  21.059  -4.259  11.225
  125   2HG2  VAL  18          HG22      VAL  18  22.281  -3.755  10.057
  126   3HG2  VAL  18          HG23      VAL  18  21.753  -2.624  11.321
  127    H    ALA  19           H        ALA  19  17.328  -3.683   9.180
  128    HA   ALA  19           HA       ALA  19  16.673  -1.727   7.242
  129   1HB   ALA  19          HB1       ALA  19  15.048  -4.138   8.080
  130   2HB   ALA  19          HB2       ALA  19  14.894  -3.218   6.580
  131   3HB   ALA  19          HB3       ALA  19  16.390  -4.117   6.897
  132    H    GLU  20           H        GLU  20  15.172  -2.372  10.453
  133    HA   GLU  20           HA       GLU  20  12.898  -0.716  10.069
  134   1HB   GLU  20          HB2       GLU  20  14.522  -1.568  12.501
  135   2HB   GLU  20          HB3       GLU  20  13.133  -0.494  12.631
  136   1HG   GLU  20          HG2       GLU  20  11.692  -2.190  11.533
  137   2HG   GLU  20          HG3       GLU  20  13.054  -3.303  11.464
  138    H    HIS  21           H        HIS  21  16.248   0.075  11.168
  139    HA   HIS  21           HA       HIS  21  15.666   2.857  11.672
  140   1HB   HIS  21          HB2       HIS  21  17.602   1.738  12.676
  141   2HB   HIS  21          HB3       HIS  21  18.289   1.418  11.082
  142    HD1  HIS  21           HD1      HIS  21  19.876   3.302  10.156
  143    HD2  HIS  21           HD2      HIS  21  17.322   4.515  13.279
  144    HE1  HIS  21           HE1      HIS  21  20.531   5.693  10.730
  145    H    LEU  22           H        LEU  22  17.006   1.056   8.869
  146    HA   LEU  22           HA       LEU  22  17.441   3.255   7.136
  147   1HB   LEU  22          HB2       LEU  22  16.655   0.357   6.686
  148   2HB   LEU  22          HB3       LEU  22  16.846   1.446   5.348
  149    HG   LEU  22           HG       LEU  22  19.041   0.853   7.394
  150   1HD1  LEU  22          HD11      LEU  22  18.448  -1.176   6.167
  151   2HD1  LEU  22          HD12      LEU  22  18.546  -0.314   4.621
  152   3HD1  LEU  22          HD13      LEU  22  20.003  -0.587   5.607
  153   1HD2  LEU  22          HD21      LEU  22  19.383   3.018   6.242
  154   2HD2  LEU  22          HD22      LEU  22  20.563   1.828   5.713
  155   3HD2  LEU  22          HD23      LEU  22  19.177   2.221   4.668
  156    H    ALA  23           H        ALA  23  14.575   1.135   7.347
  157    HA   ALA  23           HA       ALA  23  12.864   2.467   5.616
  158   1HB   ALA  23          HB1       ALA  23  11.018   1.511   7.011
  159   2HB   ALA  23          HB2       ALA  23  12.267   0.329   6.582
  160   3HB   ALA  23          HB3       ALA  23  12.213   1.026   8.220
  161    H    GLU  24           H        GLU  24  13.378   3.225   9.141
  162    HA   GLU  24           HA       GLU  24  11.506   5.307   9.308
  163   1HB   GLU  24          HB2       GLU  24  12.990   4.215  11.144
  164   2HB   GLU  24          HB3       GLU  24  14.227   5.358  10.684
  165   1HG   GLU  24          HG2       GLU  24  13.106   6.299  12.545
  166   2HG   GLU  24          HG3       GLU  24  12.644   7.246  11.138
  167    H    LYS  25           H        LYS  25  15.026   5.581   8.600
  168    HA   LYS  25           HA       LYS  25  15.083   8.319   7.972
  169   1HB   LYS  25          HB2       LYS  25  16.745   5.989   6.923
  170   2HB   LYS  25          HB3       LYS  25  17.148   7.668   6.649
  171   1HG   LYS  25          HG2       LYS  25  16.906   6.295   9.377
  172   2HG   LYS  25          HG3       LYS  25  18.390   6.665   8.553
  173   1HD   LYS  25          HD2       LYS  25  16.401   8.616   9.700
  174   2HD   LYS  25          HD3       LYS  25  18.000   8.251  10.338
  175   1HE   LYS  25          HE2       LYS  25  19.084   9.254   8.384
  176   2HE   LYS  25          HE3       LYS  25  17.516   9.523   7.605
  177   1HZ   LYS  25          HZ1       LYS  25  18.360  11.524   8.670
  178   2HZ   LYS  25          HZ2       LYS  25  16.926  11.069   9.317
  179   3HZ   LYS  25          HZ3       LYS  25  18.335  10.810  10.137
  180    H    LEU  26           H        LEU  26  14.455   5.588   5.759
  181    HA   LEU  26           HA       LEU  26  14.287   7.197   3.383
  182   1HB   LEU  26          HB2       LEU  26  13.508   4.411   4.202
  183   2HB   LEU  26          HB3       LEU  26  12.869   5.053   2.697
  184    HG   LEU  26           HG       LEU  26  14.891   5.113   1.625
  185   1HD1  LEU  26          HD11      LEU  26  16.331   6.304   3.220
  186   2HD1  LEU  26          HD12      LEU  26  16.450   4.833   4.213
  187   3HD1  LEU  26          HD13      LEU  26  17.113   4.870   2.569
  188   1HD2  LEU  26          HD21      LEU  26  15.819   2.909   1.863
  189   2HD2  LEU  26          HD22      LEU  26  15.194   2.753   3.521
  190   3HD2  LEU  26          HD23      LEU  26  14.079   2.804   2.139
  191    H    GLU  27           H        GLU  27  11.779   6.196   5.799
  192    HA   GLU  27           HA       GLU  27   9.634   7.184   4.203
  193   1HB   GLU  27          HB2       GLU  27   9.951   6.507   7.149
  194   2HB   GLU  27          HB3       GLU  27   8.470   7.196   6.494
  195   1HG   GLU  27          HG2       GLU  27   8.327   5.332   4.836
  196   2HG   GLU  27          HG3       GLU  27   9.721   4.570   5.569
  197    H    GLU  28           H        GLU  28  11.633   8.722   6.824
  198    HA   GLU  28           HA       GLU  28  10.233  11.235   6.445
  199   1HB   GLU  28          HB2       GLU  28  11.815  12.251   7.895
  200   2HB   GLU  28          HB3       GLU  28  11.286  10.709   8.568
  201   1HG   GLU  28          HG2       GLU  28  13.396   9.667   7.880
  202   2HG   GLU  28          HG3       GLU  28  13.921  11.160   7.101
  203    H    ALA  29           H        ALA  29  12.764   9.655   4.638
  204    HA   ALA  29           HA       ALA  29  13.715  12.034   3.289
  205   1HB   ALA  29          HB1       ALA  29  14.672  10.516   1.647
  206   2HB   ALA  29          HB2       ALA  29  15.028   9.917   3.271
  207   3HB   ALA  29          HB3       ALA  29  13.762   9.156   2.279
  208    H    GLY  30           H        GLY  30  10.748  10.209   3.134
  209   1HA   GLY  30          HA2       GLY  30   8.947  11.554   2.265
  210   2HA   GLY  30          HA3       GLY  30   9.904  11.907   0.826
  211    H    PHE  31           H        PHE  31  10.099   8.561   1.868
  212    HA   PHE  31           HA       PHE  31   8.244   7.845  -0.370
  213   1HB   PHE  31          HB2       PHE  31  10.603   6.175   0.454
  214   2HB   PHE  31          HB3       PHE  31   9.716   6.181  -1.054
  215    HD1  PHE  31           HD1      PHE  31   9.846   8.399  -2.499
  216    HD2  PHE  31           HD2      PHE  31  12.661   7.343   0.595
  217    HE1  PHE  31           HE1      PHE  31  11.504   9.973  -3.465
  218    HE2  PHE  31           HE2      PHE  31  14.307   8.917  -0.370
  219    HZ   PHE  31           HZ       PHE  31  13.743  10.226  -2.409
  220    H    THR  32           H        THR  32   8.009   5.184  -0.060
  221    HA   THR  32           HA       THR  32   7.309   4.625   2.765
  222    HB   THR  32           HB       THR  32   5.499   3.114   1.702
  223    HG1  THR  32           HG1      THR  32   4.658   4.005  -0.259
  224   1HG2  THR  32          HG21      THR  32   5.129   6.141   1.653
  225   2HG2  THR  32          HG22      THR  32   3.837   4.921   1.781
  226   3HG2  THR  32          HG23      THR  32   5.025   5.090   3.086
  227    H    THR  33           H        THR  33   7.678   2.417   3.340
  228    HA   THR  33           HA       THR  33   9.495   0.945   1.503
  229    HB   THR  33           HB       THR  33  11.062   0.786   3.361
  230    HG1  THR  33           HG1      THR  33   9.627   1.095   5.122
  231   1HG2  THR  33          HG21      THR  33  11.207   2.784   1.780
  232   2HG2  THR  33          HG22      THR  33  10.373   3.739   3.024
  233   3HG2  THR  33          HG23      THR  33  11.945   2.995   3.378
  234    H    GLU  34           H        GLU  34   9.774  -1.368   2.080
  235    HA   GLU  34           HA       GLU  34   7.709  -2.414   3.921
  236   1HB   GLU  34          HB2       GLU  34   8.032  -2.692   1.146
  237   2HB   GLU  34          HB3       GLU  34   8.524  -4.182   1.875
  238   1HG   GLU  34          HG2       GLU  34   6.027  -2.641   2.671
  239   2HG   GLU  34          HG3       GLU  34   6.038  -3.785   1.402
  240    H    THR  35           H        THR  35   9.040  -2.684   5.766
  241    HA   THR  35           HA       THR  35  11.747  -3.595   5.646
  242    HB   THR  35           HB       THR  35   9.926  -3.755   8.063
  243    HG1  THR  35           HG1      THR  35  10.234  -1.611   8.390
