*HEADER    DNA BINDING PROTEIN                     22-AUG-09   2KNG              
*TITLE     SOLUTION STRUCTURE OF C-DOMAIN OF LSR2                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN LSR2;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 66-112;                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS;                     
*SOURCE   3 ORGANISM_TAXID: 1773;                                                
*SOURCE   4 GENE: LSR2;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21D                                    
*KEYWDS    DNA-BINDING DOMAIN, IMMUNE RESPONSE, DNA BINDING PROTEIN              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.LI, B.XIA                                                           
*REVDAT   1   16-MAR-10 2KNG    0                                                


# 845 atoms read from pdb file prm1_new.pdb.
# 74 ALA PHI:  (73 GLY C)-(74 ALA N)-(74 ALA CA)-(74 ALA C) -180.0   0.0
 &rst     iat =    99,   101,   103,   109,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
   rk2 =   50.0, rk3 =   50.0,    &end

# 76 ASP PHI:  (75 ILE C)-(76 ASP N)-(76 ASP CA)-(76 ASP C) -180.0   0.0
 &rst     iat =   128,   130,   132,   140,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 77 ARG PHI:  (76 ASP C)-(77 ARG N)-(77 ARG CA)-(77 ARG C) -180.0   0.0
 &rst     iat =   140,   142,   144,   164,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 78 GLU PHI:  (77 ARG C)-(78 GLU N)-(78 GLU CA)-(78 GLU C) -93.0 -33.0
 &rst     iat =   164,   166,   168,   179,
   r1 = -94.0, r2 = -93.0, r3 = -33.0, r4 = -32.0,
 &end

# 78 GLU PSI:  (78 GLU N)-(78 GLU CA)-(78 GLU C)-(79 GLN N) -74.0 -14.0
 &rst     iat =   166,   168,   179,   181,
   r1 = -75.0, r2 = -74.0, r3 = -14.0, r4 = -13.0,
 &end

# 79 GLN PHI:  (78 GLU C)-(79 GLN N)-(79 GLN CA)-(79 GLN C) -92.0 -32.0
 &rst     iat =   179,   181,   183,   196,
   r1 = -93.0, r2 = -92.0, r3 = -32.0, r4 = -31.0,
 &end

# 79 GLN PSI:  (79 GLN N)-(79 GLN CA)-(79 GLN C)-(80 SER N) -72.0 -12.0
 &rst     iat =   181,   183,   196,   198,
   r1 = -73.0, r2 = -72.0, r3 = -12.0, r4 = -11.0,
 &end

# 80 SER PHI:  (79 GLN C)-(80 SER N)-(80 SER CA)-(80 SER C) -95.0 -35.0
 &rst     iat =   196,   198,   200,   207,
   r1 = -96.0, r2 = -95.0, r3 = -35.0, r4 = -34.0,
 &end

# 80 SER PSI:  (80 SER N)-(80 SER CA)-(80 SER C)-(81 ALA N) -65.0  -5.0
 &rst     iat =   198,   200,   207,   209,
   r1 = -66.0, r2 = -65.0, r3 =  -5.0, r4 =  -4.0,
 &end

# 81 ALA PHI:  (80 SER C)-(81 ALA N)-(81 ALA CA)-(81 ALA C) -94.0 -34.0
 &rst     iat =   207,   209,   211,   217,
   r1 = -95.0, r2 = -94.0, r3 = -34.0, r4 = -33.0,
 &end

# 81 ALA PSI:  (81 ALA N)-(81 ALA CA)-(81 ALA C)-(82 ALA N) -72.0 -12.0
 &rst     iat =   209,   211,   217,   219,
   r1 = -73.0, r2 = -72.0, r3 = -12.0, r4 = -11.0,
 &end

# 82 ALA PHI:  (81 ALA C)-(82 ALA N)-(82 ALA CA)-(82 ALA C) -96.0 -36.0
 &rst     iat =   217,   219,   221,   227,
   r1 = -97.0, r2 = -96.0, r3 = -36.0, r4 = -35.0,
 &end

# 82 ALA PSI:  (82 ALA N)-(82 ALA CA)-(82 ALA C)-(83 ILE N) -71.0 -11.0
 &rst     iat =   219,   221,   227,   229,
   r1 = -72.0, r2 = -71.0, r3 = -11.0, r4 = -10.0,
 &end

# 83 ILE PHI:  (82 ALA C)-(83 ILE N)-(83 ILE CA)-(83 ILE C) -92.0 -32.0
 &rst     iat =   227,   229,   231,   246,
   r1 = -93.0, r2 = -92.0, r3 = -32.0, r4 = -31.0,
 &end

# 83 ILE PSI:  (83 ILE N)-(83 ILE CA)-(83 ILE C)-(84 ARG N) -74.0 -14.0
 &rst     iat =   229,   231,   246,   248,
   r1 = -75.0, r2 = -74.0, r3 = -14.0, r4 = -13.0,
 &end

# 84 ARG PHI:  (83 ILE C)-(84 ARG N)-(84 ARG CA)-(84 ARG C) -94.0 -34.0
 &rst     iat =   246,   248,   250,   270,
   r1 = -95.0, r2 = -94.0, r3 = -34.0, r4 = -33.0,
 &end

# 84 ARG PSI:  (84 ARG N)-(84 ARG CA)-(84 ARG C)-(85 GLU N) -67.0  -7.0
 &rst     iat =   248,   250,   270,   272,
   r1 = -68.0, r2 = -67.0, r3 =  -7.0, r4 =  -6.0,
 &end

# 85 GLU PHI:  (84 ARG C)-(85 GLU N)-(85 GLU CA)-(85 GLU C) -96.0 -36.0
 &rst     iat =   270,   272,   274,   285,
   r1 = -97.0, r2 = -96.0, r3 = -36.0, r4 = -35.0,
 &end

# 85 GLU PSI:  (85 GLU N)-(85 GLU CA)-(85 GLU C)-(86 TRP N) -73.0 -13.0
 &rst     iat =   272,   274,   285,   287,
   r1 = -74.0, r2 = -73.0, r3 = -13.0, r4 = -12.0,
 &end

# 86 TRP PHI:  (85 GLU C)-(86 TRP N)-(86 TRP CA)-(86 TRP C) -93.7 -33.7
 &rst     iat =   285,   287,   289,   309,
   r1 = -94.7, r2 = -93.7, r3 = -33.7, r4 = -32.7,
 &end

# 86 TRP PSI:  (86 TRP N)-(86 TRP CA)-(86 TRP C)-(87 ALA N) -70.4 -10.4
 &rst     iat =   287,   289,   309,   311,
   r1 = -71.4, r2 = -70.4, r3 = -10.4, r4 =  -9.4,
 &end

# 87 ALA PHI:  (86 TRP C)-(87 ALA N)-(87 ALA CA)-(87 ALA C) -95.3 -35.3
 &rst     iat =   309,   311,   313,   319,
   r1 = -96.3, r2 = -95.3, r3 = -35.3, r4 = -34.3,
 &end

# 87 ALA PSI:  (87 ALA N)-(87 ALA CA)-(87 ALA C)-(88 ARG N) -69.0  -9.0
 &rst     iat =   311,   313,   319,   321,
   r1 = -70.0, r2 = -69.0, r3 =  -9.0, r4 =  -8.0,
 &end

# 88 ARG PHI:  (87 ALA C)-(88 ARG N)-(88 ARG CA)-(88 ARG C) -95.0 -35.0
 &rst     iat =   319,   321,   323,   343,
   r1 = -96.0, r2 = -95.0, r3 = -35.0, r4 = -34.0,
 &end

# 88 ARG PSI:  (88 ARG N)-(88 ARG CA)-(88 ARG C)-(89 ARG N) -74.4 -14.4
 &rst     iat =   321,   323,   343,   345,
   r1 = -75.4, r2 = -74.4, r3 = -14.4, r4 = -13.4,
 &end

# 89 ARG PHI:  (88 ARG C)-(89 ARG N)-(89 ARG CA)-(89 ARG C) -94.9 -34.9
 &rst     iat =   343,   345,   347,   367,
   r1 = -95.9, r2 = -94.9, r3 = -34.9, r4 = -33.9,
 &end

# 89 ARG PSI:  (89 ARG N)-(89 ARG CA)-(89 ARG C)-(90 ASN N) -65.5  -5.5
 &rst     iat =   345,   347,   367,   369,
   r1 = -66.5, r2 = -65.5, r3 =  -5.5, r4 =  -4.5,
 &end

# 92 HIS PHI:  (91 GLY C)-(92 HIS N)-(92 HIS CA)-(92 HIS C) -123.7 -63.7
 &rst     iat =   388,   390,   392,   406,
   r1 = -124.7, r2 = -123.7, r3 = -63.7, r4 = -62.7,
 &end

# 92 HIS PSI:  (92 HIS N)-(92 HIS CA)-(92 HIS C)-(93 ASN N) 106.7 166.7
 &rst     iat =   390,   392,   406,   408,
   r1 = 105.7, r2 = 106.7, r3 = 166.7, r4 = 167.7,
 &end

# 93 ASN PHI:  (92 HIS C)-(93 ASN N)-(93 ASN CA)-(93 ASN C) -117.4 -57.4
 &rst     iat =   406,   408,   410,   420,
   r1 = -118.4, r2 = -117.4, r3 = -57.4, r4 = -56.4,
 &end

# 93 ASN PSI:  (93 ASN N)-(93 ASN CA)-(93 ASN C)-(94 VAL N) 103.2 163.2
 &rst     iat =   408,   410,   420,   422,
   r1 = 102.2, r2 = 103.2, r3 = 163.2, r4 = 164.2,
 &end

# 94 VAL PHI:  (93 ASN C)-(94 VAL N)-(94 VAL CA)-(94 VAL C) -150.1 -80.1
 &rst     iat =   420,   422,   424,   436,
   r1 = -151.1, r2 = -150.1, r3 = -80.1, r4 = -79.1,
 &end

# 94 VAL PSI:  (94 VAL N)-(94 VAL CA)-(94 VAL C)-(95 SER N)  97.9 157.9
 &rst     iat =   422,   424,   436,   438,
   r1 =  96.9, r2 =  97.9, r3 = 157.9, r4 = 158.9,
 &end

# 97 ARG PHI:  (96 THR C)-(97 ARG N)-(97 ARG CA)-(97 ARG C) -180.0   0.0
 &rst     iat =   461,   463,   465,   485,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 99 ARG PHI:  (98 GLY C)-(99 ARG N)-(99 ARG CA)-(99 ARG C) -122.9 -62.9
 &rst     iat =   492,   494,   496,   516,
   r1 = -123.9, r2 = -122.9, r3 = -62.9, r4 = -61.9,
 &end

# 99 ARG PSI:  (99 ARG N)-(99 ARG CA)-(99 ARG C)-(100 ILE N)  92.7 152.7
 &rst     iat =   494,   496,   516,   518,
   r1 =  91.7, r2 =  92.7, r3 = 152.7, r4 = 153.7,
 &end

# 100 ILE PHI:  (99 ARG C)-(100 ILE N)-(100 ILE CA)-(100 ILE C) -135.5 -75.5
 &rst     iat =   516,   518,   520,   535,
   r1 = -136.5, r2 = -135.5, r3 = -75.5, r4 = -74.5,
 &end

# 100 ILE PSI:  (100 ILE N)-(100 ILE CA)-(100 ILE C)-(101 PRO N) 103.2 163.2
 &rst     iat =   518,   520,   535,   537,
   r1 = 102.2, r2 = 103.2, r3 = 163.2, r4 = 164.2,
 &end

# 102 ALA PHI:  (101 PRO C)-(102 ALA N)-(102 ALA CA)-(102 ALA C) -80.5 -20.5
 &rst     iat =   549,   551,   553,   559,
   r1 = -81.5, r2 = -80.5, r3 = -20.5, r4 = -19.5,
 &end

# 102 ALA PSI:  (102 ALA N)-(102 ALA CA)-(102 ALA C)-(103 ASP N) -75.2 -15.2
 &rst     iat =   551,   553,   559,   561,
   r1 = -76.2, r2 = -75.2, r3 = -15.2, r4 = -14.2,
 &end

# 103 ASP PHI:  (102 ALA C)-(103 ASP N)-(103 ASP CA)-(103 ASP C) -93.5 -33.5
 &rst     iat =   559,   561,   563,   571,
   r1 = -94.5, r2 = -93.5, r3 = -33.5, r4 = -32.5,
 &end

# 103 ASP PSI:  (103 ASP N)-(103 ASP CA)-(103 ASP C)-(104 VAL N) -66.0  -6.0
 &rst     iat =   561,   563,   571,   573,
   r1 = -67.0, r2 = -66.0, r3 =  -6.0, r4 =  -5.0,
 &end

# 104 VAL PHI:  (103 ASP C)-(104 VAL N)-(104 VAL CA)-(104 VAL C) -95.5 -35.5
 &rst     iat =   571,   573,   575,   587,
   r1 = -96.5, r2 = -95.5, r3 = -35.5, r4 = -34.5,
 &end

# 104 VAL PSI:  (104 VAL N)-(104 VAL CA)-(104 VAL C)-(105 ILE N) -71.8 -11.8
 &rst     iat =   573,   575,   587,   589,
   r1 = -72.8, r2 = -71.8, r3 = -11.8, r4 = -10.8,
 &end

# 105 ILE PHI:  (104 VAL C)-(105 ILE N)-(105 ILE CA)-(105 ILE C) -94.8 -34.8
 &rst     iat =   587,   589,   591,   606,
   r1 = -95.8, r2 = -94.8, r3 = -34.8, r4 = -33.8,
 &end

# 105 ILE PSI:  (105 ILE N)-(105 ILE CA)-(105 ILE C)-(106 ASP N) -73.2 -13.2
 &rst     iat =   589,   591,   606,   608,
   r1 = -74.2, r2 = -73.2, r3 = -13.2, r4 = -12.2,
 &end

# 106 ASP PHI:  (105 ILE C)-(106 ASP N)-(106 ASP CA)-(106 ASP C) -93.8 -33.8
 &rst     iat =   606,   608,   610,   618,
   r1 = -94.8, r2 = -93.8, r3 = -33.8, r4 = -32.8,
 &end

# 106 ASP PSI:  (106 ASP N)-(106 ASP CA)-(106 ASP C)-(107 ALA N) -70.5 -10.5
 &rst     iat =   608,   610,   618,   620,
   r1 = -71.5, r2 = -70.5, r3 = -10.5, r4 =  -9.5,
 &end