  244   1HG2  THR  35          HG21      THR  35  12.347  -4.628   8.030
  245   2HG2  THR  35          HG22      THR  35  12.845  -2.945   7.770
  246   3HG2  THR  35          HG23      THR  35  11.991  -3.396   9.263
  247    H    LEU  36           H        LEU  36  12.343  -5.713   5.217
  248    HA   LEU  36           HA       LEU  36  10.552  -7.970   5.967
  249   1HB   LEU  36          HB2       LEU  36  11.651  -7.338   3.189
  250   2HB   LEU  36          HB3       LEU  36  10.820  -8.815   3.613
  251    HG   LEU  36           HG       LEU  36   9.493  -6.096   3.756
  252   1HD1  LEU  36          HD11      LEU  36   8.507  -6.686   1.576
  253   2HD1  LEU  36          HD12      LEU  36  10.269  -6.515   1.492
  254   3HD1  LEU  36          HD13      LEU  36   9.549  -8.135   1.503
  255   1HD2  LEU  36          HD21      LEU  36   7.419  -7.432   3.671
  256   2HD2  LEU  36          HD22      LEU  36   8.360  -8.936   3.644
  257   3HD2  LEU  36          HD23      LEU  36   8.381  -7.886   5.080
  258    H    HIS  37           H        HIS  37  11.554 -10.043   5.641
  259    HA   HIS  37           HA       HIS  37  14.528 -10.079   5.520
  260   1HB   HIS  37          HB2       HIS  37  14.219 -12.402   6.496
  261   2HB   HIS  37          HB3       HIS  37  13.893 -11.037   7.549
  262    HD1  HIS  37           HD1      HIS  37  11.599 -11.016   8.723
  263    HD2  HIS  37           HD2      HIS  37  11.867 -13.664   5.450
  264    HE1  HIS  37           HE1      HIS  37   9.409 -12.350   8.682
  265    H    GLY  38           H        GLY  38  12.994  -9.584   3.212
  266   1HA   GLY  38          HA2       GLY  38  12.426 -10.291   1.117
  267   2HA   GLY  38          HA3       GLY  38  13.911 -11.237   1.241
  268    HA   PRO  39           HA       PRO  39  10.823 -14.510   2.685
  269   1HB   PRO  39          HB2       PRO  39   8.112 -14.047   2.892
  270   2HB   PRO  39          HB3       PRO  39   9.282 -13.741   4.212
  271   1HG   PRO  39          HG2       PRO  39   8.162 -11.763   2.204
  272   2HG   PRO  39          HG3       PRO  39   8.300 -11.579   3.983
  273   1HD   PRO  39          HD2       PRO  39  10.146 -10.522   2.287
  274   2HD   PRO  39          HD3       PRO  39  10.626 -11.238   3.861
  275    H    LEU  40           H        LEU  40   9.831 -12.366   0.062
  276    HA   LEU  40           HA       LEU  40   8.945 -14.665  -1.588
  277   1HB   LEU  40          HB2       LEU  40   8.324 -11.667  -1.587
  278   2HB   LEU  40          HB3       LEU  40   7.843 -12.761  -2.855
  279    HG   LEU  40           HG       LEU  40   6.914 -12.943   0.036
  280   1HD1  LEU  40          HD11      LEU  40   6.017 -10.983  -1.155
  281   2HD1  LEU  40          HD12      LEU  40   5.448 -12.030  -2.475
  282   3HD1  LEU  40          HD13      LEU  40   4.748 -12.178  -0.846
  283   1HD2  LEU  40          HD21      LEU  40   6.891 -15.179  -0.961
  284   2HD2  LEU  40          HD22      LEU  40   5.240 -14.573  -0.843
  285   3HD2  LEU  40          HD23      LEU  40   6.072 -14.558  -2.413
  286    H    LEU  41           H        LEU  41  11.730 -13.283  -0.907
  287    HA   LEU  41           HA       LEU  41  13.579 -12.525  -1.790
  288   1HB   LEU  41          HB2       LEU  41  13.364 -14.654  -2.973
  289   2HB   LEU  41          HB3       LEU  41  12.638 -13.850  -4.353
  290    HG   LEU  41           HG       LEU  41  15.265 -12.693  -3.515
  291   1HD1  LEU  41          HD11      LEU  41  15.712 -15.030  -3.021
  292   2HD1  LEU  41          HD12      LEU  41  15.055 -15.523  -4.593
  293   3HD1  LEU  41          HD13      LEU  41  16.551 -14.556  -4.515
  294   1HD2  LEU  41          HD21      LEU  41  15.724 -12.800  -5.931
  295   2HD2  LEU  41          HD22      LEU  41  14.253 -13.757  -6.197
  296   3HD2  LEU  41          HD23      LEU  41  14.132 -12.067  -5.666
  297    H    GLU  42           H        GLU  42  10.682 -11.366  -3.221
  298    HA   GLU  42           HA       GLU  42  11.764  -8.755  -3.944
  299   1HB   GLU  42          HB2       GLU  42  11.048  -9.049  -6.362
  300   2HB   GLU  42          HB3       GLU  42  12.549  -9.820  -5.892
  301   1HG   GLU  42          HG2       GLU  42  11.484 -12.024  -5.816
  302   2HG   GLU  42          HG3       GLU  42   9.919 -11.324  -6.213
  303    H    ASP  43           H        ASP  43  10.185  -8.394  -2.200
  304    HA   ASP  43           HA       ASP  43   7.388  -9.022  -2.571
  305   1HB   ASP  43          HB2       ASP  43   8.197  -8.477  -0.374
  306   2HB   ASP  43          HB3       ASP  43   8.764  -6.886  -0.921
  307    H    LEU  44           H        LEU  44   9.460  -6.161  -3.371
  308    HA   LEU  44           HA       LEU  44   7.215  -5.102  -5.020
  309   1HB   LEU  44          HB2       LEU  44   9.974  -3.929  -4.580
  310   2HB   LEU  44          HB3       LEU  44   8.726  -3.202  -5.522
  311    HG   LEU  44           HG       LEU  44   8.586  -3.655  -2.521
  312   1HD1  LEU  44          HD11      LEU  44  10.064  -1.789  -3.406
  313   2HD1  LEU  44          HD12      LEU  44   8.626  -1.066  -4.135
  314   3HD1  LEU  44          HD13      LEU  44   8.728  -1.246  -2.371
  315   1HD2  LEU  44          HD21      LEU  44   6.517  -2.441  -4.411
  316   2HD2  LEU  44          HD22      LEU  44   6.321  -3.887  -3.389
  317   3HD2  LEU  44          HD23      LEU  44   6.478  -2.300  -2.641
  318    HA   PRO  45           HA       PRO  45   8.665  -7.276  -8.490
  319   1HB   PRO  45          HB2       PRO  45   8.049  -5.561 -10.615
  320   2HB   PRO  45          HB3       PRO  45   6.900  -6.542  -9.701
  321   1HG   PRO  45          HG2       PRO  45   7.639  -3.620  -9.366
  322   2HG   PRO  45          HG3       PRO  45   6.010  -4.347  -9.317
  323   1HD   PRO  45          HD2       PRO  45   7.437  -3.696  -7.050
  324   2HD   PRO  45          HD3       PRO  45   6.292  -5.076  -7.113
  325    H    ALA  46           H        ALA  46   9.763  -6.889 -10.676
  326    HA   ALA  46           HA       ALA  46  12.481  -5.921 -10.294
  327   1HB   ALA  46          HB1       ALA  46  12.777  -6.785 -12.627
  328   2HB   ALA  46          HB2       ALA  46  11.995  -7.986 -11.587
  329   3HB   ALA  46          HB3       ALA  46  11.031  -7.042 -12.751
  330    H    SER  47           H        SER  47  10.629  -3.818  -9.932
  331    HA   SER  47           HA       SER  47  11.532  -1.819 -11.759
  332   1HB   SER  47          HB2       SER  47   8.572  -2.446 -11.681
  333   2HB   SER  47          HB3       SER  47   9.302  -1.037 -12.468
  334    HG   SER  47           HG       SER  47  10.452  -3.371 -13.259
  335    H    GLY  48           H        GLY  48  11.908  -0.116 -10.335
  336   1HA   GLY  48          HA2       GLY  48  10.576   1.297  -8.579
  337   2HA   GLY  48          HA3       GLY  48  10.573  -0.225  -7.677
  338    H    ILE  49           H        ILE  49  11.894   0.483  -6.005
  339    HA   ILE  49           HA       ILE  49  14.785   0.715  -6.654
  340    HB   ILE  49           HB       ILE  49  13.271   2.019  -4.372
  341   1HG1  ILE  49          HG12      ILE  49  12.662   3.223  -6.411
  342   2HG1  ILE  49          HG13      ILE  49  13.583   4.200  -5.291
  343   1HG2  ILE  49          HG21      ILE  49  16.190   2.245  -5.212
  344   2HG2  ILE  49          HG22      ILE  49  15.414   3.267  -3.982
  345   3HG2  ILE  49          HG23      ILE  49  15.551   1.528  -3.723
  346   1HD1  ILE  49          HD11      ILE  49  14.761   2.901  -7.779
  347   2HD1  ILE  49          HD12      ILE  49  14.235   4.587  -7.643
  348   3HD1  ILE  49          HD13      ILE  49  15.595   4.016  -6.668
  349    H    TRP  50           H        TRP  50  16.058  -0.634  -5.273
  350    HA   TRP  50           HA       TRP  50  14.611  -2.427  -3.364
  351   1HB   TRP  50          HB2       TRP  50  16.576  -3.008  -5.609
  352   2HB   TRP  50          HB3       TRP  50  16.523  -4.029  -4.209
  353    HD1  TRP  50           HD1      TRP  50  13.171  -2.896  -5.748
  354    HE1  TRP  50           HE1      TRP  50  12.070  -4.849  -6.976
  355    HE3  TRP  50           HE3      TRP  50  16.960  -6.315  -5.338
  356    HZ2  TRP  50           HZ2      TRP  50  12.711  -7.586  -7.604
  357    HZ3  TRP  50           HZ3      TRP  50  16.680  -8.595  -6.267
  358    HH2  TRP  50           HH2      TRP  50  14.566  -9.243  -7.400
  359    H    LEU  51           H        LEU  51  15.998  -3.144  -1.601
  360    HA   LEU  51           HA       LEU  51  18.752  -2.084  -1.486
  361   1HB   LEU  51          HB2       LEU  51  16.544  -1.595   0.552
  362   2HB   LEU  51          HB3       LEU  51  18.232  -1.694   1.045
  363    HG   LEU  51           HG       LEU  51  17.044   0.386  -0.842