# 107 ALA PHI:  (106 ASP C)-(107 ALA N)-(107 ALA CA)-(107 ALA C) -97.3 -37.3
 &rst     iat =   618,   620,   622,   628,
   r1 = -98.3, r2 = -97.3, r3 = -37.3, r4 = -36.3,
 &end

# 107 ALA PSI:  (107 ALA N)-(107 ALA CA)-(107 ALA C)-(108 TYR N) -69.3  -9.3
 &rst     iat =   620,   622,   628,   630,
   r1 = -70.3, r2 = -69.3, r3 =  -9.3, r4 =  -8.3,
 &end

# 108 TYR PHI:  (107 ALA C)-(108 TYR N)-(108 TYR CA)-(108 TYR C) -95.5 -35.5
 &rst     iat =   628,   630,   632,   649,
   r1 = -96.5, r2 = -95.5, r3 = -35.5, r4 = -34.5,
 &end

# 108 TYR PSI:  (108 TYR N)-(108 TYR CA)-(108 TYR C)-(109 HIS N) -72.7 -12.7
 &rst     iat =   630,   632,   649,   651,
   r1 = -73.7, r2 = -72.7, r3 = -12.7, r4 = -11.7,
 &end

# 109 HIS PHI:  (108 TYR C)-(109 HIS N)-(109 HIS CA)-(109 HIS C) -98.5 -38.5
 &rst     iat =   649,   651,   653,   667,
   r1 = -99.5, r2 = -98.5, r3 = -38.5, r4 = -37.5,
 &end

# 109 HIS PSI:  (109 HIS N)-(109 HIS CA)-(109 HIS C)-(110 ALA N) -61.2  -1.2
 &rst     iat =   651,   653,   667,   669,
   r1 = -62.2, r2 = -61.2, r3 =  -1.2, r4 =  -0.2,
 &end

# 110 ALA PHI:  (109 HIS C)-(110 ALA N)-(110 ALA CA)-(110 ALA C) -94.6 -34.6
 &rst     iat =   667,   669,   671,   677,
   r1 = -95.6, r2 = -94.6, r3 = -34.6, r4 = -33.6,
 &end

# 110 ALA PSI:  (110 ALA N)-(110 ALA CA)-(110 ALA C)-(111 ALA N) -62.5  -2.5
 &rst     iat =   669,   671,   677,   679,
   r1 = -63.5, r2 = -62.5, r3 =  -2.5, r4 =  -1.5,
 &end

# 111 ALA PHI:  (110 ALA C)-(111 ALA N)-(111 ALA CA)-(111 ALA C) -95.0 -35.0
 &rst     iat =   677,   679,   681,   687,
   r1 = -96.0, r2 = -95.0, r3 = -35.0, r4 = -34.0,
 &end

# 111 ALA PSI:  (111 ALA N)-(111 ALA CA)-(111 ALA C)-(112 THR N) -68.9  -8.9
 &rst     iat =   679,   681,   687,   689,
   r1 = -69.9, r2 = -68.9, r3 =  -8.9, r4 =  -7.9,
 &end

# 113 LEU PHI:  (112 THR C)-(113 LEU N)-(113 LEU CA)-(113 LEU C) -114.5 -54.5
 &rst     iat =   701,   703,   705,   720,
   r1 = -115.5, r2 = -114.5, r3 = -54.5, r4 = -53.5,
 &end

# 113 LEU PSI:  (113 LEU N)-(113 LEU CA)-(113 LEU C)-(114 GLU N) -48.8  11.2
 &rst     iat =   703,   705,   720,   722,
   r1 = -49.8, r2 = -48.8, r3 =  11.2, r4 =  12.2,
 &end

# 114 GLU PHI:  (113 LEU C)-(114 GLU N)-(114 GLU CA)-(114 GLU C) -180.0   0.0
 &rst     iat =   720,   722,   724,   735,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 115 HIS PHI:  (114 GLU C)-(115 HIS N)-(115 HIS CA)-(115 HIS C) -180.0   0.0
 &rst     iat =   735,   737,   739,   753,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 116 HIS PHI:  (115 HIS C)-(116 HIS N)-(116 HIS CA)-(116 HIS C) -180.0   0.0
 &rst     iat =   753,   755,   757,   771,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 117 HIS PHI:  (116 HIS C)-(117 HIS N)-(117 HIS CA)-(117 HIS C) -180.0   0.0
 &rst     iat =   771,   773,   775,   789,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 118 HIS PHI:  (117 HIS C)-(118 HIS N)-(118 HIS CA)-(118 HIS C) -180.0   0.0
 &rst     iat =   789,   791,   793,   807,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 119 HIS PHI:  (118 HIS C)-(119 HIS N)-(119 HIS CA)-(119 HIS C) -180.0   0.0
 &rst     iat =   807,   809,   811,   825,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

#
#  chirality for residue 66 atoms:  CA OG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1,12,6,7, &end
#
#  chirality for residue 67 atoms:  N C HA2 HA3
 &rst iat=14,19,17,18, &end
#
#  chirality for residue 68 atoms:  CA OG HB2 HB3
 &rst iat=23,28,26,27, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=21,30,24,25, &end
#
#  chirality for residue 69 atoms:  N C HA2 HA3
 &rst iat=32,37,35,36, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=41,46,44,45, &end
#
#  chirality for residue 70 atoms:  CB CD HG2 HG3
 &rst iat=43,49,47,48, &end
#
#  chirality for residue 70 atoms:  CG NE HD2 HD3
 &rst iat=46,52,50,51, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=39,61,42,43, &end
#
#  chirality for residue 71 atoms:  N C HA2 HA3
 &rst iat=63,68,66,67, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=72,77,75,76, &end
#
#  chirality for residue 72 atoms:  CB CD HG2 HG3
 &rst iat=74,80,78,79, &end
#
#  chirality for residue 72 atoms:  CG NE HD2 HD3
 &rst iat=77,83,81,82, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=70,92,73,74, &end
#
#  chirality for residue 73 atoms:  N C HA2 HA3
 &rst iat=94,99,97,98, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=101,109,104,105, &end
#
#  chirality for residue 75 atoms:  CA CG2 CG1 HB
 &rst iat=113,117,121,116, &end
#
#  chirality for residue 75 atoms:  CB CD1 HG12 HG13
 &rst iat=115,124,122,123, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=111,128,114,115, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=132,137,135,136, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=130,140,133,134, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=144,149,147,148, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=146,152,150,151, &end
#
#  chirality for residue 77 atoms:  CG NE HD2 HD3
 &rst iat=149,155,153,154, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=142,164,145,146, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=168,173,171,172, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=170,176,174,175, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=166,179,169,170, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=183,188,186,187, &end
#
#  chirality for residue 79 atoms:  CB CD HG2 HG3
 &rst iat=185,191,189,190, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=181,196,184,185, &end
#
#  chirality for residue 80 atoms:  CA OG HB2 HB3
 &rst iat=200,205,203,204, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=198,207,201,202, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=209,217,212,213, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=219,227,222,223, &end
#
#  chirality for residue 83 atoms:  CA CG2 CG1 HB
 &rst iat=231,235,239,234, &end
#
#  chirality for residue 83 atoms:  CB CD1 HG12 HG13
 &rst iat=233,242,240,241, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=229,246,232,233, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=250,255,253,254, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=252,258,256,257, &end
#
#  chirality for residue 84 atoms:  CG NE HD2 HD3
 &rst iat=255,261,259,260, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=248,270,251,252, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=274,279,277,278, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=276,282,280,281, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=272,285,275,276, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=289,294,292,293, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=287,309,290,291, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=311,319,314,315, &end
#
#  chirality for residue 88 atoms:  CA CG HB2 HB3
 &rst iat=323,328,326,327, &end
#
#  chirality for residue 88 atoms:  CB CD HG2 HG3
 &rst iat=325,331,329,330, &end
#
#  chirality for residue 88 atoms:  CG NE HD2 HD3
 &rst iat=328,334,332,333, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=321,343,324,325, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=347,352,350,351, &end
#
#  chirality for residue 89 atoms:  CB CD HG2 HG3
 &rst iat=349,355,353,354, &end
#
#  chirality for residue 89 atoms:  CG NE HD2 HD3
 &rst iat=352,358,356,357, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=345,367,348,349, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=371,376,374,375, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=369,381,372,373, &end
#
#  chirality for residue 91 atoms:  N C HA2 HA3
 &rst iat=383,388,386,387, &end
#
#  chirality for residue 92 atoms:  CA CG HB2 HB3
 &rst iat=392,397,395,396, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=390,406,393,394, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=410,415,413,414, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=408,420,411,412, &end
#
#  chirality for residue 94 atoms:  CA CG1 CG2 HB
 &rst iat=424,428,432,427, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=422,436,425,426, &end
#
#  chirality for residue 95 atoms:  CA OG HB2 HB3
 &rst iat=440,445,443,444, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=438,447,441,442, &end
#
#  chirality for residue 96 atoms:  CA CG2 OG1 HB
 &rst iat=451,455,459,454, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=449,461,452,453, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=465,470,468,469, &end
#
#  chirality for residue 97 atoms:  CB CD HG2 HG3
 &rst iat=467,473,471,472, &end
#
#  chirality for residue 97 atoms:  CG NE HD2 HD3
 &rst iat=470,476,474,475, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=463,485,466,467, &end
#
#  chirality for residue 98 atoms:  N C HA2 HA3
 &rst iat=487,492,490,491, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=496,501,499,500, &end
#
#  chirality for residue 99 atoms:  CB CD HG2 HG3
 &rst iat=498,504,502,503, &end
#
#  chirality for residue 99 atoms:  CG NE HD2 HD3
 &rst iat=501,507,505,506, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=494,516,497,498, &end
#
#  chirality for residue 100 atoms:  CA CG2 CG1 HB
 &rst iat=520,524,528,523, &end
#
#  chirality for residue 100 atoms:  CB CD1 HG12 HG13
 &rst iat=522,531,529,530, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=518,535,521,522, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=547,541,545,546, &end
#
#  chirality for residue 101 atoms:  CB CD HG2 HG3
 &rst iat=544,538,542,543, &end
#
#  chirality for residue 101 atoms:  CG N HD2 HD3
 &rst iat=541,537,539,540, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=537,549,548,544, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=551,559,554,555, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=563,568,566,567, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=561,571,564,565, &end
#
#  chirality for residue 104 atoms:  CA CG1 CG2 HB
 &rst iat=575,579,583,578, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=573,587,576,577, &end
#
#  chirality for residue 105 atoms:  CA CG2 CG1 HB
 &rst iat=591,595,599,594, &end
#
#  chirality for residue 105 atoms:  CB CD1 HG12 HG13
 &rst iat=593,602,600,601, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=589,606,592,593, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=610,615,613,614, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=608,618,611,612, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=620,628,623,624, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=632,637,635,636, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=630,649,633,634, &end
#
#  chirality for residue 109 atoms:  CA CG HB2 HB3
 &rst iat=653,658,656,657, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=651,667,654,655, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=669,677,672,673, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=679,687,682,683, &end
#
#  chirality for residue 112 atoms:  CA CG2 OG1 HB
 &rst iat=691,695,699,694, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=689,701,692,693, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=705,710,708,709, &end
#
#  chirality for residue 113 atoms:  CB CD1 CD2 HG
 &rst iat=707,712,716,711, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=703,720,706,707, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=724,729,727,728, &end
#
#  chirality for residue 114 atoms:  CB CD HG2 HG3
 &rst iat=726,732,730,731, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=722,735,725,726, &end
#
#  chirality for residue 115 atoms:  CA CG HB2 HB3
 &rst iat=739,744,742,743, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=737,753,740,741, &end
#
#  chirality for residue 116 atoms:  CA CG HB2 HB3
 &rst iat=757,762,760,761, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=755,771,758,759, &end
#
#  chirality for residue 117 atoms:  CA CG HB2 HB3
 &rst iat=775,780,778,779, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=773,789,776,777, &end
#
#  chirality for residue 118 atoms:  CA CG HB2 HB3
 &rst iat=793,798,796,797, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=791,807,794,795, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=811,816,814,815, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=809,825,812,813, &end
#
#  chirality for residue 120 atoms:  CA CG HB2 HB3
 &rst iat=829,834,832,833, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=827,843,830,831, &end
#
#  trans-omega constraint for residue 67
 &rst iat=16,14,12,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 68
 &rst iat=23,21,19,16, &end
#
#  trans-omega constraint for residue 69
 &rst iat=34,32,30,23, &end
#
#  trans-omega constraint for residue 70
 &rst iat=41,39,37,34, &end
#
#  trans-omega constraint for residue 71
 &rst iat=65,63,61,41, &end
#
#  trans-omega constraint for residue 72
 &rst iat=72,70,68,65, &end
#
#  trans-omega constraint for residue 73
 &rst iat=96,94,92,72, &end
#
#  trans-omega constraint for residue 74
 &rst iat=103,101,99,96, &end
#
#  trans-omega constraint for residue 75
 &rst iat=113,111,109,103, &end
#
#  trans-omega constraint for residue 76
 &rst iat=132,130,128,113, &end
#
#  trans-omega constraint for residue 77
 &rst iat=144,142,140,132, &end
#
#  trans-omega constraint for residue 78
 &rst iat=168,166,164,144, &end
#
#  trans-omega constraint for residue 79
 &rst iat=183,181,179,168, &end
#
#  trans-omega constraint for residue 80
 &rst iat=200,198,196,183, &end
#
#  trans-omega constraint for residue 81
 &rst iat=211,209,207,200, &end
#
#  trans-omega constraint for residue 82
 &rst iat=221,219,217,211, &end
#
#  trans-omega constraint for residue 83
 &rst iat=231,229,227,221, &end
#
#  trans-omega constraint for residue 84
 &rst iat=250,248,246,231, &end
#
#  trans-omega constraint for residue 85
 &rst iat=274,272,270,250, &end
#
#  trans-omega constraint for residue 86
 &rst iat=289,287,285,274, &end
#
#  trans-omega constraint for residue 87
 &rst iat=313,311,309,289, &end
#
#  trans-omega constraint for residue 88
 &rst iat=323,321,319,313, &end
#
#  trans-omega constraint for residue 89
 &rst iat=347,345,343,323, &end
#
#  trans-omega constraint for residue 90
 &rst iat=371,369,367,347, &end
#
#  trans-omega constraint for residue 91
 &rst iat=385,383,381,371, &end
#
#  trans-omega constraint for residue 92
 &rst iat=392,390,388,385, &end
#
#  trans-omega constraint for residue 93
 &rst iat=410,408,406,392, &end
#
#  trans-omega constraint for residue 94
 &rst iat=424,422,420,410, &end
#
#  trans-omega constraint for residue 95
 &rst iat=440,438,436,424, &end
#
#  trans-omega constraint for residue 96
 &rst iat=451,449,447,440, &end
#
#  trans-omega constraint for residue 97
 &rst iat=465,463,461,451, &end
#
#  trans-omega constraint for residue 98
 &rst iat=489,487,485,465, &end
#
#  trans-omega constraint for residue 99
 &rst iat=496,494,492,489, &end
#
#  trans-omega constraint for residue 100
 &rst iat=520,518,516,496, &end
#
#  trans-omega constraint for residue 101
 &rst iat=547,537,535,520, &end
#
#  trans-omega constraint for residue 102
 &rst iat=553,551,549,547, &end
#
#  trans-omega constraint for residue 103
 &rst iat=563,561,559,553, &end
#
#  trans-omega constraint for residue 104
 &rst iat=575,573,571,563, &end
#
#  trans-omega constraint for residue 105
 &rst iat=591,589,587,575, &end
#
#  trans-omega constraint for residue 106
 &rst iat=610,608,606,591, &end
#
#  trans-omega constraint for residue 107
 &rst iat=622,620,618,610, &end
#
#  trans-omega constraint for residue 108
 &rst iat=632,630,628,622, &end
#
#  trans-omega constraint for residue 109
 &rst iat=653,651,649,632, &end
#
#  trans-omega constraint for residue 110
 &rst iat=671,669,667,653, &end
#
#  trans-omega constraint for residue 111
 &rst iat=681,679,677,671, &end
#
#  trans-omega constraint for residue 112
 &rst iat=691,689,687,681, &end
#
#  trans-omega constraint for residue 113
 &rst iat=705,703,701,691, &end
#
#  trans-omega constraint for residue 114
 &rst iat=724,722,720,705, &end
#
#  trans-omega constraint for residue 115
 &rst iat=739,737,735,724, &end
#
#  trans-omega constraint for residue 116
 &rst iat=757,755,753,739, &end
#
#  trans-omega constraint for residue 117
 &rst iat=775,773,771,757, &end
#
#  trans-omega constraint for residue 118
 &rst iat=793,791,789,775, &end
#
#  trans-omega constraint for residue 119
 &rst iat=811,809,807,793, &end
#
#  trans-omega constraint for residue 120
 &rst iat=829,827,825,811, &end
#
#    0 AMB  20-2:3      112 THR  HB          3.50    (#      3:20  Single Ambig)
 &rst
  ixpk= 3, nxpk= 20, iat=  -1, 694, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1= 704, 690,
 &end
#
#    0 AMB  20-2:4      112 THR  HB          2.60    (#      4:20  Single Ambig)
 &rst
  ixpk= 4, nxpk= 20, iat=  -1, 694, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 696, 697, 698, 713, 714, 715, 717, 718, 719,
 &end
#
#   96 THR  HA           96 THR  HB          2.60    (#      5:20  Unique         2.40, 2.50 A)
 &rst
  ixpk= 5, nxpk= 20, iat= 452, 454, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   96 THR  MG2          96 THR  HB          2.60    (#      6:20  Unique         2.43, 2.66 A)
 &rst
  ixpk= 6, nxpk= 20, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 456, 457, 458,
 &end
#
#    0 AMB  20-2:13     104 VAL  HA          2.60    (#     13:20  Single Ambig)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1, 576, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 574, 590,
 &end
#
#  104 VAL  HB          104 VAL  HA          3.50    (#     14:20  Unique         2.53, 2.93 A)
 &rst
  ixpk= 14, nxpk= 20, iat= 578, 576, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 ALA  MB          104 VAL  HA          2.60    (#     15:20  Unique         2.17, 2.95 A)
 &rst
  ixpk= 15, nxpk= 20, iat=  -1, 576, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 625, 626, 627,
 &end
#
#  104 VAL  MGY         104 VAL  HA          2.60    (#     16:20  Unique         2.29, 3.20 A)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1, 576, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#  104 VAL  MGX         104 VAL  HA          2.60    (#     17:20  Unique         2.29, 3.20 A)
 &rst
  ixpk= 17, nxpk= 20, iat=  -1, 576, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#  105 ILE  HN          105 ILE  HA          4.40    (#     18:20  Unique         2.88, 2.89 A)
 &rst
  ixpk= 18, nxpk= 20, iat= 590, 592, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  20-2:19     105 ILE  HA          2.60    (#     19:20  Single Ambig)
 &rst
  ixpk= 19, nxpk= 20, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 596, 597, 598, 603, 604, 605,
 &end
#
#  105 ILE  HG1-        105 ILE  HA          4.40    (#     20:20  Unique         2.50, 2.67 A)
 &rst
  ixpk= 20, nxpk= 20, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 600, 601,
 &end
#
#    0 AMB  20-2:22      83 ILE  HA          4.40    (#     22:20  Single Ambig)
 &rst
  ixpk= 22, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 230, 273,
 &end
#
#   86 TRP  HB+          83 ILE  HA          4.40    (#     23:20  Unique         2.28, 3.02 A)
 &rst
  ixpk= 23, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 292, 293,
 &end
#
#   86 TRP  HB-          83 ILE  HA          3.50    (#     24:20  Unique         2.28, 3.02 A)
 &rst
  ixpk= 24, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 292, 293,
 &end
#
#    0 AMB  20-2:25      83 ILE  HA          4.40    (#     25:20  Single Ambig)
 &rst