  364   1HD1  LEU  51          HD11      LEU  51  18.176   0.528   1.988
  365   2HD1  LEU  51          HD12      LEU  51  17.682   1.918   1.003
  366   3HD1  LEU  51          HD13      LEU  51  16.481   0.710   1.506
  367   1HD2  LEU  51          HD21      LEU  51  19.389   1.433  -0.543
  368   2HD2  LEU  51          HD22      LEU  51  19.927  -0.175  -0.007
  369   3HD2  LEU  51          HD23      LEU  51  19.266   0.065  -1.640
  370    H    VAL  52           H        VAL  52  20.118  -3.506  -0.430
  371    HA   VAL  52           HA       VAL  52  18.908  -6.017   0.617
  372    HB   VAL  52           HB       VAL  52  21.422  -5.788  -1.092
  373   1HG1  VAL  52          HG11      VAL  52  19.743  -8.191  -0.229
  374   2HG1  VAL  52          HG12      VAL  52  21.173  -8.245  -1.283
  375   3HG1  VAL  52          HG13      VAL  52  21.344  -7.758   0.405
  376   1HG2  VAL  52          HG21      VAL  52  19.557  -5.221  -2.569
  377   2HG2  VAL  52          HG22      VAL  52  20.090  -6.861  -2.917
  378   3HG2  VAL  52          HG23      VAL  52  18.614  -6.604  -1.964
  379    H    ILE  53           H        ILE  53  19.803  -6.717   2.524
  380    HA   ILE  53           HA       ILE  53  21.997  -5.072   3.683
  381    HB   ILE  53           HB       ILE  53  19.463  -5.953   5.132
  382   1HG1  ILE  53          HG12      ILE  53  19.218  -3.302   5.265
  383   2HG1  ILE  53          HG13      ILE  53  20.097  -3.332   3.746
  384   1HG2  ILE  53          HG21      ILE  53  20.290  -4.480   6.909
  385   2HG2  ILE  53          HG22      ILE  53  21.483  -5.721   6.550
  386   3HG2  ILE  53          HG23      ILE  53  21.723  -4.069   5.939
  387   1HD1  ILE  53          HD11      ILE  53  18.253  -4.757   2.780
  388   2HD1  ILE  53          HD12      ILE  53  17.437  -4.705   4.354
  389   3HD1  ILE  53          HD13      ILE  53  17.672  -3.220   3.413
  390    H    SER  54           H        SER  54  23.612  -6.283   4.431
  391    HA   SER  54           HA       SER  54  23.354  -8.753   5.840
  392   1HB   SER  54          HB2       SER  54  24.330  -8.805   2.951
  393   2HB   SER  54          HB3       SER  54  24.897  -9.976   4.146
  394    HG   SER  54           HG       SER  54  22.177  -9.482   3.536
  395    H    SER  55           H        SER  55  26.050  -9.541   5.752
  396    HA   SER  55           HA       SER  55  27.807  -7.199   5.612
  397   1HB   SER  55          HB2       SER  55  27.298  -8.720   8.196
  398   2HB   SER  55          HB3       SER  55  28.684  -7.632   7.936
  399    HG   SER  55           HG       SER  55  26.232  -6.572   7.260
  400    H    THR  56           H        THR  56  28.022  -8.721   3.752
  401    HA   THR  56           HA       THR  56  28.758 -11.375   3.957
  402    HB   THR  56           HB       THR  56  29.510 -10.995   1.539
  403    HG1  THR  56           HG1      THR  56  28.830  -8.909   0.794
  404   1HG2  THR  56          HG21      THR  56  26.806  -9.841   2.325
  405   2HG2  THR  56          HG22      THR  56  27.282 -10.485   0.738
  406   3HG2  THR  56          HG23      THR  56  27.202 -11.566   2.131
  407    H    HIS  57           H        HIS  57  30.935  -8.575   4.258
  408    HA   HIS  57           HA       HIS  57  33.349  -9.920   3.845
  409   1HB   HIS  57          HB2       HIS  57  33.023  -7.468   4.118
  410   2HB   HIS  57          HB3       HIS  57  32.883  -7.699   5.862
  411    HD1  HIS  57           HD1      HIS  57  35.496  -8.421   3.022
  412    HD2  HIS  57           HD2      HIS  57  35.171  -7.538   7.144
  413    HE1  HIS  57           HE1      HIS  57  37.864  -8.131   3.891
  414    H    GLY  58           H        GLY  58  31.202 -10.340   6.660
  415   1HA   GLY  58          HA2       GLY  58  32.547 -12.612   7.485
  416   2HA   GLY  58          HA3       GLY  58  33.330 -11.314   8.401
  417    H    ALA  59           H        ALA  59  29.944 -10.900   7.802
  418    HA   ALA  59           HA       ALA  59  29.172 -12.239  10.321
  419   1HB   ALA  59          HB1       ALA  59  29.691 -10.001  11.054
  420   2HB   ALA  59          HB2       ALA  59  28.716  -9.280   9.768
  421   3HB   ALA  59          HB3       ALA  59  27.937 -10.203  11.073
  422    H    GLY  60           H        GLY  60  28.799 -12.731   7.393
  423   1HA   GLY  60          HA2       GLY  60  25.933 -12.458   6.875
  424   2HA   GLY  60          HA3       GLY  60  27.098 -13.472   6.003
  425    H    ASP  61           H        ASP  61  24.589 -14.512   6.710
  426    HA   ASP  61           HA       ASP  61  24.619 -15.784   9.315
  427   1HB   ASP  61          HB2       ASP  61  22.545 -15.204   8.167
  428   2HB   ASP  61          HB3       ASP  61  22.952 -16.309   6.854
  429    H    ILE  62           H        ILE  62  25.901 -16.660   6.196
  430    HA   ILE  62           HA       ILE  62  27.235 -18.969   7.328
  431    HB   ILE  62           HB       ILE  62  25.064 -19.777   6.242
  432   1HG1  ILE  62          HG12      ILE  62  25.976 -21.631   4.936
  433   2HG1  ILE  62          HG13      ILE  62  27.564 -20.886   4.927
  434   1HG2  ILE  62          HG21      ILE  62  26.387 -19.048   3.604
  435   2HG2  ILE  62          HG22      ILE  62  24.837 -19.854   3.835
  436   3HG2  ILE  62          HG23      ILE  62  25.020 -18.174   4.341
  437   1HD1  ILE  62          HD11      ILE  62  27.345 -22.682   6.632
  438   2HD1  ILE  62          HD12      ILE  62  27.654 -21.133   7.428
  439   3HD1  ILE  62          HD13      ILE  62  26.009 -21.803   7.400
  440    HA   PRO  63           HA       PRO  63  30.492 -16.789   5.360
  441   1HB   PRO  63          HB2       PRO  63  31.400 -19.390   4.096
  442   2HB   PRO  63          HB3       PRO  63  32.393 -18.109   4.865
  443   1HG   PRO  63          HG2       PRO  63  31.724 -20.300   6.292
  444   2HG   PRO  63          HG3       PRO  63  31.565 -18.679   7.046
  445   1HD   PRO  63          HD2       PRO  63  29.426 -20.423   5.849
  446   2HD   PRO  63          HD3       PRO  63  29.373 -19.436   7.342
  447    H    ASP  64           H        ASP  64  28.808 -18.967   3.026
  448    HA   ASP  64           HA       ASP  64  29.596 -17.502   0.668
  449   1HB   ASP  64          HB2       ASP  64  28.700 -19.784   0.538
  450   2HB   ASP  64          HB3       ASP  64  27.149 -19.232   1.182
  451    H    ASN  65           H        ASN  65  26.719 -17.424   2.737
  452    HA   ASN  65           HA       ASN  65  25.123 -16.128   3.237
  453   1HB   ASN  65          HB2       ASN  65  26.922 -14.598   3.965
  454   2HB   ASN  65          HB3       ASN  65  26.799 -13.775   2.411
  455   1HD2  ASN  65          HD22      ASN  65  25.351 -12.048   2.392
  456   2HD2  ASN  65          HD21      ASN  65  24.034 -11.838   3.519
  457    H    LEU  66           H        LEU  66  23.257 -15.369   2.573
  458    HA   LEU  66           HA       LEU  66  21.485 -15.010   1.158
  459   1HB   LEU  66          HB2       LEU  66  23.527 -13.236  -0.204
  460   2HB   LEU  66          HB3       LEU  66  21.924 -13.437  -0.879
  461    HG   LEU  66           HG       LEU  66  22.323 -12.506   1.967
  462   1HD1  LEU  66          HD11      LEU  66  23.462 -10.910   0.466
  463   2HD1  LEU  66          HD12      LEU  66  21.987 -10.784  -0.523
  464   3HD1  LEU  66          HD13      LEU  66  21.993 -10.209   1.155
  465   1HD2  LEU  66          HD21      LEU  66  20.042 -11.624   1.705
  466   2HD2  LEU  66          HD22      LEU  66  19.992 -12.169   0.019
  467   3HD2  LEU  66          HD23      LEU  66  20.033 -13.350   1.332
  468    H    SER  67           H        SER  67  22.513 -17.426   1.063
  469    HA   SER  67           HA       SER  67  23.651 -18.166  -1.475
  470   1HB   SER  67          HB2       SER  67  22.699 -19.774   0.930
  471   2HB   SER  67          HB3       SER  67  23.715 -20.390  -0.404
  472    HG   SER  67           HG       SER  67  25.231 -18.776   0.139
  473    HA   PRO  68           HA       PRO  68  19.433 -20.329  -2.190
  474   1HB   PRO  68          HB2       PRO  68  17.189 -19.390  -0.872
  475   2HB   PRO  68          HB3       PRO  68  18.215 -20.743  -0.333
  476   1HG   PRO  68          HG2       PRO  68  18.248 -17.923   0.675
  477   2HG   PRO  68          HG3       PRO  68  18.372 -19.433   1.617
  478   1HD   PRO  68          HD2       PRO  68  20.512 -17.971   0.960
  479   2HD   PRO  68          HD3       PRO  68  20.595 -19.743   1.106
  480    H    PHE  69           H        PHE  69  19.465 -16.969  -1.201
  481    HA   PHE  69           HA       PHE  69  17.850 -15.840  -3.257
  482   1HB   PHE  69          HB2       PHE  69  20.086 -14.767  -1.513
  483   2HB   PHE  69          HB3       PHE  69  19.374 -13.802  -2.770