  ixpk= 25, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 234, 224, 225, 226,
 &end
#
#   83 ILE  HG1-         83 ILE  HA          4.40    (#     26:20  Unique         2.41, 2.69 A)
 &rst
  ixpk= 26, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 240, 241,
 &end
#
#   96 THR  HB           96 THR  HA          2.60    (#     27:20  Unique         2.40, 2.50 A)
 &rst
  ixpk= 27, nxpk= 20, iat= 454, 452, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   97 ARG  HN           96 THR  HA          4.40    (#     28:20  Unique         2.89, 3.46 A)
 &rst
  ixpk= 28, nxpk= 20, iat= 464, 452, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   84 ARG  HD+          96 THR  HA          4.40    (#     29:20  Unique         2.40, 3.73 A)
 &rst
  ixpk= 29, nxpk= 20, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 259, 260,
 &end
#
#   96 THR  MG2          96 THR  HA          2.60    (#     30:20  Unique         2.42, 3.06 A)
 &rst
  ixpk= 30, nxpk= 20, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 456, 457, 458,
 &end
#
#   95 SER  HN           95 SER  HB+         4.40    (#     31:20  Unique         2.39, 2.78 A)
 &rst
  ixpk= 31, nxpk= 20, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 443, 444,
 &end
#
#   95 SER  HA           95 SER  HB+         2.60    (#     33:20  Unique         2.36, 2.71 A)
 &rst
  ixpk= 33, nxpk= 20, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 443, 444,
 &end
#
#   95 SER  HN           95 SER  HB-         4.40    (#     34:20  Unique         2.39, 2.78 A)
 &rst
  ixpk= 34, nxpk= 20, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 443, 444,
 &end
#
#   95 SER  HA           95 SER  HB-         2.60    (#     35:20  Unique         2.36, 2.71 A)
 &rst
  ixpk= 35, nxpk= 20, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 443, 444,
 &end
#
#  102 ALA  HN          101 PRO  HA          2.60    (#     37:20  Unique         2.21, 2.23 A)
 &rst
  ixpk= 37, nxpk= 20, iat= 552, 548, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  101 PRO  HB+         101 PRO  HA          2.60    (#     38:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 38, nxpk= 20, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 545, 546,
 &end
#
#    0 AMB  20-2:39     101 PRO  HA          2.60    (#     39:20  Single Ambig)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 545, 546, 542, 543,
 &end
#
#  112 THR  HN          112 THR  HA          3.50    (#     41:20  Unique         2.89, 2.92 A)
 &rst
  ixpk= 41, nxpk= 20, iat= 690, 692, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  112 THR  MG2         112 THR  HA          2.60    (#     42:20  Unique         2.44, 3.09 A)
 &rst
  ixpk= 42, nxpk= 20, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 696, 697, 698,
 &end
#
#   80 SER  HN           80 SER  HB+         4.40    (#     43:20  Unique         2.37, 3.06 A)
 &rst
  ixpk= 43, nxpk= 20, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 203, 204,
 &end
#
#    0 AMB  20-2:44       0 AMB  20-1:44     4.40    (#     44:20  Double Ambig)
 &rst
  ixpk= 44, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
 igr1= 532, 533, 534, 529, 530,
 igr2= 203, 204, 203, 204,
 &end
#
#   80 SER  HN           80 SER  HB-         4.40    (#     45:20  Unique         2.37, 3.06 A)
 &rst
  ixpk= 45, nxpk= 20, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 203, 204,
 &end
#
#    0 AMB  20-2:46      80 SER  HB-         4.40    (#     46:20  Single Ambig)
 &rst
  ixpk= 46, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 532, 533, 534, 529, 530,
 igr2= 203, 204,
 &end
#
#    0 AMB  20-2:47      86 TRP  HA          4.40    (#     47:20  Single Ambig)
 &rst
  ixpk= 47, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 379, 380, 379, 380,
 &end
#
#   86 TRP  HN           86 TRP  HA          2.60    (#     48:20  Unique         2.75, 2.77 A)
 &rst
  ixpk= 48, nxpk= 20, iat= 288, 290, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   86 TRP  HB+          86 TRP  HA          2.60    (#     49:20  Unique         2.40, 2.72 A)
 &rst
  ixpk= 49, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 292, 293,
 &end
#
#   86 TRP  HB-          86 TRP  HA          2.60    (#     50:20  Unique         2.40, 2.72 A)
 &rst
  ixpk= 50, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 292, 293,
 &end
#
#    0 AMB  20-2:51      86 TRP  HA          3.50    (#     51:20  Single Ambig)
 &rst
  ixpk= 51, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 350, 351, 353, 354,
 &end
#
#   76 ASP  HN           75 ILE  HA          2.60    (#     52:20  Unique         2.12, 2.24 A)
 &rst
  ixpk= 52, nxpk= 20, iat= 131, 114, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   75 ILE  HB           75 ILE  HA          4.40    (#     53:20  Unique         2.49, 2.98 A)
 &rst
  ixpk= 53, nxpk= 20, iat= 116, 114, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   75 ILE  MG2          75 ILE  HA          3.50    (#     54:20  Unique         2.43, 3.28 A)
 &rst
  ixpk= 54, nxpk= 20, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 118, 119, 120,
 &end
#
#    0 AMB  20-2:55      80 SER  HA          4.40    (#     55:20  Single Ambig)
 &rst
  ixpk= 55, nxpk= 20, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 230, 210,
 &end
#
#    0 AMB  20-2:56      80 SER  HA          4.40    (#     56:20  Single Ambig)
 &rst
  ixpk= 56, nxpk= 20, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 234, 224, 225, 226,
 &end
#
#    0 AMB  20-2:57      80 SER  HA          3.50    (#     57:20  Single Ambig)
 &rst
  ixpk= 57, nxpk= 20, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 532, 533, 534, 529, 530,
 &end
#
#   94 VAL  HB           94 VAL  HA          2.60    (#     58:20  Unique         2.43, 2.49 A)
 &rst
  ixpk= 58, nxpk= 20, iat= 427, 425, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   95 SER  HN           94 VAL  HA          2.60    (#     59:20  Unique         2.16, 2.26 A)
 &rst
  ixpk= 59, nxpk= 20, iat= 439, 425, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   94 VAL  HN           94 VAL  HA          4.40    (#     60:20  Unique         2.89, 2.92 A)
 &rst
  ixpk= 60, nxpk= 20, iat= 423, 425, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   94 VAL  MGX          94 VAL  HA          3.50    (#     61:20  Unique         2.31, 3.52 A)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#   84 ARG  HN           84 ARG  HA          3.50    (#     62:20  Unique         2.85, 2.88 A)
 &rst
  ixpk= 62, nxpk= 20, iat= 249, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 ARG  HB-          84 ARG  HA          2.60    (#     63:20  Unique         2.33, 2.79 A)
 &rst
  ixpk= 63, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 253, 254,
 &end
#
#   87 ALA  MB           84 ARG  HA          2.60    (#     64:20  Unique         2.57, 3.57 A)
 &rst
  ixpk= 64, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 316, 317, 318,
 &end
#
#   84 ARG  HG+          84 ARG  HA          3.50    (#     65:20  Unique         2.41, 2.85 A)
 &rst
  ixpk= 65, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 256, 257,
 &end
#
#  108 TYR  HB+         108 TYR  HA          4.40    (#     66:20  Unique         2.34, 2.71 A)
 &rst
  ixpk= 66, nxpk= 20, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 635, 636,
 &end
#
#  111 ALA  MB          108 TYR  HA          3.50    (#     67:20  Unique         2.63, 3.68 A)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 684, 685, 686,
 &end
#
#  101 PRO  HD-         100 ILE  HA          2.60    (#     68:20  Unique         2.03, 2.44 A)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 539, 540,
 &end
#
#    0 AMB  20-2:69     100 ILE  HA          2.60    (#     69:20  Single Ambig)
 &rst
  ixpk= 69, nxpk= 20, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 429, 430, 431, 433, 434, 435, 525, 526, 527,
 &end
#
#   85 GLU  HN           85 GLU  HA          2.60    (#     70:20  Unique         2.78, 2.79 A)
 &rst
  ixpk= 70, nxpk= 20, iat= 273, 275, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   88 ARG  HN           85 GLU  HA          4.40    (#     71:20  Unique         3.31, 3.43 A)
 &rst
  ixpk= 71, nxpk= 20, iat= 322, 275, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   85 GLU  HG+          85 GLU  HA          2.60    (#     72:20  Unique         2.42, 2.88 A)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 280, 281,
 &end
#
#    0 AMB  20-2:73       0 AMB  20-1:73     2.60    (#     73:20  Double Ambig)
 &rst
  ixpk= 73, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 529, 530, 353, 354,
 igr2= 521, 275,
 &end
#
#   96 THR  HN           95 SER  HA          4.40    (#     75:20  Unique         2.19, 2.32 A)
 &rst
  ixpk= 75, nxpk= 20, iat= 450, 441, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   95 SER  HB+          95 SER  HA          2.60    (#     77:20  Unique         2.36, 2.71 A)
 &rst
  ixpk= 77, nxpk= 20, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 443, 444,
 &end
#
#   95 SER  HB-          95 SER  HA          2.60    (#     78:20  Unique         2.36, 2.71 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 443, 444,
 &end
#
#    0 AMB  20-2:81     109 HIS  HA          4.40    (#     81:20  Single Ambig)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 652, 662,
 &end
#
#  109 HIS  HD2         109 HIS  HA          4.40    (#     82:20  Unique         2.27, 3.86 A)
 &rst
  ixpk= 82, nxpk= 20, iat= 666, 654, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  109 HIS  HB+         109 HIS  HA          2.60    (#     83:20  Unique         2.49, 2.79 A)
 &rst
  ixpk= 83, nxpk= 20, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 656, 657,
 &end
#
#   79 GLN  HN           79 GLN  HA          3.50    (#     84:20  Unique         2.83, 2.88 A)
 &rst
  ixpk= 84, nxpk= 20, iat= 182, 184, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:85      79 GLN  HA          4.40    (#     85:20  Single Ambig)
 &rst
  ixpk= 85, nxpk= 20, iat=  -1, 184, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 189, 190, 174, 175,
 &end
#
#   89 ARG  HN           89 ARG  HA          3.50    (#     86:20  Unique         2.85, 2.89 A)
 &rst
  ixpk= 86, nxpk= 20, iat= 346, 348, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:87      89 ARG  HA          2.60    (#     87:20  Single Ambig)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 350, 351, 329, 330,
 &end
#
#   89 ARG  HG-          89 ARG  HA          2.60    (#     88:20  Unique         2.41, 2.73 A)
 &rst
  ixpk= 88, nxpk= 20, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 353, 354,
 &end
#
#  109 HIS  HB+         106 ASP  HA          2.60    (#     90:20  Unique         2.51, 3.45 A)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1, 611, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 656, 657,
 &end
#
#    0 AMB  20-2:91     106 ASP  HA          2.60    (#     91:20  Single Ambig)
 &rst
  ixpk= 91, nxpk= 20, iat=  -1, 611, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 609, 631,
 &end
#
#   79 GLN  HG+          79 GLN  HA          6.00    (#     92:20  Unique         2.42, 3.24 A)
 &rst
  ixpk= 92, nxpk= 20, iat=  -1, 184, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 189, 190,
 &end
#
#   79 GLN  HB+          79 GLN  HA          2.60    (#     93:20  Unique         2.36, 2.68 A)
 &rst
  ixpk= 93, nxpk= 20, iat=  -1, 184, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 186, 187,
 &end
#
#   80 SER  HN           79 GLN  HA          4.40    (#     94:20  Unique         3.43, 3.55 A)
 &rst
  ixpk= 94, nxpk= 20, iat= 199, 184, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  114 GLU  HN          114 GLU  HA          3.50    (#     95:20  Unique         2.25, 2.79 A)
 &rst
  ixpk= 95, nxpk= 20, iat= 723, 725, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  115 HIS  HN          114 GLU  HA          4.40    (#     96:20  Unique         2.07, 2.70 A)
 &rst
  ixpk= 96, nxpk= 20, iat= 738, 725, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  114 GLU  HG-         114 GLU  HA          4.40    (#     97:20  Unique         2.33, 3.11 A)
 &rst
  ixpk= 97, nxpk= 20, iat=  -1, 725, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 730, 731,
 &end
#
#  114 GLU  HB+         114 GLU  HA          2.60    (#     98:20  Unique         2.37, 2.75 A)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1, 725, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 727, 728,
 &end
#
#  103 ASP  HN          103 ASP  HA          2.60    (#     99:20  Unique         2.75, 2.77 A)
 &rst
  ixpk= 99, nxpk= 20, iat= 562, 564, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#    0 AMB  20-2:100    103 ASP  HA          4.40    (#    100:20  Single Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 574, 590,
 &end
#
#  103 ASP  HB-         103 ASP  HA          2.60    (#    101:20  Unique         2.34, 2.72 A)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 566, 567,
 &end
#
#   70 ARG  HB+          70 ARG  HA          4.40    (#    102:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 102, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=  44,  45,
 &end
#
#   70 ARG  HB-          70 ARG  HA          4.40    (#    103:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 103, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=  44,  45,
 &end
#
#  100 ILE  HN           99 ARG  HA          2.60    (#    104:20  Unique         2.19, 2.28 A)
 &rst
  ixpk= 104, nxpk= 20, iat= 519, 497, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   99 ARG  HB+          99 ARG  HA          2.60    (#    105:20  Unique         2.47, 2.78 A)
 &rst
  ixpk= 105, nxpk= 20, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 499, 500,
 &end
#
#  114 GLU  HN          113 LEU  HA          3.50    (#    106:20  Unique         3.42, 3.55 A)
 &rst
  ixpk= 106, nxpk= 20, iat= 723, 706, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  113 LEU  HN          113 LEU  HA          3.50    (#    107:20  Unique         2.87, 2.92 A)
 &rst
  ixpk= 107, nxpk= 20, iat= 704, 706, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:108    113 LEU  HA          2.60    (#    108:20  Single Ambig)
 &rst
  ixpk= 108, nxpk= 20, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 713, 714, 715, 717, 718, 719, 713, 714, 715, 717,
       718, 719,
 &end
#
#    0 AMB  20-2:109    102 ALA  HA          2.60    (#    109:20  Single Ambig)
 &rst
  ixpk= 109, nxpk= 20, iat=  -1, 554, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 552, 562,
 &end
#
#  105 ILE  HB          102 ALA  HA          2.60    (#    110:20  Unique         2.20, 2.25 A)
 &rst
  ixpk= 110, nxpk= 20, iat= 594, 554, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  102 ALA  MB          102 ALA  HA          2.60    (#    111:20  Unique         2.40, 2.63 A)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1, 554, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 556, 557, 558,
 &end
#
#   87 ALA  HN           87 ALA  HA          3.50    (#    112:20  Unique         2.83, 2.84 A)
 &rst
  ixpk= 112, nxpk= 20, iat= 312, 314, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HE3          87 ALA  HA          3.50    (#    113:20  Unique         2.83, 3.05 A)
 &rst
  ixpk= 113, nxpk= 20, iat= 307, 314, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:114     87 ALA  HA          3.50    (#    114:20  Single Ambig)
 &rst
  ixpk= 114, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 405, 379, 380,
 &end
#
#   92 HIS  HB-          87 ALA  HA          6.00    (#    115:20  Unique         2.44, 3.36 A)
 &rst
  ixpk= 115, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 395, 396,
 &end
#
#   87 ALA  MB           87 ALA  HA          2.60    (#    116:20  Unique         2.43, 2.67 A)
 &rst
  ixpk= 116, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 316, 317, 318,
 &end
#
#   97 ARG  HB+          97 ARG  HA          2.60    (#    118:20  Unique         2.36, 2.68 A)
 &rst
  ixpk= 118, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 468, 469,
 &end
#
#   97 ARG  HB-          97 ARG  HA          3.50    (#    119:20  Unique         2.36, 2.68 A)
 &rst
  ixpk= 119, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 468, 469,
 &end
#
#   97 ARG  HG+          97 ARG  HA          3.50    (#    120:20  Unique         2.47, 3.32 A)
 &rst