  484    HD1  PHE  69           HD1      PHE  69  18.470 -15.750   0.314
  485    HD2  PHE  69           HD2      PHE  69  17.427 -12.525  -2.349
  486    HE1  PHE  69           HE1      PHE  69  16.618 -15.100   1.825
  487    HE2  PHE  69           HE2      PHE  69  15.605 -11.856  -0.810
  488    HZ   PHE  69           HZ       PHE  69  15.193 -13.154   1.281
  489    H    TYR  70           H        TYR  70  21.441 -16.259  -3.074
  490    HA   TYR  70           HA       TYR  70  22.097 -15.329  -5.594
  491   1HB   TYR  70          HB2       TYR  70  23.808 -15.741  -3.969
  492   2HB   TYR  70          HB3       TYR  70  23.381 -17.427  -3.849
  493    HD1  TYR  70           HD1      TYR  70  24.810 -18.943  -4.899
  494    HD2  TYR  70           HD2      TYR  70  24.343 -14.993  -6.583
  495    HE1  TYR  70           HE1      TYR  70  26.433 -19.513  -6.682
  496    HE2  TYR  70           HE2      TYR  70  25.961 -15.553  -8.356
  497    HH   TYR  70           HH       TYR  70  27.375 -17.183  -9.257
  498    H    GLU  71           H        GLU  71  21.299 -18.768  -4.710
  499    HA   GLU  71           HA       GLU  71  21.490 -19.699  -7.380
  500   1HB   GLU  71          HB2       GLU  71  19.835 -20.802  -5.068
  501   2HB   GLU  71          HB3       GLU  71  20.205 -21.641  -6.583
  502   1HG   GLU  71          HG2       GLU  71  22.692 -21.145  -5.959
  503   2HG   GLU  71          HG3       GLU  71  22.095 -20.869  -4.343
  504    H    ALA  72           H        ALA  72  18.646 -18.359  -5.581
  505    HA   ALA  72           HA       ALA  72  16.741 -19.039  -7.593
  506   1HB   ALA  72          HB1       ALA  72  15.340 -17.298  -6.471
  507   2HB   ALA  72          HB2       ALA  72  16.049 -18.460  -5.325
  508   3HB   ALA  72          HB3       ALA  72  16.753 -16.836  -5.499
  509    H    LEU  73           H        LEU  73  18.866 -16.153  -7.197
  510    HA   LEU  73           HA       LEU  73  17.655 -14.498  -9.127
  511   1HB   LEU  73          HB2       LEU  73  20.524 -14.896  -8.191
  512   2HB   LEU  73          HB3       LEU  73  20.140 -13.766  -9.455
  513    HG   LEU  73           HG       LEU  73  18.998 -13.687  -6.628
  514   1HD1  LEU  73          HD11      LEU  73  21.435 -13.203  -6.761
  515   2HD1  LEU  73          HD12      LEU  73  21.096 -11.895  -7.912
  516   3HD1  LEU  73          HD13      LEU  73  20.482 -11.805  -6.246
  517   1HD2  LEU  73          HD21      LEU  73  18.239 -11.394  -7.210
  518   2HD2  LEU  73          HD22      LEU  73  18.733 -11.668  -8.899
  519   3HD2  LEU  73          HD23      LEU  73  17.418 -12.613  -8.165
  520    H    GLN  74           H        GLN  74  20.392 -16.783  -9.614
  521    HA   GLN  74           HA       GLN  74  20.324 -16.466 -12.448
  522   1HB   GLN  74          HB2       GLN  74  21.970 -18.346 -12.431
  523   2HB   GLN  74          HB3       GLN  74  22.367 -16.980 -11.405
  524   1HG   GLN  74          HG2       GLN  74  21.555 -18.228  -9.418
  525   2HG   GLN  74          HG3       GLN  74  21.197 -19.601 -10.435
  526   1HE2  GLN  74          HE22      GLN  74  23.745 -17.381  -9.278
  527   2HE2  GLN  74          HE21      GLN  74  25.116 -18.399  -9.624
  528    H    GLU  75           H        GLU  75  18.286 -18.369 -10.401
  529    HA   GLU  75           HA       GLU  75  17.749 -20.416 -12.343
  530   1HB   GLU  75          HB2       GLU  75  17.410 -20.627  -9.875
  531   2HB   GLU  75          HB3       GLU  75  16.036 -19.526 -10.015
  532   1HG   GLU  75          HG2       GLU  75  14.865 -21.117 -11.473
  533   2HG   GLU  75          HG3       GLU  75  16.278 -22.178 -11.489
  534    H    GLN  76           H        GLN  76  16.421 -17.193 -11.688
  535    HA   GLN  76           HA       GLN  76  14.421 -17.612 -13.873
  536   1HB   GLN  76          HB2       GLN  76  13.119 -15.794 -12.672
  537   2HB   GLN  76          HB3       GLN  76  13.122 -17.408 -11.976
  538   1HG   GLN  76          HG2       GLN  76  14.391 -16.814 -10.151
  539   2HG   GLN  76          HG3       GLN  76  15.168 -15.449 -10.960
  540   1HE2  GLN  76          HE22      GLN  76  14.692 -14.340  -8.878
  541   2HE2  GLN  76          HE21      GLN  76  13.157 -13.491  -8.773
  542    H    LYS  77           H        LYS  77  16.921 -15.406 -12.727
  543    HA   LYS  77           HA       LYS  77  17.345 -13.220 -13.248
  544   1HB   LYS  77          HB2       LYS  77  17.868 -14.658 -15.842
  545   2HB   LYS  77          HB3       LYS  77  18.513 -13.067 -15.394
  546   1HG   LYS  77          HG2       LYS  77  19.485 -14.160 -13.336
  547   2HG   LYS  77          HG3       LYS  77  19.028 -15.728 -14.019
  548   1HD   LYS  77          HD2       LYS  77  20.926 -13.733 -15.309
  549   2HD   LYS  77          HD3       LYS  77  21.421 -15.143 -14.356
  550   1HE   LYS  77          HE2       LYS  77  20.271 -16.607 -15.989
  551   2HE   LYS  77          HE3       LYS  77  19.806 -15.199 -16.950
  552   1HZ   LYS  77          HZ1       LYS  77  22.594 -16.073 -16.435
  553   2HZ   LYS  77          HZ2       LYS  77  21.788 -16.235 -17.839
  554   3HZ   LYS  77          HZ3       LYS  77  22.174 -14.749 -17.300
  555    HA   PRO  78           HA       PRO  78  13.332 -11.878 -15.174
  556   1HB   PRO  78          HB2       PRO  78  13.007  -9.894 -13.128
  557   2HB   PRO  78          HB3       PRO  78  12.074 -11.381 -13.377
  558   1HG   PRO  78          HG2       PRO  78  14.112 -10.823 -11.350
  559   2HG   PRO  78          HG3       PRO  78  12.975 -12.185 -11.450
  560   1HD   PRO  78          HD2       PRO  78  15.776 -12.239 -12.005
  561   2HD   PRO  78          HD3       PRO  78  14.591 -13.536 -12.283
  562    H    ASP  79           H        ASP  79  12.801  -9.387 -15.616
  563    HA   ASP  79           HA       ASP  79  15.257  -8.254 -16.799
  564   1HB   ASP  79          HB2       ASP  79  13.344  -8.556 -18.252
  565   2HB   ASP  79          HB3       ASP  79  12.316  -7.606 -17.173
  566    H    LEU  80           H        LEU  80  16.160  -7.627 -14.683
  567    HA   LEU  80           HA       LEU  80  14.732  -5.734 -13.004
  568   1HB   LEU  80          HB2       LEU  80  17.631  -6.576 -13.037
  569   2HB   LEU  80          HB3       LEU  80  16.958  -5.523 -11.844
  570    HG   LEU  80           HG       LEU  80  17.366  -7.745 -10.985
  571   1HD1  LEU  80          HD11      LEU  80  15.211  -8.024  -9.805
  572   2HD1  LEU  80          HD12      LEU  80  15.761  -6.344  -9.830
  573   3HD1  LEU  80          HD13      LEU  80  14.459  -6.877 -10.925
  574   1HD2  LEU  80          HD21      LEU  80  16.100  -9.643 -11.530
  575   2HD2  LEU  80          HD22      LEU  80  14.950  -8.706 -12.526
  576   3HD2  LEU  80          HD23      LEU  80  16.613  -8.950 -13.074
  577    H    SER  81           H        SER  81  15.896  -5.051 -16.001
  578    HA   SER  81           HA       SER  81  17.652  -2.935 -15.766
  579   1HB   SER  81          HB2       SER  81  15.603  -3.495 -17.941
  580   2HB   SER  81          HB3       SER  81  17.243  -2.867 -18.073
  581    HG   SER  81           HG       SER  81  16.335  -5.405 -18.063
  582    H    ALA  82           H        ALA  82  14.487  -3.031 -14.720
  583    HA   ALA  82           HA       ALA  82  13.994  -0.122 -15.187
  584   1HB   ALA  82          HB1       ALA  82  12.022  -2.377 -14.642
  585   2HB   ALA  82          HB2       ALA  82  11.607  -0.657 -14.811
  586   3HB   ALA  82          HB3       ALA  82  12.266  -1.548 -16.194
  587    H    VAL  83           H        VAL  83  15.435  -2.070 -12.975
  588    HA   VAL  83           HA       VAL  83  14.579  -0.256 -10.800
  589    HB   VAL  83           HB       VAL  83  13.344  -2.171 -10.334
  590   1HG1  VAL  83          HG11      VAL  83  14.261  -4.451 -10.056
  591   2HG1  VAL  83          HG12      VAL  83  14.366  -3.871 -11.720
  592   3HG1  VAL  83          HG13      VAL  83  15.819  -3.878 -10.690
  593   1HG2  VAL  83          HG21      VAL  83  14.015  -2.946  -8.233
  594   2HG2  VAL  83          HG22      VAL  83  15.730  -2.621  -8.524
  595   3HG2  VAL  83          HG23      VAL  83  14.583  -1.285  -8.317
  596    H    ARG  84           H        ARG  84  16.109  -0.132  -9.016
  597    HA   ARG  84           HA       ARG  84  18.923  -0.717  -9.684
  598   1HB   ARG  84          HB2       ARG  84  19.542   1.472  -8.628
  599   2HB   ARG  84          HB3       ARG  84  18.785   1.628 -10.215
  600   1HG   ARG  84          HG2       ARG  84  16.673   2.286  -9.223
  601   2HG   ARG  84          HG3       ARG  84  17.262   1.997  -7.583
  602   1HD   ARG  84          HD2       ARG  84  18.817   3.915  -9.300