  ixpk= 120, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 471, 472,
 &end
#
#    0 AMB  20-2:121     82 ALA  HA          3.50    (#    121:20  Single Ambig)
 &rst
  ixpk= 121, nxpk= 20, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 273, 230, 210,
 &end
#
#   82 ALA  HN           82 ALA  HA          3.50    (#    122:20  Unique         2.81, 2.85 A)
 &rst
  ixpk= 122, nxpk= 20, iat= 220, 222, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   85 GLU  HB+          82 ALA  HA          3.50    (#    123:20  Unique         2.60, 3.35 A)
 &rst
  ixpk= 123, nxpk= 20, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 277, 278,
 &end
#
#   82 ALA  MB           82 ALA  HA          2.60    (#    124:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 124, nxpk= 20, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 224, 225, 226,
 &end
#
#  107 ALA  HN          107 ALA  HA          2.60    (#    125:20  Unique         2.74, 2.74 A)
 &rst
  ixpk= 125, nxpk= 20, iat= 621, 623, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#    0 AMB  20-2:127     81 ALA  HA          2.60    (#    127:20  Single Ambig)
 &rst
  ixpk= 127, nxpk= 20, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 210, 273, 230,
 &end
#
#   84 ARG  HB+          81 ALA  HA          2.60    (#    128:20  Unique         2.30, 3.08 A)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 253, 254,
 &end
#
#   81 ALA  MB           81 ALA  HA          2.60    (#    129:20  Unique         2.43, 2.66 A)
 &rst
  ixpk= 129, nxpk= 20, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 214, 215, 216,
 &end
#
#    0 AMB  20-2:130    102 ALA  HA          4.40    (#    130:20  Single Ambig)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1, 554, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 590, 574,
 &end
#
#  105 ILE  MD1         102 ALA  HA          2.60    (#    131:20  Unique         2.14, 3.02 A)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1, 554, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 603, 604, 605,
 &end
#
#   92 HIS  HB+          92 HIS  HA          2.60    (#    132:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 132, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 395, 396,
 &end
#
#   92 HIS  HB-          92 HIS  HA          3.50    (#    133:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 133, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 395, 396,
 &end
#
#    0 AMB  20-2:134    110 ALA  HA          2.60    (#    134:20  Single Ambig)
 &rst
  ixpk= 134, nxpk= 20, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 670, 723,
 &end
#
#    0 AMB  20-2:135    110 ALA  HA          2.60    (#    135:20  Single Ambig)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 708, 709, 674, 675, 676,
 &end
#
#    0 AMB  20-2:136     76 ASP  HA          3.50    (#    136:20  Single Ambig)
 &rst
  ixpk= 136, nxpk= 20, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 143, 167,
 &end
#
#   76 ASP  HN           76 ASP  HA          3.50    (#    137:20  Unique         2.28, 2.94 A)
 &rst
  ixpk= 137, nxpk= 20, iat= 131, 133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:140     76 ASP  HA          4.40    (#    140:20  Single Ambig)
 &rst
  ixpk= 140, nxpk= 20, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 114, 145, 169,
 &end
#
#   76 ASP  HB-          76 ASP  HA          2.60    (#    141:20  Unique         2.34, 2.73 A)
 &rst
  ixpk= 141, nxpk= 20, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 135, 136,
 &end
#
#   94 VAL  HN           93 ASN  HA          2.60    (#    142:20  Unique         2.13, 2.18 A)
 &rst
  ixpk= 142, nxpk= 20, iat= 423, 411, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   93 ASN  HB+          93 ASN  HA          2.60    (#    143:20  Unique         2.41, 2.74 A)
 &rst
  ixpk= 143, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 413, 414,
 &end
#
#   93 ASN  HB-          93 ASN  HA          2.60    (#    144:20  Unique         2.41, 2.74 A)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 413, 414,
 &end
#
#   90 ASN  HB+          90 ASN  HA          2.60    (#    145:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 374, 375,
 &end
#
#  111 ALA  HN          111 ALA  HA          2.60    (#    146:20  Unique         2.74, 2.78 A)
 &rst
  ixpk= 146, nxpk= 20, iat= 680, 682, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  112 THR  HN          111 ALA  HA          4.40    (#    147:20  Unique         3.53, 3.59 A)
 &rst
  ixpk= 147, nxpk= 20, iat= 690, 682, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  111 ALA  MB          111 ALA  HA          2.60    (#    148:20  Unique         2.44, 2.65 A)
 &rst
  ixpk= 148, nxpk= 20, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 684, 685, 686,
 &end
#
#   90 ASN  HN           90 ASN  HA          4.40    (#    149:20  Unique         2.95, 2.97 A)
 &rst
  ixpk= 149, nxpk= 20, iat= 370, 372, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   90 ASN  HB-          90 ASN  HA          4.40    (#    150:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 150, nxpk= 20, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 374, 375,
 &end
#
#   74 ALA  MB           74 ALA  HA          2.60    (#    151:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 151, nxpk= 20, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 106, 107, 108,
 &end
#
#    0 AMB  20-2:152     74 ALA  HA          2.60    (#    152:20  Single Ambig)
 &rst
  ixpk= 152, nxpk= 20, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 112, 102,
 &end
#
#    0 AMB  20-2:153      0 AMB  20-1:153    3.50    (#    153:20  Double Ambig)
 &rst
  ixpk= 153, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 525, 526, 527, 580, 581, 582, 584, 585, 586,
 igr2= 539, 540, 539, 540,
 &end
#
#  101 PRO  HG+         101 PRO  HD+         4.40    (#    155:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 155, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 542, 543,
 igr2= 539, 540,
 &end
#
#    0 AMB  20-2:156      0 AMB  20-1:156    2.60    (#    156:20  Double Ambig)
 &rst
  ixpk= 156, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 542, 543, 578, 545, 546,
 igr2= 539, 540, 539, 540, 539, 540,
 &end
#
#  101 PRO  HG+         101 PRO  HD-         4.40    (#    158:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 158, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 542, 543,
 igr2= 539, 540,
 &end
#
#    0 AMB  20-2:159    101 PRO  HD-         2.60    (#    159:20  Single Ambig)
 &rst
  ixpk= 159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 542, 543, 578, 545, 546,
 igr2= 539, 540,
 &end
#
#    0 AMB  20-2:160    101 PRO  HD-         2.60    (#    160:20  Single Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 525, 526, 527, 580, 581, 582, 584, 585, 586,
 igr2= 539, 540,
 &end
#
#   91 GLY  HN           91 GLY  HA+         2.60    (#    161:20  Unique         2.28, 2.59 A)
 &rst
  ixpk= 161, nxpk= 20, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 386, 387,
 &end
#
#   91 GLY  HN           91 GLY  HA-         2.60    (#    163:20  Unique         2.28, 2.59 A)
 &rst
  ixpk= 163, nxpk= 20, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 386, 387,
 &end
#
#   71 GLY  HN            0 AMB  20-1:166    3.50    (#    166:20  Single Ambig)
 &rst
  ixpk= 166, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=  66,  67,  35,  36,
 &end
#
#   74 ALA  HN           73 GLY  HA+         3.50    (#    168:20  Unique         2.19, 2.88 A)
 &rst
  ixpk= 168, nxpk= 20, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  97,  98,
 &end
#
#   99 ARG  HN           98 GLY  HA+         2.60    (#    169:20  Unique         2.21, 2.59 A)
 &rst
  ixpk= 169, nxpk= 20, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 490, 491,
 &end
#
#   98 GLY  HN           98 GLY  HA+         3.50    (#    170:20  Unique         2.29, 2.63 A)
 &rst
  ixpk= 170, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 490, 491,
 &end
#
#   84 ARG  HG+          84 ARG  HD+         4.40    (#    171:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 171, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 256, 257,
 igr2= 259, 260,
 &end
#
#   84 ARG  HB-          84 ARG  HD+         2.60    (#    172:20  Unique         2.34, 3.15 A)
 &rst
  ixpk= 172, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 253, 254,
 igr2= 259, 260,
 &end
#
#    0 AMB  20-2:173      0 AMB  20-1:173    2.60    (#    173:20  Double Ambig)
 &rst
  ixpk= 173, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 329, 330, 150, 151, 353, 354, 499, 500,
 igr2= 332, 333, 153, 154, 356, 357, 505, 506,
 &end
#
#    0 AMB  20-2:174      0 AMB  20-1:174    2.60    (#    174:20  Double Ambig)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 353, 354,  75,  76, 499, 500,  44,  45,
 igr2= 356, 357,  81,  82, 505, 506,  50,  51,
 &end
#
#    0 AMB  20-2:175      0 AMB  20-1:175    2.60    (#    175:20  Double Ambig)
 &rst
  ixpk= 175, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 502, 503, 353, 354,
 igr2= 505, 506, 356, 357,
 &end
#
#  113 LEU  HN          113 LEU  HB+         3.50    (#    176:20  Unique         2.28, 2.68 A)
 &rst
  ixpk= 176, nxpk= 20, iat= 704,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 708, 709,
 &end
#
#  113 LEU  HA          113 LEU  HB+         3.50    (#    177:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 177, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 708, 709,
 &end
#
#    0 AMB  20-2:179      0 AMB  20-1:179    3.50    (#    179:20  Double Ambig)
 &rst
  ixpk= 179, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 713, 714, 715, 717, 718, 719, 713, 714, 715, 717,
       718, 719,
 igr2= 708, 709, 708, 709,
 &end
#
#  113 LEU  HA          113 LEU  HB-         4.40    (#    180:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 180, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 708, 709,
 &end
#
#    0 AMB  20-2:182    113 LEU  HB-         2.60    (#    182:20  Single Ambig)
 &rst
  ixpk= 182, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1= 713, 714, 715, 717, 718, 719, 713, 714, 715, 717,
       718, 719,
 igr2= 708, 709,
 &end
#
#  113 LEU  HN          113 LEU  HB-         4.40    (#    183:20  Unique         2.28, 2.68 A)
 &rst
  ixpk= 183, nxpk= 20, iat= 704,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 708, 709,
 &end
#
#   76 ASP  HA           76 ASP  HB+         2.60    (#    184:20  Unique         2.34, 2.73 A)
 &rst
  ixpk= 184, nxpk= 20, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 135, 136,
 &end
#
#   76 ASP  HN           76 ASP  HB-         3.50    (#    185:20  Unique         2.44, 2.83 A)
 &rst
  ixpk= 185, nxpk= 20, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 135, 136,
 &end
#
#   76 ASP  HA           76 ASP  HB-         2.60    (#    186:20  Unique         2.34, 2.73 A)
 &rst
  ixpk= 186, nxpk= 20, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 135, 136,
 &end
#
#   77 ARG  HN           76 ASP  HB-         4.40    (#    187:20  Unique         2.12, 3.57 A)
 &rst
  ixpk= 187, nxpk= 20, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 135, 136,
 &end
#
#  106 ASP  HN          106 ASP  HB+         2.60    (#    188:20  Unique         2.41, 2.50 A)
 &rst
  ixpk= 188, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 613, 614,
 &end
#
#  107 ALA  HN          106 ASP  HB+         2.60    (#    189:20  Unique         2.53, 3.24 A)
 &rst
  ixpk= 189, nxpk= 20, iat= 621,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 613, 614,
 &end
#
#    0 AMB  20-2:190      0 AMB  20-1:190    2.60    (#    190:20  Double Ambig)
 &rst
  ixpk= 190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 611, 564,
 igr2= 613, 614, 613, 614,
 &end
#
#  103 ASP  HA          103 ASP  HB+         2.60    (#    191:20  Unique         2.34, 2.72 A)
 &rst
  ixpk= 191, nxpk= 20, iat= 564,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 566, 567,
 &end
#
#  103 ASP  HN          103 ASP  HB+         3.50    (#    193:20  Unique         2.39, 2.62 A)
 &rst
  ixpk= 193, nxpk= 20, iat= 562,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 566, 567,
 &end
#
#  103 ASP  HN          103 ASP  HB-         3.50    (#    194:20  Unique         2.39, 2.62 A)
 &rst
  ixpk= 194, nxpk= 20, iat= 562,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 566, 567,
 &end
#
#    0 AMB  20-2:195      0 AMB  20-1:195    4.40    (#    195:20  Double Ambig)
 &rst
  ixpk= 195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 370, 301,
 igr2= 374, 375, 374, 375,
 &end
#
#    0 AMB  20-2:196      0 AMB  20-1:196    2.60    (#    196:20  Double Ambig)
 &rst
  ixpk= 196, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 379, 380, 379, 380,
 igr2= 374, 375, 374, 375,
 &end
#
#   90 ASN  HA           90 ASN  HB+         2.60    (#    197:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 197, nxpk= 20, iat= 372,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 374, 375,
 &end
#
#    0 AMB  20-2:199    100 ILE  HB          4.40    (#    199:20  Single Ambig)
 &rst
  ixpk= 199, nxpk= 20, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 521, 539, 540, 497,
 &end
#
#  100 ILE  HN          100 ILE  HB          2.60    (#    200:20  Unique         2.32, 2.47 A)
 &rst
  ixpk= 200, nxpk= 20, iat= 519, 523, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  100 ILE  MG2         100 ILE  HB          2.60    (#    201:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 201, nxpk= 20, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 525, 526, 527,
 &end
#
#    0 AMB  20-2:202    100 ILE  HB          2.60    (#    202:20  Single Ambig)
 &rst
  ixpk= 202, nxpk= 20, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 603, 604, 605, 529, 530, 532, 533, 534,
 &end
#
#    0 AMB  20-2:203     90 ASN  HB-         2.60    (#    203:20  Single Ambig)
 &rst
  ixpk= 203, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 370, 301,
 igr2= 374, 375,
 &end
#
#    0 AMB  20-2:204     90 ASN  HB-         2.60    (#    204:20  Single Ambig)
 &rst
  ixpk= 204, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 379, 380, 379, 380,
 igr2= 374, 375,
 &end
#
#   75 ILE  HA           75 ILE  HB          3.50    (#    206:20  Unique         2.49, 2.98 A)
 &rst
  ixpk= 206, nxpk= 20, iat= 114, 116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   75 ILE  HG1+         75 ILE  HB          4.40    (#    207:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 207, nxpk= 20, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 122, 123,
 &end
#
#   75 ILE  HG1-         75 ILE  HB          4.40    (#    208:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 208, nxpk= 20, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 122, 123,
 &end
#
#   75 ILE  MG2          75 ILE  HB          2.60    (#    209:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 209, nxpk= 20, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 118, 119, 120,
 &end
#
#   93 ASN  HA           93 ASN  HB+         3.50    (#    210:20  Unique         2.41, 2.74 A)
 &rst
  ixpk= 210, nxpk= 20, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 413, 414,
 &end
#
#   93 ASN  HA           93 ASN  HB-         3.50    (#    212:20  Unique         2.41, 2.74 A)
 &rst
  ixpk= 212, nxpk= 20, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 413, 414,
 &end
#
#  108 TYR  HN          108 TYR  HB+         2.60    (#    214:20  Unique         2.22, 2.47 A)
 &rst
  ixpk= 214, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 635, 636,
 &end
#
#  108 TYR  HD          108 TYR  HB+         3.50    (#    215:20  Unique         2.36, 3.07 A)
 &rst
  ixpk= 215, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 639, 648,
 igr2= 635, 636,
 &end
#
#  108 TYR  HN          108 TYR  HB-         2.60    (#    217:20  Unique         2.22, 2.47 A)
 &rst
  ixpk= 217, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 635, 636,
 &end
#
#  108 TYR  HD          108 TYR  HB-         3.50    (#    218:20  Unique         2.36, 3.07 A)
 &rst
  ixpk= 218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 639, 648,
 igr2= 635, 636,
 &end
#
#  106 ASP  HN          105 ILE  HB          2.60    (#    220:20  Unique         2.61, 2.63 A)
 &rst