  603   2HD   ARG  84          HD3       ARG  84  17.200   4.406  -8.776
  604    HE   ARG  84           HE       ARG  84  18.733   3.429  -6.533
  605   1HH1  ARG  84          HH21      ARG  84  18.591   6.161  -8.770
  606   2HH1  ARG  84          HH22      ARG  84  19.024   7.352  -7.604
  607   1HH2  ARG  84          HH11      ARG  84  19.223   5.045  -4.904
  608   2HH2  ARG  84          HH12      ARG  84  19.295   6.713  -5.321
  609    H    PHE  85           H        PHE  85  20.183  -0.940  -7.703
  610    HA   PHE  85           HA       PHE  85  18.518  -1.337  -5.284
  611   1HB   PHE  85          HB2       PHE  85  19.370  -3.406  -4.766
  612   2HB   PHE  85          HB3       PHE  85  18.889  -3.520  -6.438
  613    HD1  PHE  85           HD1      PHE  85  20.745  -3.376  -8.250
  614    HD2  PHE  85           HD2      PHE  85  21.558  -4.029  -4.068
  615    HE1  PHE  85           HE1      PHE  85  22.912  -4.426  -8.836
  616    HE2  PHE  85           HE2      PHE  85  23.735  -5.056  -4.655
  617    HZ   PHE  85           HZ       PHE  85  24.408  -5.281  -7.037
  618    H    GLY  86           H        GLY  86  20.020  -1.661  -3.373
  619   1HA   GLY  86          HA2       GLY  86  22.675  -0.395  -3.593
  620   2HA   GLY  86          HA3       GLY  86  21.536   0.276  -2.407
  621    H    ALA  87           H        ALA  87  23.971  -0.998  -1.660
  622    HA   ALA  87           HA       ALA  87  23.103  -3.580  -0.444
  623   1HB   ALA  87          HB1       ALA  87  25.792  -2.859  -1.708
  624   2HB   ALA  87          HB2       ALA  87  25.434  -4.355  -0.846
  625   3HB   ALA  87          HB3       ALA  87  24.603  -4.006  -2.369
  626    H    ILE  88           H        ILE  88  23.258  -3.427   1.755
  627    HA   ILE  88           HA       ILE  88  24.885  -1.200   2.902
  628    HB   ILE  88           HB       ILE  88  22.085  -2.131   3.659
  629   1HG1  ILE  88          HG12      ILE  88  22.987   0.315   2.080
  630   2HG1  ILE  88          HG13      ILE  88  21.977  -1.005   1.512
  631   1HG2  ILE  88          HG21      ILE  88  22.104  -0.130   5.168
  632   2HG2  ILE  88          HG22      ILE  88  23.286  -1.336   5.598
  633   3HG2  ILE  88          HG23      ILE  88  23.798   0.145   4.758
  634   1HD1  ILE  88          HD11      ILE  88  21.160   1.052   3.575
  635   2HD1  ILE  88          HD12      ILE  88  20.643   0.955   1.902
  636   3HD1  ILE  88          HD13      ILE  88  20.183  -0.341   3.027
  637    H    GLY  89           H        GLY  89  26.161  -1.714   4.572
  638   1HA   GLY  89          HA2       GLY  89  27.039  -2.836   6.417
  639   2HA   GLY  89          HA3       GLY  89  25.756  -4.050   6.309
  640    H    ILE  90           H        ILE  90  26.118  -4.559   3.548
  641    HA   ILE  90           HA       ILE  90  27.806  -6.660   3.267
  642    HB   ILE  90           HB       ILE  90  26.559  -4.659   1.360
  643   1HG1  ILE  90          HG12      ILE  90  25.909  -7.526   2.076
  644   2HG1  ILE  90          HG13      ILE  90  25.130  -6.136   2.783
  645   1HG2  ILE  90          HG21      ILE  90  26.925  -6.078  -0.564
  646   2HG2  ILE  90          HG22      ILE  90  28.484  -5.635   0.099
  647   3HG2  ILE  90          HG23      ILE  90  27.802  -7.253   0.404
  648   1HD1  ILE  90          HD11      ILE  90  24.131  -5.524   0.639
  649   2HD1  ILE  90          HD12      ILE  90  24.883  -6.949  -0.129
  650   3HD1  ILE  90          HD13      ILE  90  23.682  -7.152   1.152
  651    H    GLY  91           H        GLY  91  29.800  -7.046   2.144
  652   1HA   GLY  91          HA2       GLY  91  31.664  -4.715   1.982
  653   2HA   GLY  91          HA3       GLY  91  32.080  -6.116   2.929
  654    H    SER  92           H        SER  92  30.565  -7.694   0.575
  655    HA   SER  92           HA       SER  92  32.931  -8.484  -0.785
  656   1HB   SER  92          HB2       SER  92  30.001  -8.871  -1.406
  657   2HB   SER  92          HB3       SER  92  31.338  -9.694  -2.225
  658    HG   SER  92           HG       SER  92  30.941  -9.719   0.596
  659    H    ARG  93           H        ARG  93  33.839  -7.780  -2.608
  660    HA   ARG  93           HA       ARG  93  32.594  -5.913  -4.470
  661   1HB   ARG  93          HB2       ARG  93  34.956  -5.204  -2.646
  662   2HB   ARG  93          HB3       ARG  93  34.789  -4.481  -4.247
  663   1HG   ARG  93          HG2       ARG  93  32.551  -3.628  -3.671
  664   2HG   ARG  93          HG3       ARG  93  32.742  -4.256  -2.014
  665   1HD   ARG  93          HD2       ARG  93  34.711  -2.829  -1.669
  666   2HD   ARG  93          HD3       ARG  93  34.587  -2.237  -3.343
  667    HE   ARG  93           HE       ARG  93  32.122  -1.857  -1.909
  668   1HH1  ARG  93          HH11      ARG  93  35.358  -0.394  -2.283
  669   2HH1  ARG  93          HH12      ARG  93  34.774   1.217  -2.012
  670   1HH2  ARG  93          HH21      ARG  93  31.434   0.178  -1.447
  671   2HH2  ARG  93          HH22      ARG  93  32.490   1.579  -1.547
  672    H    GLU  94           H        GLU  94  34.230  -5.569  -6.264
  673    HA   GLU  94           HA       GLU  94  35.012  -7.940  -7.440
  674   1HB   GLU  94          HB2       GLU  94  36.165  -5.192  -7.883
  675   2HB   GLU  94          HB3       GLU  94  36.203  -6.527  -9.042
  676   1HG   GLU  94          HG2       GLU  94  33.688  -6.497  -9.086
  677   2HG   GLU  94          HG3       GLU  94  33.710  -5.072  -8.041
  678    H    TYR  95           H        TYR  95  36.808  -6.094  -5.083
  679    HA   TYR  95           HA       TYR  95  39.259  -7.726  -5.521
  680   1HB   TYR  95          HB2       TYR  95  40.479  -5.823  -4.586
  681   2HB   TYR  95          HB3       TYR  95  39.578  -5.380  -6.020
  682    HD1  TYR  95           HD1      TYR  95  39.755  -5.024  -2.322
  683    HD2  TYR  95           HD2      TYR  95  37.741  -3.765  -5.929
  684    HE1  TYR  95           HE1      TYR  95  38.693  -3.174  -1.076
  685    HE2  TYR  95           HE2      TYR  95  36.678  -1.905  -4.687
  686    HH   TYR  95           HH       TYR  95  37.315  -1.320  -1.193
  687    H    ASP  96           H        ASP  96  36.629  -7.860  -3.568
  688    HA   ASP  96           HA       ASP  96  38.212  -8.466  -1.113
  689   1HB   ASP  96          HB2       ASP  96  36.284  -6.795  -0.914
  690   2HB   ASP  96          HB3       ASP  96  35.195  -8.137  -1.259
  691    H    THR  97           H        THR  97  37.811 -10.006  -3.675
  692    HA   THR  97           HA       THR  97  35.995 -12.118  -3.289
  693    HB   THR  97           HB       THR  97  37.325 -12.915  -5.438
  694    HG1  THR  97           HG1      THR  97  38.648 -11.349  -6.293
  695   1HG2  THR  97          HG21      THR  97  36.192 -11.218  -6.797
  696   2HG2  THR  97          HG22      THR  97  35.143 -11.718  -5.463
  697   3HG2  THR  97          HG23      THR  97  35.996 -10.170  -5.375
  698    H    PHE  98           H        PHE  98  38.243 -11.902  -1.284
  699    HA   PHE  98           HA       PHE  98  38.835 -14.818  -1.182
  700   1HB   PHE  98          HB2       PHE  98  40.850 -13.487  -1.887
  701   2HB   PHE  98          HB3       PHE  98  40.756 -12.601  -0.371
  702    HD1  PHE  98           HD1      PHE  98  41.940 -13.437   1.524
  703    HD2  PHE  98           HD2      PHE  98  41.055 -16.088  -1.766
  704    HE1  PHE  98           HE1      PHE  98  43.333 -15.204   2.569
  705    HE2  PHE  98           HE2      PHE  98  42.448 -17.853  -0.714
  706    HZ   PHE  98           HZ       PHE  98  43.590 -17.416   1.455
  707    H    CYS  99           H        CYS  99  37.387 -12.079   0.265
  708    HA   CYS  99           HA       CYS  99  37.232 -13.403   2.907
  709   1HB   CYS  99          HB2       CYS  99  37.832 -10.448   2.418
  710   2HB   CYS  99          HB3       CYS  99  37.614 -11.217   3.992
  711    HG   CYS  99           HG       CYS  99  40.135 -10.632   3.648
  712    H    GLY 100           H        GLY 100  35.363 -13.138   0.554
  713   1HA   GLY 100          HA2       GLY 100  33.013 -12.166   2.019
  714   2HA   GLY 100          HA3       GLY 100  33.446 -11.255   0.565
  715    H    ALA 101           H        ALA 101  31.274 -12.041  -0.070
  716    HA   ALA 101           HA       ALA 101  30.670 -14.789  -0.643
  717   1HB   ALA 101          HB1       ALA 101  28.678 -13.792  -1.700
  718   2HB   ALA 101          HB2       ALA 101  28.992 -13.006  -0.145
  719   3HB   ALA 101          HB3       ALA 101  29.431 -12.183  -1.659
  720    H    ILE 102           H        ILE 102  33.198 -13.636  -1.930
  721    HA   ILE 102           HA       ILE 102  34.229 -13.187  -3.846
  722    HB   ILE 102           HB       ILE 102  32.779 -15.493  -5.132
  723   1HG1  ILE 102          HG12      ILE 102  34.819 -15.731  -2.881
  724   2HG1  ILE 102          HG13      ILE 102  33.132 -16.255  -2.832
  725   1HG2  ILE 102          HG21      ILE 102  34.648 -14.215  -6.324
  726   2HG2  ILE 102          HG22      ILE 102  35.746 -14.788  -5.054
  727   3HG2  ILE 102          HG23      ILE 102  34.933 -15.936  -6.138
  728   1HD1  ILE 102          HD11      ILE 102  33.607 -17.893  -4.664
  729   2HD1  ILE 102          HD12      ILE 102  35.338 -17.497  -4.496
  730   3HD1  ILE 102          HD13      ILE 102  34.455 -18.198  -3.135
  731    H    ASP 103           H        ASP 103  31.932 -11.607  -3.448
  732    HA   ASP 103           HA       ASP 103  30.569 -10.095  -4.380
  733   1HB   ASP 103          HB2       ASP 103  32.769  -9.518  -5.421
  734   2HB   ASP 103          HB3       ASP 103  32.287 -10.406  -6.860
  735    H    LYS 104           H        LYS 104  30.086 -13.165  -5.043
  736    HA   LYS 104           HA       LYS 104  28.920 -13.326  -7.605
  737   1HB   LYS 104          HB2       LYS 104  28.447 -14.965  -5.098
  738   2HB   LYS 104          HB3       LYS 104  27.884 -15.422  -6.698
  739   1HG   LYS 104          HG2       LYS 104  30.162 -15.501  -7.524
  740   2HG   LYS 104          HG3       LYS 104  30.789 -15.054  -5.943
  741   1HD   LYS 104          HD2       LYS 104  29.262 -17.596  -6.632
  742   2HD   LYS 104          HD3       LYS 104  30.996 -17.470  -6.290
  743   1HE   LYS 104          HE2       LYS 104  30.476 -16.689  -3.975
  744   2HE   LYS 104          HE3       LYS 104  28.753 -16.817  -4.324
  745   1HZ   LYS 104          HZ1       LYS 104  29.109 -19.215  -4.706
  746   2HZ   LYS 104          HZ2       LYS 104  30.650 -19.068  -4.157
  747   3HZ   LYS 104          HZ3       LYS 104  29.369 -18.715  -3.176
  748    H    LEU 105           H        LEU 105  27.329 -12.610  -4.467
  749    HA   LEU 105           HA       LEU 105  24.660 -12.944  -5.430
  750   1HB   LEU 105          HB2       LEU 105  25.333 -12.973  -3.052
  751   2HB   LEU 105          HB3       LEU 105  25.774 -11.280  -3.123
  752    HG   LEU 105           HG       LEU 105  23.667 -11.738  -1.965
  753   1HD1  LEU 105          HD11      LEU 105  24.043  -9.519  -3.089
  754   2HD1  LEU 105          HD12      LEU 105  23.024 -10.095  -4.431
  755   3HD1  LEU 105          HD13      LEU 105  22.349  -9.952  -2.811
  756   1HD2  LEU 105          HD21      LEU 105  22.520 -12.532  -4.676
  757   2HD2  LEU 105          HD22      LEU 105  22.855 -13.635  -3.319
  758   3HD2  LEU 105          HD23      LEU 105  21.625 -12.374  -3.156
  759    H    GLU 106           H        GLU 106  26.681 -10.000  -4.895
  760    HA   GLU 106           HA       GLU 106  24.951  -8.109  -6.002
  761   1HB   GLU 106          HB2       GLU 106  27.972  -8.084  -5.910
  762   2HB   GLU 106          HB3       GLU 106  26.881  -6.723  -6.121
  763   1HG   GLU 106          HG2       GLU 106  27.393  -6.673  -3.899
  764   2HG   GLU 106          HG3       GLU 106  25.769  -7.299  -3.926
  765    H    ALA 107           H        ALA 107  27.520 -10.147  -7.510
  766    HA   ALA 107           HA       ALA 107  27.523  -8.915 -10.046
  767   1HB   ALA 107          HB1       ALA 107  29.282 -10.488  -9.371
  768   2HB   ALA 107          HB2       ALA 107  28.107 -11.826  -9.338
  769   3HB   ALA 107          HB3       ALA 107  28.509 -11.030 -10.870
  770    H    GLU 108           H        GLU 108  25.576 -11.789  -8.867
  771    HA   GLU 108           HA       GLU 108  24.238 -12.068 -11.358
  772   1HB   GLU 108          HB2       GLU 108  23.772 -13.046  -8.557
  773   2HB   GLU 108          HB3       GLU 108  22.424 -13.107  -9.679
  774   1HG   GLU 108          HG2       GLU 108  25.134 -14.415 -10.118
  775   2HG   GLU 108          HG3       GLU 108  23.629 -15.214  -9.685
  776    H    LEU 109           H        LEU 109  23.439 -10.030  -8.502
  777    HA   LEU 109           HA       LEU 109  20.875  -9.200  -9.436
  778   1HB   LEU 109          HB2       LEU 109  22.975  -7.882  -7.670
  779   2HB   LEU 109          HB3       LEU 109  21.493  -7.036  -8.101
  780    HG   LEU 109           HG       LEU 109  21.589  -9.702  -6.645
  781   1HD1  LEU 109          HD11      LEU 109  21.029  -6.897  -5.589
  782   2HD1  LEU 109          HD12      LEU 109  20.976  -8.407  -4.653
  783   3HD1  LEU 109          HD13      LEU 109  22.514  -7.825  -5.308
  784   1HD2  LEU 109          HD21      LEU 109  19.263  -7.789  -7.179
  785   2HD2  LEU 109          HD22      LEU 109  19.452  -9.414  -7.864
  786   3HD2  LEU 109          HD23      LEU 109  19.200  -9.223  -6.132
  787    H    LYS 110           H        LYS 110  24.133  -7.791 -10.073
  788    HA   LYS 110           HA       LYS 110  23.148  -5.628 -11.657
  789   1HB   LYS 110          HB2       LYS 110  25.870  -7.004 -11.563
  790   2HB   LYS 110          HB3       LYS 110  25.545  -5.440 -12.330
  791   1HG   LYS 110          HG2       LYS 110  25.059  -4.386 -10.237
  792   2HG   LYS 110          HG3       LYS 110  24.895  -5.883  -9.396
  793   1HD   LYS 110          HD2       LYS 110  26.920  -5.289  -8.601
  794   2HD   LYS 110          HD3       LYS 110  27.427  -6.298  -9.933
  795   1HE   LYS 110          HE2       LYS 110  27.183  -3.247 -10.075
  796   2HE   LYS 110          HE3       LYS 110  28.660  -4.092  -9.623
  797   1HZ   LYS 110          HZ1       LYS 110  28.724  -3.524 -11.931
  798   2HZ   LYS 110          HZ2       LYS 110  28.668  -5.143 -11.818
  799   3HZ   LYS 110          HZ3       LYS 110  27.333  -4.295 -12.264
  800    H    ASN 111           H        ASN 111  24.263  -8.928 -12.423
  801    HA   ASN 111           HA       ASN 111  24.209  -8.728 -15.264
  802   1HB   ASN 111          HB2       ASN 111  25.330 -10.594 -14.738
  803   2HB   ASN 111          HB3       ASN 111  24.607 -10.752 -13.185
  804   1HD2  ASN 111          HD21      ASN 111  22.482 -11.706 -12.910
  805   2HD2  ASN 111          HD22      ASN 111  22.336 -13.203 -13.739
  806    H    SER 112           H        SER 112  21.684  -9.308 -12.850
  807    HA   SER 112           HA       SER 112  19.778 -10.274 -14.771
  808   1HB   SER 112          HB2       SER 112  19.222  -9.192 -12.012
  809   2HB   SER 112          HB3       SER 112  18.192 -10.239 -13.015
  810    HG   SER 112           HG       SER 112  20.676 -10.915 -11.845
  811    H    GLY 113           H        GLY 113  20.956  -7.083 -14.126
  812   1HA   GLY 113          HA2       GLY 113  20.329  -5.726 -16.122
  813   2HA   GLY 113          HA3       GLY 113  18.648  -5.904 -15.618
  814    H    ALA 114           H        ALA 114  19.658  -5.680 -12.663
  815    HA   ALA 114           HA       ALA 114  19.034  -2.886 -12.496
  816   1HB   ALA 114          HB1       ALA 114  20.003  -4.834 -10.349
  817   2HB   ALA 114          HB2       ALA 114  19.378  -3.194 -10.051
  818   3HB   ALA 114          HB3       ALA 114  18.309  -4.409 -10.704
  819    H    LYS 115           H        LYS 115  20.423  -1.377 -11.133
  820    HA   LYS 115           HA       LYS 115  23.342  -1.851 -11.478
  821   1HB   LYS 115          HB2       LYS 115  23.676   0.546 -11.721
  822   2HB   LYS 115          HB3       LYS 115  22.690  -0.081 -13.040
  823   1HG   LYS 115          HG2       LYS 115  20.653   0.851 -12.032
  824   2HG   LYS 115          HG3       LYS 115  21.556   1.360 -10.597
  825   1HD   LYS 115          HD2       LYS 115  22.961   2.849 -12.037
  826   2HD   LYS 115          HD3       LYS 115  21.952   2.399 -13.430
  827   1HE   LYS 115          HE2       LYS 115  19.945   3.269 -12.216
  828   2HE   LYS 115          HE3       LYS 115  20.982   3.739 -10.858
  829   1HZ   LYS 115          HZ1       LYS 115  21.184   4.828 -13.610
  830   2HZ   LYS 115          HZ2       LYS 115  20.540   5.605 -12.333
  831   3HZ   LYS 115          HZ3       LYS 115  22.133   5.266 -12.353
  832    H    GLN 116           H        GLN 116  24.558  -1.342  -9.630
  833    HA   GLN 116           HA       GLN 116  23.008  -0.946  -7.144
  834   1HB   GLN 116          HB2       GLN 116  24.942  -2.599  -7.290
  835   2HB   GLN 116          HB3       GLN 116  26.008  -1.201  -7.416
  836   1HG   GLN 116          HG2       GLN 116  24.958  -0.321  -5.273
  837   2HG   GLN 116          HG3       GLN 116  24.080  -1.845  -5.133
  838   1HE2  GLN 116          HE22      GLN 116  26.340  -0.452  -3.521
  839   2HE2  GLN 116          HE21      GLN 116  27.535  -1.718  -3.333
  840    H    THR 117           H        THR 117  22.388   1.217  -6.949
  841    HA   THR 117           HA       THR 117  23.989   3.342  -8.219
  842    HB   THR 117           HB       THR 117  21.557   3.433  -6.392