  ixpk= 220, nxpk= 20, iat= 609, 594, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  105 ILE  HN          105 ILE  HB          2.60    (#    221:20  Unique         2.30, 2.33 A)
 &rst
  ixpk= 221, nxpk= 20, iat= 590, 594, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  102 ALA  HA          105 ILE  HB          2.60    (#    222:20  Unique         2.20, 2.25 A)
 &rst
  ixpk= 222, nxpk= 20, iat= 554, 594, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#  105 ILE  HG1-        105 ILE  HB          3.50    (#    223:20  Unique         2.71, 2.88 A)
 &rst
  ixpk= 223, nxpk= 20, iat=  -1, 594, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 600, 601,
 &end
#
#    0 AMB  20-2:224    105 ILE  HB          2.60    (#    224:20  Single Ambig)
 &rst
  ixpk= 224, nxpk= 20, iat=  -1, 594, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 596, 597, 598, 603, 604, 605,
 &end
#
#  100 ILE  MD1          83 ILE  HB          3.50    (#    225:20  Unique         2.41, 3.13 A)
 &rst
  ixpk= 225, nxpk= 20, iat=  -1, 234, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 532, 533, 534,
 &end
#
#   84 ARG  HN           83 ILE  HB          4.40    (#    226:20  Unique         2.61, 2.78 A)
 &rst
  ixpk= 226, nxpk= 20, iat= 249, 234, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   83 ILE  HN           83 ILE  HB          3.50    (#    227:20  Unique         2.38, 2.44 A)
 &rst
  ixpk= 227, nxpk= 20, iat= 230, 234, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   83 ILE  MG2          83 ILE  HB          2.60    (#    228:20  Unique         2.44, 2.68 A)
 &rst
  ixpk= 228, nxpk= 20, iat=  -1, 234, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 236, 237, 238,
 &end
#
#   83 ILE  HG1-         83 ILE  HB          3.50    (#    229:20  Unique         2.46, 2.81 A)
 &rst
  ixpk= 229, nxpk= 20, iat=  -1, 234, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 240, 241,
 &end
#
#    0 AMB  20-2:230      0 AMB  20-1:230    4.40    (#    230:20  Double Ambig)
 &rst
  ixpk= 230, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 167, 143,
 igr2= 174, 175, 174, 175,
 &end
#
#   78 GLU  HA           78 GLU  HG+         2.60    (#    231:20  Unique         2.40, 2.85 A)
 &rst
  ixpk= 231, nxpk= 20, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 174, 175,
 &end
#
#   78 GLU  HB+          78 GLU  HG+         2.60    (#    232:20  Unique         2.25, 2.74 A)
 &rst
  ixpk= 232, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 171, 172,
 igr2= 174, 175,
 &end
#
#  114 GLU  HB+         114 GLU  HG+         2.60    (#    233:20  Unique         2.32, 2.68 A)
 &rst
  ixpk= 233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 727, 728,
 igr2= 730, 731,
 &end
#
#  114 GLU  HB+         114 GLU  HG-         2.60    (#    234:20  Unique         2.32, 2.68 A)
 &rst
  ixpk= 234, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 727, 728,
 igr2= 730, 731,
 &end
#
#   85 GLU  HN           85 GLU  HG+         4.40    (#    235:20  Unique         2.29, 4.23 A)
 &rst
  ixpk= 235, nxpk= 20, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 280, 281,
 &end
#
#    0 AMB  20-2:236      0 AMB  20-1:236    2.60    (#    236:20  Double Ambig)
 &rst
  ixpk= 236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 275, 222,
 igr2= 280, 281, 280, 281,
 &end
#
#   85 GLU  HB+          85 GLU  HG+         2.60    (#    237:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 277, 278,
 igr2= 280, 281,
 &end
#
#   79 GLN  HA           79 GLN  HG+         6.00    (#    239:20  Unique         2.42, 3.24 A)
 &rst
  ixpk= 239, nxpk= 20, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 189, 190,
 &end
#
#    0 AMB  20-2:241      0 AMB  20-1:241    2.60    (#    241:20  Double Ambig)
 &rst
  ixpk= 241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 186, 187, 171, 172,
 igr2= 189, 190, 189, 190,
 &end
#
#    0 AMB  20-2:242     79 GLN  HG-         2.60    (#    242:20  Single Ambig)
 &rst
  ixpk= 242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 186, 187, 171, 172,
 igr2= 189, 190,
 &end
#
#   79 GLN  HA           79 GLN  HG-         6.00    (#    243:20  Unique         2.42, 3.24 A)
 &rst
  ixpk= 243, nxpk= 20, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 189, 190,
 &end
#
#   94 VAL  HN           94 VAL  HB          4.40    (#    245:20  Unique         3.34, 3.45 A)
 &rst
  ixpk= 245, nxpk= 20, iat= 423, 427, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   94 VAL  HA           94 VAL  HB          3.50    (#    246:20  Unique         2.43, 2.49 A)
 &rst
  ixpk= 246, nxpk= 20, iat= 425, 427, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:247     94 VAL  HB          2.60    (#    247:20  Single Ambig)
 &rst
  ixpk= 247, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 429, 430, 431, 433, 434, 435, 525, 526, 527,
 &end
#
#  101 PRO  HA          101 PRO  HB+         2.60    (#    249:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 249, nxpk= 20, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 545, 546,
 &end
#
#  101 PRO  HG+         101 PRO  HB+         2.60    (#    250:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 542, 543,
 igr2= 545, 546,
 &end
#
#   97 ARG  HA           97 ARG  HB+         3.50    (#    254:20  Unique         2.36, 2.68 A)
 &rst
  ixpk= 254, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 468, 469,
 &end
#
#   92 HIS  HA           92 HIS  HB+         4.40    (#    257:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 257, nxpk= 20, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 395, 396,
 &end
#
#   87 ALA  MB           92 HIS  HB-         4.40    (#    260:20  Unique         2.37, 4.06 A)
 &rst
  ixpk= 260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 316, 317, 318,
 igr2= 395, 396,
 &end
#
#    0 AMB  20-2:261    104 VAL  HB          2.60    (#    261:20  Single Ambig)
 &rst
  ixpk= 261, nxpk= 20, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 574, 590,
 &end
#
#  101 PRO  HD-         104 VAL  HB          4.40    (#    262:20  Unique         2.69, 4.13 A)
 &rst
  ixpk= 262, nxpk= 20, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 539, 540,
 &end
#
#    0 AMB  20-2:263    104 VAL  HB          2.60    (#    263:20  Single Ambig)
 &rst
  ixpk= 263, nxpk= 20, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 580, 581, 582, 584, 585, 586, 525, 526, 527,
 &end
#
#  104 VAL  MGX         104 VAL  HB          2.60    (#    264:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 264, nxpk= 20, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#   89 ARG  HN           89 ARG  HB+         2.60    (#    265:20  Unique         2.16, 2.96 A)
 &rst
  ixpk= 265, nxpk= 20, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 350, 351,
 &end
#
#   89 ARG  HA           89 ARG  HB+         2.60    (#    266:20  Unique         2.44, 2.80 A)
 &rst
  ixpk= 266, nxpk= 20, iat= 348,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 350, 351,
 &end
#
#   99 ARG  HA           99 ARG  HB+         2.60    (#    267:20  Unique         2.47, 2.78 A)
 &rst
  ixpk= 267, nxpk= 20, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 499, 500,
 &end
#
#   99 ARG  HD+          99 ARG  HB+         2.60    (#    268:20  Unique         2.43, 3.00 A)
 &rst
  ixpk= 268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 505, 506,
 igr2= 499, 500,
 &end
#
#   99 ARG  HN           99 ARG  HB+         3.50    (#    269:20  Unique         2.30, 2.91 A)
 &rst
  ixpk= 269, nxpk= 20, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 499, 500,
 &end
#
#   88 ARG  HN           88 ARG  HB+         2.60    (#    270:20  Unique         2.25, 2.55 A)
 &rst
  ixpk= 270, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 326, 327,
 &end
#
#   89 ARG  HN           88 ARG  HB+         3.50    (#    271:20  Unique         2.50, 3.20 A)
 &rst
  ixpk= 271, nxpk= 20, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 326, 327,
 &end
#
#   88 ARG  HA           88 ARG  HB+         2.60    (#    272:20  Unique         2.47, 2.78 A)
 &rst
  ixpk= 272, nxpk= 20, iat= 324,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 326, 327,
 &end
#
#   88 ARG  HD+          88 ARG  HB+         2.60    (#    273:20  Unique         2.35, 3.06 A)
 &rst
  ixpk= 273, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 332, 333,
 igr2= 326, 327,
 &end
#
#    0 AMB  20-2:274      0 AMB  20-1:274    2.60    (#    274:20  Double Ambig)
 &rst
  ixpk= 274, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 329, 330, 353, 354,
 igr2= 326, 327, 326, 327,
 &end
#
#  114 GLU  HN          114 GLU  HB+         2.60    (#    275:20  Unique         2.19, 2.98 A)
 &rst
  ixpk= 275, nxpk= 20, iat= 723,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 727, 728,
 &end
#
#    0 AMB  20-2:276      0 AMB  20-1:276    2.60    (#    276:20  Double Ambig)
 &rst
  ixpk= 276, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 145, 725,
 igr2= 147, 148, 727, 728,
 &end
#
#    0 AMB  20-2:277      0 AMB  20-1:277    2.60    (#    277:20  Double Ambig)
 &rst
  ixpk= 277, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 730, 731, 277, 278,
 igr2= 727, 728, 253, 254,
 &end
#
#    0 AMB  20-2:278      0 AMB  20-1:278    2.60    (#    278:20  Double Ambig)
 &rst
  ixpk= 278, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 143, 167, 756,
 igr2= 147, 148, 147, 148, 727, 728,
 &end
#
#   77 ARG  HD+          77 ARG  HB+         2.60    (#    279:20  Unique         2.40, 3.08 A)
 &rst
  ixpk= 279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 153, 154,
 igr2= 147, 148,
 &end
#
#  115 HIS  HA          115 HIS  HB+         2.60    (#    281:20  Unique         2.21, 2.74 A)
 &rst
  ixpk= 281, nxpk= 20, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 742, 743,
 &end
#
#  115 HIS  HA          115 HIS  HB-         2.60    (#    282:20  Unique         2.21, 2.74 A)
 &rst
  ixpk= 282, nxpk= 20, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 742, 743,
 &end
#
#   84 ARG  HN           84 ARG  HB+         2.60    (#    284:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 284, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 253, 254,
 &end
#
#   84 ARG  HG+          84 ARG  HB+         2.60    (#    285:20  Unique         2.27, 2.76 A)
 &rst
  ixpk= 285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 256, 257,
 igr2= 253, 254,
 &end
#
#   84 ARG  HB-          84 ARG  HG+         2.60    (#    286:20  Unique         2.27, 2.76 A)
 &rst
  ixpk= 286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 253, 254,
 igr2= 256, 257,
 &end
#
#    0 AMB  20-2:288      0 AMB  20-1:288    2.60    (#    288:20  Double Ambig)
 &rst
  ixpk= 288, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 273, 210,
 igr2= 277, 278, 171, 172,
 &end
#
#   78 GLU  HN           78 GLU  HB+         2.60    (#    289:20  Unique         2.24, 2.73 A)
 &rst
  ixpk= 289, nxpk= 20, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 171, 172,
 &end
#
#    0 AMB  20-2:290      0 AMB  20-1:290    2.60    (#    290:20  Double Ambig)
 &rst
  ixpk= 290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 275, 169, 222,
 igr2= 277, 278, 171, 172, 277, 278,
 &end
#
#    0 AMB  20-2:291      0 AMB  20-1:291    2.60    (#    291:20  Double Ambig)
 &rst
  ixpk= 291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 174, 175, 189, 190,
 igr2= 171, 172, 171, 172,
 &end
#
#   86 TRP  HN           86 TRP  HB+         2.60    (#    292:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 292, nxpk= 20, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 292, 293,
 &end
#
#   86 TRP  HD1          86 TRP  HB-         6.00    (#    294:20  Unique         2.62, 3.23 A)
 &rst
  ixpk= 294, nxpk= 20, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 292, 293,
 &end
#
#   86 TRP  HN           86 TRP  HB-         2.60    (#    295:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 295, nxpk= 20, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 292, 293,
 &end
#
#   86 TRP  HA           86 TRP  HB-         2.60    (#    296:20  Unique         2.40, 2.72 A)
 &rst
  ixpk= 296, nxpk= 20, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 292, 293,
 &end
#
#   83 ILE  HA           86 TRP  HB-         3.50    (#    298:20  Unique         2.28, 3.02 A)
 &rst
  ixpk= 298, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 292, 293,
 &end
#
#  109 HIS  HN          109 HIS  HB+         2.60    (#    299:20  Unique         2.27, 3.02 A)
 &rst
  ixpk= 299, nxpk= 20, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 656, 657,
 &end
#
#  110 ALA  HN          109 HIS  HB+         4.40    (#    300:20  Unique         2.72, 3.31 A)
 &rst
  ixpk= 300, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 656, 657,
 &end
#
#  106 ASP  HA          109 HIS  HB+         3.50    (#    301:20  Unique         2.51, 3.45 A)
 &rst
  ixpk= 301, nxpk= 20, iat= 611,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 656, 657,
 &end
#
#  109 HIS  HA          109 HIS  HB+         2.60    (#    302:20  Unique         2.49, 2.79 A)
 &rst
  ixpk= 302, nxpk= 20, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 656, 657,
 &end
#
#  105 ILE  HN          105 ILE  HG1-        3.50    (#    303:20  Unique         2.42, 3.17 A)
 &rst
  ixpk= 303, nxpk= 20, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 600, 601,
 &end
#
#  105 ILE  HB          105 ILE  HG1-        4.40    (#    304:20  Unique         2.71, 2.88 A)
 &rst
  ixpk= 304, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 600, 601,
 &end
#
#  101 PRO  HD+         101 PRO  HG+         3.50    (#    307:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 539, 540,
 igr2= 542, 543,
 &end
#
#  101 PRO  HD-         101 PRO  HG+         3.50    (#    308:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 539, 540,
 igr2= 542, 543,
 &end
#
#  101 PRO  HB+         101 PRO  HG+         2.60    (#    309:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 545, 546,
 igr2= 542, 543,
 &end
#
#  104 VAL  MGY         101 PRO  HG+         4.40    (#    310:20  Unique         2.18, 5.27 A)
 &rst
  ixpk= 310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 542, 543,
 &end
#
#  100 ILE  HN          100 ILE  HG1-        3.50    (#    312:20  Unique         2.24, 3.07 A)
 &rst
  ixpk= 312, nxpk= 20, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 529, 530,
 &end
#
#    0 AMB  20-2:317      0 AMB  20-1:317    2.60    (#    317:20  Double Ambig)
 &rst
  ixpk= 317, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 348, 275,
 igr2= 353, 354, 353, 354, 329, 330, 329, 330,
 &end
#
#    0 AMB  20-2:319     89 ARG  HG-         2.60    (#    319:20  Single Ambig)
 &rst
  ixpk= 319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 348, 275,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:320      0 AMB  20-1:320    2.60    (#    320:20  Double Ambig)
 &rst
  ixpk= 320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 147, 148,  44,  45,
 igr2= 150, 151,  47,  48,
 &end
#
#   75 ILE  HB           75 ILE  HG1-        3.50    (#    322:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 322, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 122, 123,
 &end
#
#   75 ILE  MD1          75 ILE  HG1-        3.50    (#    324:20  Unique         2.34, 2.66 A)
 &rst
  ixpk= 324, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 125, 126, 127,
 igr2= 122, 123,
 &end
#
#   75 ILE  MD1          75 ILE  HG1+        2.60    (#    325:20  Unique         2.34, 2.66 A)
 &rst
  ixpk= 325, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 125, 126, 127,
 igr2= 122, 123,
 &end
#
#   83 ILE  HN           83 ILE  HG1-        3.50    (#    327:20  Unique         2.20, 2.97 A)
 &rst
  ixpk= 327, nxpk= 20, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 240, 241,
 &end
#
#    0 AMB  20-2:330    104 VAL  MGY         2.60    (#    330:20  Single Ambig)
 &rst
  ixpk= 330, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 574, 590,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  101 PRO  HD+         104 VAL  MGY         4.40    (#    331:20  Unique         2.43, 4.97 A)
 &rst
  ixpk= 331, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 539, 540,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  104 VAL  HA          104 VAL  MGY         2.60    (#    332:20  Unique         2.29, 3.20 A)
 &rst
  ixpk= 332, nxpk= 20, iat= 576,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  101 PRO  HD-         104 VAL  MGY         2.60    (#    333:20  Unique         2.43, 4.97 A)
 &rst
  ixpk= 333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 539, 540,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   92 HIS  HB+         104 VAL  MGY         3.50    (#    334:20  Unique         2.56, 5.02 A)
 &rst
  ixpk= 334, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 395, 396,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  20-2:335    104 VAL  MGY         2.60    (#    335:20  Single Ambig)
 &rst
  ixpk= 335, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 542, 543, 545, 546, 578,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   96 THR  HB           96 THR  MG2         2.60    (#    336:20  Unique         2.43, 2.66 A)
 &rst
  ixpk= 336, nxpk= 20, iat= 454,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 456, 457, 458,
 &end
#
#   96 THR  HA           96 THR  MG2         2.60    (#    337:20  Unique         2.42, 3.06 A)
 &rst
  ixpk= 337, nxpk= 20, iat= 452,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 456, 457, 458,
 &end
#
#   94 VAL  HA           94 VAL  MGY         3.50    (#    338:20  Unique         2.31, 3.52 A)
 &rst
  ixpk= 338, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  20-2:339     94 VAL  MGY         3.50    (#    339:20  Single Ambig)
 &rst
  ixpk= 339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 539, 540, 521,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#  101 PRO  HD-          94 VAL  MGY         6.00    (#    340:20  Unique         2.32, 5.50 A)
 &rst
  ixpk= 340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 539, 540,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  20-2:341     94 VAL  MGY         2.60    (#    341:20  Single Ambig)
 &rst
  ixpk= 341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1= 427, 542, 543, 578,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   87 ALA  MB           94 VAL  MGY         3.50    (#    342:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 316, 317, 318,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   86 TRP  HE3         104 VAL  MGX         3.50    (#    343:20  Unique         3.07, 5.31 A)
 &rst
  ixpk= 343, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   86 TRP  HZ3         104 VAL  MGX         2.60    (#    344:20  Unique         2.36, 4.37 A)
 &rst
  ixpk= 344, nxpk= 20, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  104 VAL  HA          104 VAL  MGX         2.60    (#    345:20  Unique         2.29, 3.20 A)
 &rst
  ixpk= 345, nxpk= 20, iat= 576,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  101 PRO  HD-         104 VAL  MGX         6.00    (#    346:20  Unique         2.43, 4.97 A)
 &rst
  ixpk= 346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 539, 540,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  20-2:347    104 VAL  MGX         2.60    (#    347:20  Single Ambig)
 &rst
  ixpk= 347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 542, 543, 545, 546, 578, 427,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   87 ALA  MB          104 VAL  MGX         2.60    (#    348:20  Unique         2.38, 4.54 A)
 &rst
  ixpk= 348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 316, 317, 318,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   94 VAL  HN           94 VAL  MGX         3.50    (#    349:20  Unique         2.62, 4.19 A)
 &rst
  ixpk= 349, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   94 VAL  HA           94 VAL  MGX         4.40    (#    350:20  Unique         2.31, 3.52 A)
 &rst
  ixpk= 350, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  20-2:351     94 VAL  MGX         4.40    (#    351:20  Single Ambig)
 &rst
  ixpk= 351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 539, 540, 521,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   84 ARG  HA           94 VAL  MGX         6.00    (#    352:20  Unique         2.26, 3.60 A)
 &rst
  ixpk= 352, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#  101 PRO  HD-          94 VAL  MGX         6.00    (#    353:20  Unique         2.32, 5.50 A)
 &rst
  ixpk= 353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 539, 540,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  20-2:354     94 VAL  MGX         2.60    (#    354:20  Single Ambig)
 &rst
  ixpk= 354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1= 427, 542, 543, 578,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   84 ARG  HB-          94 VAL  MGX         4.40    (#    355:20  Unique         2.77, 5.22 A)
 &rst
  ixpk= 355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 253, 254,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   87 ALA  MB           94 VAL  MGX         2.60    (#    356:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 316, 317, 318,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   84 ARG  HG+          94 VAL  MGX         4.40    (#    357:20  Unique         2.38, 4.07 A)
 &rst
  ixpk= 357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 256, 257,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#  112 THR  HN          112 THR  MG2         3.50    (#    358:20  Unique         2.25, 3.33 A)
 &rst
  ixpk= 358, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 696, 697, 698,
 &end
#
#  108 TYR  HE          112 THR  MG2         6.00    (#    359:20  Unique         3.17, 4.51 A)
 &rst
  ixpk= 359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 641, 646,
 igr2= 696, 697, 698,
 &end
#
#    0 AMB  20-2:360    112 THR  MG2         2.60    (#    360:20  Single Ambig)
 &rst
  ixpk= 360, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 694, 654,
 igr2= 696, 697, 698,
 &end
#
#  111 ALA  MB          112 THR  MG2         4.40    (#    361:20  Unique         3.06, 5.17 A)
 &rst
  ixpk= 361, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 684, 685, 686,
 igr2= 696, 697, 698,
 &end
#
#   86 TRP  HE1         111 ALA  MB          3.50    (#    364:20  Unique         2.33, 3.24 A)
 &rst
  ixpk= 364, nxpk= 20, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 684, 685, 686,
 &end
#
#  111 ALA  HN          111 ALA  MB          2.60    (#    365:20  Unique         2.31, 2.81 A)
 &rst
  ixpk= 365, nxpk= 20, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 684, 685, 686,
 &end
#
#  112 THR  HN          111 ALA  MB          2.60    (#    366:20  Unique         2.70, 3.51 A)
 &rst
  ixpk= 366, nxpk= 20, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 684, 685, 686,
 &end
#
#   86 TRP  HZ2         111 ALA  MB          2.60    (#    367:20  Unique         2.26, 2.96 A)
 &rst
  ixpk= 367, nxpk= 20, iat= 301,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 684, 685, 686,
 &end
#
#  111 ALA  HA          111 ALA  MB          2.60    (#    368:20  Unique         2.44, 2.65 A)
 &rst
  ixpk= 368, nxpk= 20, iat= 682,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 684, 685, 686,
 &end
#
#  108 TYR  HA          111 ALA  MB          4.40    (#    369:20  Unique         2.63, 3.68 A)
 &rst
  ixpk= 369, nxpk= 20, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 684, 685, 686,
 &end
#
#    0 AMB  20-2:370     74 ALA  MB          3.50    (#    370:20  Single Ambig)
 &rst
  ixpk= 370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 102, 112,
 igr2= 106, 107, 108,
 &end
#
#   74 ALA  HA           74 ALA  MB          2.60    (#    371:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 371, nxpk= 20, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 106, 107, 108,
 &end
#
#    0 AMB  20-2:372     74 ALA  MB          4.40    (#    372:20  Single Ambig)
 &rst
  ixpk= 372, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=  75,  76, 116,
 igr2= 106, 107, 108,
 &end
#
#    0 AMB  20-2:373    102 ALA  MB          2.60    (#    373:20  Single Ambig)
 &rst
  ixpk= 373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 552, 562,
 igr2= 556, 557, 558,
 &end
#
#    0 AMB  20-2:374    102 ALA  MB          3.50    (#    374:20  Single Ambig)
 &rst
  ixpk= 374, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 548, 564, 611,
 igr2= 556, 557, 558,
 &end
#
#  102 ALA  HA          102 ALA  MB          2.60    (#    375:20  Unique         2.40, 2.63 A)
 &rst
  ixpk= 375, nxpk= 20, iat= 554,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 556, 557, 558,
 &end
#
#   87 ALA  HN           87 ALA  MB          2.60    (#    377:20  Unique         2.40, 2.84 A)
 &rst
  ixpk= 377, nxpk= 20, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 316, 317, 318,
 &end
#
#    0 AMB  20-2:378     87 ALA  MB          6.00    (#    378:20  Single Ambig)
 &rst
  ixpk= 378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 391, 273,
 igr2= 316, 317, 318,
 &end
#
#   88 ARG  HN           87 ALA  MB          2.60    (#    379:20  Unique         2.56, 3.43 A)
 &rst
  ixpk= 379, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 316, 317, 318,
 &end
#
#   86 TRP  HE3          87 ALA  MB          3.50    (#    380:20  Unique         2.42, 3.65 A)
 &rst
  ixpk= 380, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 316, 317, 318,
 &end
#
#   86 TRP  HZ3          87 ALA  MB          4.40    (#    381:20  Unique         3.12, 4.39 A)
 &rst
  ixpk= 381, nxpk= 20, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 316, 317, 318,
 &end
#
#   84 ARG  HA           87 ALA  MB          2.60    (#    382:20  Unique         2.57, 3.57 A)
 &rst
  ixpk= 382, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 316, 317, 318,
 &end
#
#   87 ALA  HA           87 ALA  MB          2.60    (#    383:20  Unique         2.43, 2.67 A)
 &rst
  ixpk= 383, nxpk= 20, iat= 314,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 316, 317, 318,
 &end
#
#   92 HIS  HB+          87 ALA  MB          4.40    (#    384:20  Unique         2.37, 4.06 A)
 &rst
  ixpk= 384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 395, 396,
 igr2= 316, 317, 318,
 &end
#
#   92 HIS  HB-          87 ALA  MB          3.50    (#    385:20  Unique         2.37, 4.06 A)
 &rst
  ixpk= 385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 395, 396,
 igr2= 316, 317, 318,
 &end
#
#   94 VAL  HB           87 ALA  MB          3.50    (#    386:20  Unique         2.41, 3.26 A)
 &rst
  ixpk= 386, nxpk= 20, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 316, 317, 318,
 &end
#
#   94 VAL  MGX          87 ALA  MB          2.60    (#    387:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 387, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 429, 430, 431, 433, 434, 435,
 igr2= 316, 317, 318,
 &end
#
#  104 VAL  MGX          87 ALA  MB          2.60    (#    388:20  Unique         2.38, 4.54 A)
 &rst
  ixpk= 388, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 316, 317, 318,
 &end
#
#    0 AMB  20-2:389      0 AMB  20-1:389    4.40    (#    389:20  Double Ambig)
 &rst
  ixpk= 389, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
 igr1= 171, 172, 186, 187, 277, 278,
 igr2= 214, 215, 216, 224, 225, 226,
 &end
#
#    0 AMB  20-2:390      0 AMB  20-1:390    2.60    (#    390:20  Double Ambig)
 &rst
  ixpk= 390, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 210, 230,
 igr2= 214, 215, 216, 224, 225, 226,
 &end
#
#   82 ALA  HN            0 AMB  20-1:391    2.60    (#    391:20  Single Ambig)
 &rst
  ixpk= 391, nxpk= 20, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 224, 225, 226, 214, 215, 216,
 &end
#
#    0 AMB  20-2:392      0 AMB  20-1:392    2.60    (#    392:20  Double Ambig)
 &rst
  ixpk= 392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 169, 222,
 igr2= 214, 215, 216, 224, 225, 226,
 &end
#
#  110 ALA  HN          110 ALA  MB          2.60    (#    393:20  Unique         2.42, 2.87 A)
 &rst
  ixpk= 393, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 674, 675, 676,
 &end
#
#  111 ALA  HN          110 ALA  MB          2.60    (#    394:20  Unique         2.49, 3.45 A)
 &rst
  ixpk= 394, nxpk= 20, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 674, 675, 676,
 &end
#
#  110 ALA  HA          110 ALA  MB          2.60    (#    395:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 395, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 674, 675, 676,
 &end
#
#  108 TYR  HN          107 ALA  MB          3.50    (#    397:20  Unique         2.51, 3.39 A)
 &rst
  ixpk= 397, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 625, 626, 627,
 &end
#
#  107 ALA  HN          107 ALA  MB          2.60    (#    398:20  Unique         2.35, 2.83 A)
 &rst
  ixpk= 398, nxpk= 20, iat= 621,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 625, 626, 627,
 &end
#
#    0 AMB  20-2:399    107 ALA  MB          4.40    (#    399:20  Single Ambig)
 &rst
  ixpk= 399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 301, 574,
 igr2= 625, 626, 627,
 &end
#
#   86 TRP  HH2         107 ALA  MB          3.50    (#    400:20  Unique         2.20, 3.12 A)
 &rst
  ixpk= 400, nxpk= 20, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 625, 626, 627,
 &end
#
#   86 TRP  HZ3         107 ALA  MB          4.40    (#    401:20  Unique         2.58, 3.46 A)
 &rst
  ixpk= 401, nxpk= 20, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 625, 626, 627,
 &end
#
#  107 ALA  HA          107 ALA  MB          2.60    (#    402:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 402, nxpk= 20, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 625, 626, 627,
 &end
#
#  104 VAL  HA          107 ALA  MB          2.60    (#    403:20  Unique         2.17, 2.95 A)
 &rst
  ixpk= 403, nxpk= 20, iat= 576,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 625, 626, 627,
 &end
#
#    0 AMB  20-2:404    100 ILE  MG2         4.40    (#    404:20  Single Ambig)
 &rst
  ixpk= 404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 590, 574,
 igr2= 525, 526, 527,
 &end
#
#    0 AMB  20-2:405    100 ILE  MG2         2.60    (#    405:20  Single Ambig)
 &rst
  ixpk= 405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 539, 540, 521,
 igr2= 525, 526, 527,
 &end
#
#  101 PRO  HD-         100 ILE  MG2         2.60    (#    406:20  Unique         2.13, 3.55 A)
 &rst
  ixpk= 406, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 539, 540,
 igr2= 525, 526, 527,
 &end
#
#    0 AMB  20-2:407    100 ILE  MG2         2.60    (#    407:20  Single Ambig)
 &rst
  ixpk= 407, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 578, 542, 543, 427,
 igr2= 525, 526, 527,
 &end
#
#  100 ILE  HB          100 ILE  MG2         2.60    (#    408:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 408, nxpk= 20, iat= 523,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 525, 526, 527,
 &end
#
#  105 ILE  HG1-        100 ILE  MG2         2.60    (#    409:20  Unique         2.43, 3.70 A)
 &rst
  ixpk= 409, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 600, 601,
 igr2= 525, 526, 527,
 &end
#
#    0 AMB  20-2:410     75 ILE  MG2         2.60    (#    410:20  Single Ambig)
 &rst
  ixpk= 410, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 114, 145,
 igr2= 118, 119, 120,
 &end
#
#   75 ILE  HB           75 ILE  MG2         2.60    (#    411:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 411, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 118, 119, 120,
 &end
#
#    0 AMB  20-2:412     75 ILE  MG2         4.40    (#    412:20  Single Ambig)
 &rst
  ixpk= 412, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 131, 199,
 igr2= 118, 119, 120,
 &end
#
#  106 ASP  HN          105 ILE  MG2         3.50    (#    413:20  Unique         3.25, 4.10 A)
 &rst
  ixpk= 413, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 596, 597, 598,
 &end
#
#  109 HIS  HD2         105 ILE  MG2         4.40    (#    414:20  Unique         2.40, 3.70 A)
 &rst
  ixpk= 414, nxpk= 20, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 596, 597, 598,
 &end
#
#  106 ASP  HA          105 ILE  MG2         4.40    (#    415:20  Unique         3.61, 4.67 A)
 &rst
  ixpk= 415, nxpk= 20, iat= 611,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 596, 597, 598,
 &end
#
#  105 ILE  HA          105 ILE  MG2         2.60    (#    416:20  Unique         2.63, 3.29 A)
 &rst