  843    HG1  THR 117           HG1      THR 117  21.402   2.588  -8.562
  844   1HG2  THR 117          HG21      THR 117  22.795   5.544  -6.125
  845   2HG2  THR 117          HG22      THR 117  22.999   5.677  -7.885
  846   3HG2  THR 117          HG23      THR 117  21.395   5.829  -7.155
  847    H    GLY 118           H        GLY 118  25.166   4.962  -7.042
  848   1HA   GLY 118          HA2       GLY 118  26.408   5.839  -5.316
  849   2HA   GLY 118          HA3       GLY 118  25.515   4.822  -4.185
  850    H    GLU 119           H        GLU 119  26.904   3.644  -3.109
  851    HA   GLU 119           HA       GLU 119  28.390   1.563  -4.411
  852   1HB   GLU 119          HB2       GLU 119  30.572   1.938  -3.590
  853   2HB   GLU 119          HB3       GLU 119  30.095   3.444  -4.365
  854   1HG   GLU 119          HG2       GLU 119  29.575   4.442  -2.185
  855   2HG   GLU 119          HG3       GLU 119  30.103   2.934  -1.402
  856    H    THR 120           H        THR 120  29.477   0.213  -2.456
  857    HA   THR 120           HA       THR 120  27.470  -0.758  -0.837
  858    HB   THR 120           HB       THR 120  30.299  -0.818   0.129
  859    HG1  THR 120           HG1      THR 120  29.711  -2.254  -2.208
  860   1HG2  THR 120          HG21      THR 120  28.587  -2.325   1.085
  861   2HG2  THR 120          HG22      THR 120  28.294  -3.026  -0.520
  862   3HG2  THR 120          HG23      THR 120  29.876  -3.237   0.270
  863    H    LEU 121           H        LEU 121  26.498  -0.047   0.948
  864    HA   LEU 121           HA       LEU 121  27.415   2.421   2.304
  865   1HB   LEU 121          HB2       LEU 121  24.956   1.517   1.363
  866   2HB   LEU 121          HB3       LEU 121  24.878   1.047   3.056
  867    HG   LEU 121           HG       LEU 121  25.307   3.795   1.922
  868   1HD1  LEU 121          HD11      LEU 121  23.100   4.323   2.757
  869   2HD1  LEU 121          HD12      LEU 121  23.013   2.920   1.687
  870   3HD1  LEU 121          HD13      LEU 121  22.933   2.693   3.450
  871   1HD2  LEU 121          HD21      LEU 121  25.117   2.968   4.853
  872   2HD2  LEU 121          HD22      LEU 121  26.472   3.810   4.041
  873   3HD2  LEU 121          HD23      LEU 121  24.946   4.636   4.279
  874    H    LYS 122           H        LYS 122  27.459   2.380   4.733
  875    HA   LYS 122           HA       LYS 122  27.428  -0.280   5.995
  876   1HB   LYS 122          HB2       LYS 122  29.816   1.616   6.048
  877   2HB   LYS 122          HB3       LYS 122  29.551   0.348   7.247
  878   1HG   LYS 122          HG2       LYS 122  29.441  -1.305   5.354
  879   2HG   LYS 122          HG3       LYS 122  29.949  -0.016   4.247
  880   1HD   LYS 122          HD2       LYS 122  32.019   0.296   5.579
  881   2HD   LYS 122          HD3       LYS 122  31.539  -1.014   6.655
  882   1HE   LYS 122          HE2       LYS 122  32.132  -1.233   3.664
  883   2HE   LYS 122          HE3       LYS 122  33.184  -1.751   4.981
  884   1HZ   LYS 122          HZ1       LYS 122  32.106  -3.652   4.205
  885   2HZ   LYS 122          HZ2       LYS 122  31.336  -3.337   5.602
  886   3HZ   LYS 122          HZ3       LYS 122  30.619  -2.997   4.159
  887    H    ILE 123           H        ILE 123  27.000  -0.196   8.189
  888    HA   ILE 123           HA       ILE 123  26.022   2.334   9.363
  889    HB   ILE 123           HB       ILE 123  24.025   0.617   9.991
  890   1HG1  ILE 123          HG12      ILE 123  23.208  -0.495   7.928
  891   2HG1  ILE 123          HG13      ILE 123  24.725  -0.237   7.133
  892   1HG2  ILE 123          HG21      ILE 123  23.773   2.869   9.031
  893   2HG2  ILE 123          HG22      ILE 123  24.116   2.226   7.408
  894   3HG2  ILE 123          HG23      ILE 123  22.660   1.707   8.295
  895   1HD1  ILE 123          HD11      ILE 123  24.389  -1.914   9.658
  896   2HD1  ILE 123          HD12      ILE 123  24.342  -2.558   8.005
  897   3HD1  ILE 123          HD13      ILE 123  25.830  -1.831   8.608
  898    H    ASN 124           H        ASN 124  26.673   2.422  11.529
  899    HA   ASN 124           HA       ASN 124  26.655   0.121  13.132
  900   1HB   ASN 124          HB2       ASN 124  28.990   0.098  11.642
  901   2HB   ASN 124          HB3       ASN 124  29.503   1.064  13.020
  902   1HD2  ASN 124          HD22      ASN 124  27.316  -1.801  12.560
  903   2HD2  ASN 124          HD21      ASN 124  27.939  -2.693  13.943
  904    H    ILE 125           H        ILE 125  28.235   0.705  15.247
  905    HA   ILE 125           HA       ILE 125  27.698   3.419  16.147
  906    HB   ILE 125           HB       ILE 125  25.506   2.277  16.219
  907   1HG1  ILE 125          HG12      ILE 125  26.451   2.728  19.065
  908   2HG1  ILE 125          HG13      ILE 125  26.174   4.031  17.899
  909   1HG2  ILE 125          HG21      ILE 125  26.723   0.320  18.208
  910   2HG2  ILE 125          HG22      ILE 125  25.028   0.397  17.701
  911   3HG2  ILE 125          HG23      ILE 125  26.262  -0.066  16.540
  912   1HD1  ILE 125          HD11      ILE 125  24.092   2.061  18.930
  913   2HD1  ILE 125          HD12      ILE 125  24.226   3.786  19.301
  914   3HD1  ILE 125          HD13      ILE 125  23.805   3.273  17.656
  915    H    LEU 126           H        LEU 126  28.341   3.395  18.650
  916    HA   LEU 126           HA       LEU 126  31.023   2.721  18.900
  917   1HB   LEU 126          HB2       LEU 126  29.860   4.401  20.200
  918   2HB   LEU 126          HB3       LEU 126  28.920   3.185  21.058
  919    HG   LEU 126           HG       LEU 126  31.936   2.993  21.197
  920   1HD1  LEU 126          HD11      LEU 126  31.536   5.389  21.536
  921   2HD1  LEU 126          HD12      LEU 126  30.306   5.033  22.768
  922   3HD1  LEU 126          HD13      LEU 126  32.012   4.617  23.053
  923   1HD2  LEU 126          HD21      LEU 126  31.468   2.292  23.526
  924   2HD2  LEU 126          HD22      LEU 126  29.739   2.624  23.300
  925   3HD2  LEU 126          HD23      LEU 126  30.524   1.307  22.413
  926    H    ASP 127           H        ASP 127  28.199   0.731  19.765
  927    HA   ASP 127           HA       ASP 127  29.818  -1.480  20.816
  928   1HB   ASP 127          HB2       ASP 127  27.566  -1.227  21.666
  929   2HB   ASP 127          HB3       ASP 127  26.888  -1.270  20.036
  930    H    HIS 128           H        HIS 128  31.305  -1.376  19.027
  931    HA   HIS 128           HA       HIS 128  30.725  -1.426  16.385
  932   1HB   HIS 128          HB2       HIS 128  33.129  -2.557  17.838
  933   2HB   HIS 128          HB3       HIS 128  33.059  -2.382  16.091
  934    HD1  HIS 128           HD1      HIS 128  31.423   0.647  16.683
  935    HD2  HIS 128           HD2      HIS 128  35.275  -0.795  17.614
  936    HE1  HIS 128           HE1      HIS 128  32.924   2.687  16.886
  937    H    ASP 129           H        ASP 129  30.984  -2.884  14.681
  938    HA   ASP 129           HA       ASP 129  30.885  -5.768  15.106
  939   1HB   ASP 129          HB2       ASP 129  28.989  -4.362  13.193
  940   2HB   ASP 129          HB3       ASP 129  29.111  -6.087  13.452
  941    H    ILE 130           H        ILE 130  30.717  -6.468  12.460
  942    HA   ILE 130           HA       ILE 130  33.297  -6.141  11.443
  943    HB   ILE 130           HB       ILE 130  30.697  -7.226  10.399
  944   1HG1  ILE 130          HG12      ILE 130  31.988  -9.305  10.240
  945   2HG1  ILE 130          HG13      ILE 130  33.477  -8.468  10.660
  946   1HG2  ILE 130          HG21      ILE 130  31.572  -6.264   8.334
  947   2HG2  ILE 130          HG22      ILE 130  33.172  -6.980   8.644
  948   3HG2  ILE 130          HG23      ILE 130  31.764  -8.011   8.309
  949   1HD1  ILE 130          HD11      ILE 130  31.088  -8.744  12.535
  950   2HD1  ILE 130          HD12      ILE 130  32.490  -9.831  12.506
  951   3HD1  ILE 130          HD13      ILE 130  32.712  -8.134  12.945
  952    HA   PRO 131           HA       PRO 131  31.845  -2.800   8.279
  953   1HB   PRO 131          HB2       PRO 131  29.730  -1.152   8.988
  954   2HB   PRO 131          HB3       PRO 131  29.538  -2.636   7.994
  955   1HG   PRO 131          HG2       PRO 131  29.277  -2.374  11.014
  956   2HG   PRO 131          HG3       PRO 131  28.079  -3.037   9.905
  957   1HD   PRO 131          HD2       PRO 131  29.657  -4.728  11.128
  958   2HD   PRO 131          HD3       PRO 131  29.523  -4.915   9.364
  959    H    GLU 132           H        GLU 132  31.073  -2.174  11.646
  960    HA   GLU 132           HA       GLU 132  32.142  -1.139  13.331
  961   1HB   GLU 132          HB2       GLU 132  34.159  -2.137  12.164
  962   2HB   GLU 132          HB3       GLU 132  34.471  -0.536  11.489
  963   1HG   GLU 132          HG2       GLU 132  34.689   0.397  13.764
  964   2HG   GLU 132          HG3       GLU 132  34.263  -1.170  14.459
  965    H    ASP 133           H        ASP 133  31.852   0.747  10.356
  966    HA   ASP 133           HA       ASP 133  31.592   3.254  11.953
  967   1HB   ASP 133          HB2       ASP 133  33.868   3.117  11.142
  968   2HB   ASP 133          HB3       ASP 133  33.318   2.709   9.518
  969    HA   PRO 134           HA       PRO 134  28.073   3.393   9.094
  970   1HB   PRO 134          HB2       PRO 134  26.906   5.740   9.915
  971   2HB   PRO 134          HB3       PRO 134  26.784   4.216  10.838
  972   1HG   PRO 134          HG2       PRO 134  28.711   6.510  11.276
  973   2HG   PRO 134          HG3       PRO 134  27.729   5.640  12.496
  974   1HD   PRO 134          HD2       PRO 134  30.352   5.051  12.035
  975   2HD   PRO 134          HD3       PRO 134  29.175   3.776  12.459
  976    H    ALA 135           H        ALA 135  27.446   4.619   7.245
  977    HA   ALA 135           HA       ALA 135  29.158   6.907   6.413
  978   1HB   ALA 135          HB1       ALA 135  30.168   4.825   5.532
  979   2HB   ALA 135          HB2       ALA 135  28.619   4.381   4.784
  980   3HB   ALA 135          HB3       ALA 135  29.498   5.820   4.229
  981    H    GLU 136           H        GLU 136  26.599   7.142   7.465
  982    HA   GLU 136           HA       GLU 136  24.432   6.695   5.800
  983   1HB   GLU 136          HB2       GLU 136  23.186   8.159   7.278
  984   2HB   GLU 136          HB3       GLU 136  24.287   7.130   8.194
  985   1HG   GLU 136          HG2       GLU 136  25.887   9.031   8.407
  986   2HG   GLU 136          HG3       GLU 136  24.789  10.061   7.489
  987    H    GLU 137           H        GLU 137  26.746   9.265   5.366
  988    HA   GLU 137           HA       GLU 137  25.143  11.138   3.906
  989   1HB   GLU 137          HB2       GLU 137  28.083  10.375   3.653
  990   2HB   GLU 137          HB3       GLU 137  27.329  11.769   2.863
  991   1HG   GLU 137          HG2       GLU 137  26.682  12.675   5.097
  992   2HG   GLU 137          HG3       GLU 137  27.514  11.327   5.876
  993    H    TRP 138           H        TRP 138  26.407   7.953   3.046
  994    HA   TRP 138           HA       TRP 138  26.103   8.072   0.211
  995   1HB   TRP 138          HB2       TRP 138  25.811   5.887   2.278
  996   2HB   TRP 138          HB3       TRP 138  25.502   5.604   0.581
  997    HD1  TRP 138           HD1      TRP 138  27.100   3.835   0.182
  998    HE1  TRP 138           HE1      TRP 138  29.588   3.525   0.150
  999    HE3  TRP 138           HE3      TRP 138  28.506   8.366   2.208
 1000    HZ2  TRP 138           HZ2      TRP 138  31.959   5.026   0.921
 1001    HZ3  TRP 138           HZ3      TRP 138  30.892   8.871   2.538
 1002    HH2  TRP 138           HH2      TRP 138  32.634   7.216   1.904
 1003    H    LEU 139           H        LEU 139  23.783   7.452   2.911
 1004    HA   LEU 139           HA       LEU 139  21.575   6.552   1.264
 1005   1HB   LEU 139          HB2       LEU 139  22.114   6.580   3.953
 1006   2HB   LEU 139          HB3       LEU 139  21.196   8.045   3.873
 1007    HG   LEU 139           HG       LEU 139  19.301   6.774   2.760
 1008   1HD1  LEU 139          HD11      LEU 139  20.914   4.343   3.679
 1009   2HD1  LEU 139          HD12      LEU 139  19.254   4.310   3.081
 1010   3HD1  LEU 139          HD13      LEU 139  20.559   4.759   1.986
 1011   1HD2  LEU 139          HD21      LEU 139  20.216   5.922   5.547
 1012   2HD2  LEU 139          HD22      LEU 139  19.288   7.381   5.143
 1013   3HD2  LEU 139          HD23      LEU 139  18.558   5.783   4.927
 1014    H    GLY 140           H        GLY 140  22.448   9.611   2.829
 1015   1HA   GLY 140          HA2       GLY 140  20.440  11.300   1.831
 1016   2HA   GLY 140          HA3       GLY 140  22.096  11.824   2.194
 1017    H    SER 141           H        SER 141  23.638  10.525   0.226
 1018    HA   SER 141           HA       SER 141  23.312  12.058  -2.063
 1019   1HB   SER 141          HB2       SER 141  24.808   9.508  -1.286
 1020   2HB   SER 141          HB3       SER 141  25.050  10.379  -2.755
 1021    HG   SER 141           HG       SER 141  25.560  11.142  -0.094
 1022    H    TRP 142           H        TRP 142  22.921   8.535  -1.627
 1023    HA   TRP 142           HA       TRP 142  21.880   7.752  -4.050
 1024   1HB   TRP 142          HB2       TRP 142  22.706   6.327  -2.258
 1025   2HB   TRP 142          HB3       TRP 142  21.361   6.781  -1.240
 1026    HD1  TRP 142           HD1      TRP 142  22.216   4.557  -4.213
 1027    HE1  TRP 142           HE1      TRP 142  20.413   2.732  -4.440
 1028    HE3  TRP 142           HE3      TRP 142  19.127   6.087  -0.464
 1029    HZ2  TRP 142           HZ2      TRP 142  17.896   2.065  -3.153
 1030    HZ3  TRP 142           HZ3      TRP 142  17.026   4.837   0.033
 1031    HH2  TRP 142           HH2      TRP 142  16.408   2.838  -1.314
 1032    H    VAL 143           H        VAL 143  20.028   9.024  -1.251
 1033    HA   VAL 143           HA       VAL 143  17.425   8.859  -2.426
 1034    HB   VAL 143           HB       VAL 143  18.698  10.390  -0.139
 1035   1HG1  VAL 143          HG11      VAL 143  16.506  11.252   0.538
 1036   2HG1  VAL 143          HG12      VAL 143  17.076  11.987  -0.948
 1037   3HG1  VAL 143          HG13      VAL 143  15.820  10.723  -1.024
 1038   1HG2  VAL 143          HG21      VAL 143  17.132   9.019   1.203
 1039   2HG2  VAL 143          HG22      VAL 143  16.494   8.284  -0.289
 1040   3HG2  VAL 143          HG23      VAL 143  18.167   8.006   0.198
 1041    H    ASN 144           H        ASN 144  19.665  11.736  -2.109
 1042    HA   ASN 144           HA       ASN 144  17.844  13.300  -3.604
 1043   1HB   ASN 144          HB2       ASN 144  19.080  15.060  -3.119
 1044   2HB   ASN 144          HB3       ASN 144  19.912  13.979  -2.015
 1045   1HD2  ASN 144          HD22      ASN 144  21.693  12.579  -3.495
 1046   2HD2  ASN 144          HD21      ASN 144  22.778  13.663  -4.346
 1047    H    LEU 145           H        LEU 145  20.110  10.994  -4.738
 1048    HA   LEU 145           HA       LEU 145  20.263  11.984  -7.466
 1049   1HB   LEU 145          HB2       LEU 145  21.178   9.572  -5.950
 1050   2HB   LEU 145          HB3       LEU 145  20.705   9.256  -7.609
 1051    HG   LEU 145           HG       LEU 145  22.261  10.934  -8.461
 1052   1HD1  LEU 145          HD11      LEU 145  23.988  11.933  -7.011
 1053   2HD1  LEU 145          HD12      LEU 145  22.379  12.497  -6.550
 1054   3HD1  LEU 145          HD13      LEU 145  23.193  11.252  -5.576
 1055   1HD2  LEU 145          HD21      LEU 145  24.329   9.683  -7.965
 1056   2HD2  LEU 145          HD22      LEU 145  23.545   8.917  -6.565
 1057   3HD2  LEU 145          HD23      LEU 145  22.965   8.582  -8.211
 1058    H    LEU 146           H        LEU 146  18.121   9.686  -5.676
 1059    HA   LEU 146           HA       LEU 146  16.783   8.893  -8.125
 1060   1HB   LEU 146          HB2       LEU 146  15.785   7.344  -6.915
 1061   2HB   LEU 146          HB3       LEU 146  17.271   7.523  -6.038
 1062    HG   LEU 146           HG       LEU 146  15.718   9.001  -4.419
 1063   1HD1  LEU 146          HD11      LEU 146  13.494   7.893  -4.212
 1064   2HD1  LEU 146          HD12      LEU 146  13.635   8.797  -5.721
 1065   3HD1  LEU 146          HD13      LEU 146  13.789   7.028  -5.725
 1066   1HD2  LEU 146          HD21      LEU 146  15.443   6.947  -3.078
 1067   2HD2  LEU 146          HD22      LEU 146  15.786   5.952  -4.514
 1068   3HD2  LEU 146          HD23      LEU 146  17.047   6.989  -3.829
 1069    H    LYS 147           H        LYS 147  16.255  11.142  -5.556
 1070    HA   LYS 147           HA       LYS 147  13.599  11.995  -5.993
 1071   1HB   LYS 147          HB2       LYS 147  16.138  13.355  -5.030
 1072   2HB   LYS 147          HB3       LYS 147  14.659  14.276  -5.282
 1073   1HG   LYS 147          HG2       LYS 147  13.432  12.714  -3.760
 1074   2HG   LYS 147          HG3       LYS 147  14.969  11.904  -3.405
 1075   1HD   LYS 147          HD2       LYS 147  15.896  14.004  -2.509
 1076   2HD   LYS 147          HD3       LYS 147  14.413  14.873  -2.909
 1077   1HE   LYS 147          HE2       LYS 147  14.557  12.499  -0.993
 1078   2HE   LYS 147          HE3       LYS 147  14.658  14.183  -0.482
 1079   1HZ   LYS 147          HZ1       LYS 147  12.438  13.224  -0.286
 1080   2HZ   LYS 147          HZ2       LYS 147  12.436  14.547  -1.258
 1081   3HZ   LYS 147          HZ3       LYS 147  12.324  13.042  -1.903