  ixpk= 416, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 596, 597, 598,
 &end
#
#  105 ILE  HB          105 ILE  MG2         2.60    (#    417:20  Unique         2.41, 2.66 A)
 &rst
  ixpk= 417, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 596, 597, 598,
 &end
#
#   84 ARG  HN           83 ILE  MG2         6.00    (#    418:20  Unique         3.50, 4.36 A)
 &rst
  ixpk= 418, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 236, 237, 238,
 &end
#
#    0 AMB  20-2:419     83 ILE  MG2         6.00    (#    419:20  Single Ambig)
 &rst
  ixpk= 419, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 230, 273,
 igr2= 236, 237, 238,
 &end
#
#  105 ILE  HA           83 ILE  MG2         4.40    (#    420:20  Unique         2.49, 3.48 A)
 &rst
  ixpk= 420, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 236, 237, 238,
 &end
#
#   83 ILE  HA           83 ILE  MG2         2.60    (#    421:20  Unique         2.54, 3.22 A)
 &rst
  ixpk= 421, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 236, 237, 238,
 &end
#
#  108 TYR  HB-          83 ILE  MG2         4.40    (#    422:20  Unique         2.34, 3.79 A)
 &rst
  ixpk= 422, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 635, 636,
 igr2= 236, 237, 238,
 &end
#
#    0 AMB  20-2:423     83 ILE  MG2         2.60    (#    423:20  Single Ambig)
 &rst
  ixpk= 423, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 234, 600, 601,
 igr2= 236, 237, 238,
 &end
#
#  100 ILE  HG1-        100 ILE  MD1         2.60    (#    426:20  Unique         2.34, 2.64 A)
 &rst
  ixpk= 426, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 529, 530,
 igr2= 532, 533, 534,
 &end
#
#    0 AMB  20-2:427    100 ILE  MD1         3.50    (#    427:20  Single Ambig)
 &rst
  ixpk= 427, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 521, 539, 540,
 igr2= 532, 533, 534,
 &end
#
#    0 AMB  20-2:428    100 ILE  MD1         2.60    (#    428:20  Single Ambig)
 &rst
  ixpk= 428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 203, 204, 201,
 igr2= 532, 533, 534,
 &end
#
#   84 ARG  HA          100 ILE  MD1         6.00    (#    429:20  Unique         2.99, 4.20 A)
 &rst
  ixpk= 429, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 532, 533, 534,
 &end
#
#   83 ILE  HG1-         83 ILE  MD1         2.60    (#    430:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 430, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 240, 241,
 igr2= 243, 244, 245,
 &end
#
#   80 SER  HA           83 ILE  MD1         4.40    (#    431:20  Unique         2.33, 4.13 A)
 &rst
  ixpk= 431, nxpk= 20, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 243, 244, 245,
 &end
#
#    0 AMB  20-2:432     83 ILE  MD1         2.60    (#    432:20  Single Ambig)
 &rst
  ixpk= 432, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 600, 601, 234,
 igr2= 243, 244, 245,
 &end
#
#    0 AMB  20-2:433     83 ILE  MD1         2.60    (#    433:20  Single Ambig)
 &rst
  ixpk= 433, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 596, 597, 598, 532, 533, 534,
 igr2= 243, 244, 245,
 &end
#
#  105 ILE  HB          105 ILE  HA          4.40    (#    436:20  Unique         3.04, 3.04 A)
 &rst
  ixpk= 436, nxpk= 20, iat= 594, 592, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  108 TYR  HB-         105 ILE  HA          6.00    (#    437:20  Unique         2.50, 3.19 A)
 &rst
  ixpk= 437, nxpk= 20, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 635, 636,
 &end
#
#  108 TYR  HB+         105 ILE  HA          3.50    (#    438:20  Unique         2.50, 3.19 A)
 &rst
  ixpk= 438, nxpk= 20, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 635, 636,
 &end
#
#  107 ALA  HN          104 VAL  HA          4.40    (#    439:20  Unique         3.02, 3.10 A)
 &rst
  ixpk= 439, nxpk= 20, iat= 621, 576, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  20-2:440    105 ILE  HA          4.40    (#    440:20  Single Ambig)
 &rst
  ixpk= 440, nxpk= 20, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 631, 609,
 &end
#
#    0 AMB  20-2:441    104 VAL  HA          6.00    (#    441:20  Single Ambig)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1, 576, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 631, 609,
 &end
#
#   86 TRP  HZ3         104 VAL  HA          6.00    (#    442:20  Unique         3.59, 3.69 A)
 &rst
  ixpk= 442, nxpk= 20, iat= 305, 576, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  108 TYR  HD           83 ILE  HA          4.40    (#    443:20  Unique         2.65, 4.29 A)
 &rst
  ixpk= 443, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 639, 648,
 &end
#
#  108 TYR  HE           83 ILE  HA          4.40    (#    444:20  Unique         2.98, 4.82 A)
 &rst
  ixpk= 444, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 641, 646,
 &end
#
#    0 AMB  20-2:445     83 ILE  HA          4.40    (#    445:20  Single Ambig)
 &rst
  ixpk= 445, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 288, 249,
 &end
#
#   84 ARG  HD-          96 THR  HA          4.40    (#    446:20  Unique         2.40, 3.73 A)
 &rst
  ixpk= 446, nxpk= 20, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 259, 260,
 &end
#
#  102 ALA  MB          101 PRO  HA          6.00    (#    449:20  Unique         4.36, 4.99 A)
 &rst
  ixpk= 449, nxpk= 20, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 556, 557, 558,
 &end
#
#    0 AMB  20-2:450    112 THR  HA          6.00    (#    450:20  Single Ambig)
 &rst
  ixpk= 450, nxpk= 20, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 684, 685, 686, 708, 709,
 &end
#
#    0 AMB  20-2:451     80 SER  HB-         6.00    (#    451:20  Single Ambig)
 &rst
  ixpk= 451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 214, 215, 216, 234,
 igr2= 203, 204,
 &end
#
#    0 AMB  20-2:452      0 AMB  20-1:452    4.40    (#    452:20  Double Ambig)
 &rst
  ixpk= 452, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr1= 214, 215, 216, 234,
 igr2= 203, 204, 203, 204,
 &end
#
#   81 ALA  HN           80 SER  HB-         4.40    (#    453:20  Unique         2.45, 3.39 A)
 &rst
  ixpk= 453, nxpk= 20, iat= 210,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 203, 204,
 &end
#
#   81 ALA  HN           80 SER  HB+         4.40    (#    454:20  Unique         2.45, 3.39 A)
 &rst
  ixpk= 454, nxpk= 20, iat= 210,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 203, 204,
 &end
#
#   89 ARG  HD+          86 TRP  HA          4.40    (#    455:20  Unique         2.65, 3.92 A)
 &rst
  ixpk= 455, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 356, 357,
 &end
#
#   89 ARG  HN           86 TRP  HA          6.00    (#    456:20  Unique         3.51, 3.61 A)
 &rst
  ixpk= 456, nxpk= 20, iat= 346, 290, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   87 ALA  HN           86 TRP  HA          4.40    (#    457:20  Unique         3.59, 3.61 A)
 &rst
  ixpk= 457, nxpk= 20, iat= 312, 290, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  20-2:458     86 TRP  HA          6.00    (#    458:20  Single Ambig)
 &rst
  ixpk= 458, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 353, 354, 316, 317, 318,
 &end
#
#   75 ILE  HG1+         75 ILE  HA          4.40    (#    459:20  Unique         2.31, 3.06 A)
 &rst
  ixpk= 459, nxpk= 20, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 122, 123,
 &end
#
#   78 GLU  HB+          75 ILE  HA          6.00    (#    460:20  Unique         3.87, 5.43 A)
 &rst
  ixpk= 460, nxpk= 20, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 171, 172,
 &end
#
#   75 ILE  HN           75 ILE  HA          4.40    (#    461:20  Unique         2.25, 2.91 A)
 &rst
  ixpk= 461, nxpk= 20, iat= 112, 114, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   84 ARG  HN           80 SER  HA          6.00    (#    462:20  Unique         3.81, 3.99 A)
 &rst
  ixpk= 462, nxpk= 20, iat= 249, 201, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   80 SER  HN           80 SER  HA          4.40    (#    463:20  Unique         2.78, 2.86 A)
 &rst
  ixpk= 463, nxpk= 20, iat= 199, 201, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   94 VAL  MGX          84 ARG  HA          6.00    (#    464:20  Unique         2.26, 3.60 A)
 &rst
  ixpk= 464, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  20-2:465     84 ARG  HA          4.40    (#    465:20  Single Ambig)
 &rst
  ixpk= 465, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 532, 533, 534, 529, 530,
 &end
#
#    0 AMB  20-2:466     84 ARG  HA          4.40    (#    466:20  Single Ambig)
 &rst
  ixpk= 466, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 273, 230,
 &end
#
#   87 ALA  HN           84 ARG  HA          4.40    (#    467:20  Unique         3.40, 3.55 A)
 &rst
  ixpk= 467, nxpk= 20, iat= 312, 251, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  108 TYR  HD          108 TYR  HA          4.40    (#    468:20  Unique         2.75, 3.62 A)
 &rst
  ixpk= 468, nxpk= 20, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 639, 648,
 &end
#
#  108 TYR  HN          108 TYR  HA          4.40    (#    469:20  Unique         2.83, 2.85 A)
 &rst
  ixpk= 469, nxpk= 20, iat= 631, 633, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  100 ILE  HN          100 ILE  HA          4.40    (#    470:20  Unique         2.89, 2.94 A)
 &rst
  ixpk= 470, nxpk= 20, iat= 519, 521, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   88 ARG  HD+          85 GLU  HA          4.40    (#    471:20  Unique         2.71, 4.23 A)
 &rst
  ixpk= 471, nxpk= 20, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 332, 333,
 &end
#
#   88 ARG  HD+          88 ARG  HA          4.40    (#    472:20  Unique         3.40, 4.56 A)
 &rst
  ixpk= 472, nxpk= 20, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 332, 333,
 &end
#
#    0 AMB  20-2:473      0 AMB  20-1:473    2.60    (#    473:20  Double Ambig)
 &rst
  ixpk= 473, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 277, 278, 542, 543, 427,
 igr2= 275, 521,
 &end
#
#   88 ARG  HB+          85 GLU  HA          2.60    (#    474:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 474, nxpk= 20, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 326, 327,
 &end
#
#   92 HIS  HN           88 ARG  HA          4.40    (#    475:20  Unique         3.71, 4.03 A)
 &rst
  ixpk= 475, nxpk= 20, iat= 391, 324, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   89 ARG  HN           88 ARG  HA          4.40    (#    476:20  Unique         3.56, 3.58 A)
 &rst
  ixpk= 476, nxpk= 20, iat= 346, 324, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   89 ARG  HN           85 GLU  HA          6.00    (#    477:20  Unique         3.75, 3.94 A)
 &rst
  ixpk= 477, nxpk= 20, iat= 346, 275, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:478    109 HIS  HA          6.00    (#    478:20  Single Ambig)
 &rst
  ixpk= 478, nxpk= 20, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 670, 723,
 &end
#
#   95 SER  HN           95 SER  HA          4.40    (#    479:20  Unique         2.80, 2.90 A)
 &rst
  ixpk= 479, nxpk= 20, iat= 439, 441, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  113 LEU  HN          109 HIS  HA          4.40    (#    480:20  Unique         3.51, 3.75 A)
 &rst
  ixpk= 480, nxpk= 20, iat= 704, 654, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  108 TYR  HD          109 HIS  HA          4.40    (#    481:20  Unique         3.36, 4.83 A)
 &rst
  ixpk= 481, nxpk= 20, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 639, 648,
 &end
#
#   82 ALA  MB           79 GLN  HA          2.60    (#    482:20  Unique         2.24, 3.39 A)
 &rst
  ixpk= 482, nxpk= 20, iat=  -1, 184, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 224, 225, 226,
 &end
#
#  107 ALA  HN          106 ASP  HA          4.40    (#    483:20  Unique         3.62, 3.63 A)
 &rst
  ixpk= 483, nxpk= 20, iat= 621, 611, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   82 ALA  HN           79 GLN  HA          4.40    (#    484:20  Unique         2.93, 3.26 A)
 &rst
  ixpk= 484, nxpk= 20, iat= 220, 184, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  105 ILE  MG2         106 ASP  HA          4.40    (#    485:20  Unique         3.61, 4.67 A)
 &rst
  ixpk= 485, nxpk= 20, iat=  -1, 611, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 596, 597, 598,
 &end
#
#  106 ASP  HB+         106 ASP  HA          2.60    (#    486:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 486, nxpk= 20, iat=  -1, 611, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 613, 614,
 &end
#
#    0 AMB  20-2:487     70 ARG  HA          3.50    (#    487:20  Single Ambig)
 &rst
  ixpk= 487, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  47,  48,  78,  79,
 &end
#
#  102 ALA  MB          103 ASP  HA          4.40    (#    488:20  Unique         4.45, 5.03 A)
 &rst
  ixpk= 488, nxpk= 20, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 556, 557, 558,
 &end
#
#   71 GLY  HN           70 ARG  HA          4.40    (#    489:20  Unique         2.08, 2.82 A)
 &rst
  ixpk= 489, nxpk= 20, iat=  64,  42, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  107 ALA  HN          103 ASP  HA          6.00    (#    490:20  Unique         3.86, 4.04 A)
 &rst
  ixpk= 490, nxpk= 20, iat= 621, 564, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  106 ASP  HN          103 ASP  HA          4.40    (#    491:20  Unique         3.50, 3.70 A)
 &rst
  ixpk= 491, nxpk= 20, iat= 609, 564, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   99 ARG  HN           99 ARG  HA          4.40    (#    492:20  Unique         2.28, 2.88 A)
 &rst
  ixpk= 492, nxpk= 20, iat= 495, 497, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   99 ARG  HG+          99 ARG  HA          2.60    (#    493:20  Unique         2.40, 2.80 A)
 &rst
  ixpk= 493, nxpk= 20, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 502, 503,
 &end
#
#   90 ASN  HB-          87 ALA  HA          4.40    (#    494:20  Unique         2.67, 3.76 A)
 &rst
  ixpk= 494, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 374, 375,
 &end
#
#  104 VAL  MGX          87 ALA  HA          6.00    (#    495:20  Unique         3.82, 5.69 A)
 &rst
  ixpk= 495, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#   90 ASN  HB+          87 ALA  HA          6.00    (#    496:20  Unique         2.67, 3.76 A)
 &rst
  ixpk= 496, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 374, 375,
 &end
#
#   92 HIS  HB+          87 ALA  HA          6.00    (#    497:20  Unique         2.44, 3.36 A)
 &rst
  ixpk= 497, nxpk= 20, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 395, 396,
 &end
#
#   86 TRP  HZ3          87 ALA  HA          4.40    (#    498:20  Unique         3.23, 3.63 A)
 &rst
  ixpk= 498, nxpk= 20, iat= 305, 314, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   88 ARG  HN           87 ALA  HA          4.40    (#    499:20  Unique         3.57, 3.59 A)
 &rst
  ixpk= 499, nxpk= 20, iat= 322, 314, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   98 GLY  HN           97 ARG  HA          3.50    (#    500:20  Unique         2.29, 3.03 A)
 &rst
  ixpk= 500, nxpk= 20, iat= 488, 466, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 ARG  HD-          81 ALA  HA          6.00    (#    501:20  Unique         2.21, 4.48 A)
 &rst
  ixpk= 501, nxpk= 20, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 259, 260,
 &end
#
#   82 ALA  HN           81 ALA  HA          4.40    (#    502:20  Unique         3.57, 3.60 A)
 &rst
  ixpk= 502, nxpk= 20, iat= 220, 212, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   84 ARG  HN           81 ALA  HA          4.40    (#    503:20  Unique         3.08, 3.46 A)
 &rst
  ixpk= 503, nxpk= 20, iat= 249, 212, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  20-2:504     82 ALA  HA          4.40    (#    504:20  Single Ambig)
 &rst
  ixpk= 504, nxpk= 20, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 288, 249,
 &end
#
#    0 AMB  20-2:505    107 ALA  HA          4.40    (#    505:20  Single Ambig)
 &rst
  ixpk= 505, nxpk= 20, iat=  -1, 623, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 631, 609,
 &end
#
#   90 ASN  HN           87 ALA  HA          4.40    (#    507:20  Unique         3.27, 3.47 A)
 &rst
  ixpk= 507, nxpk= 20, iat= 370, 314, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   91 GLY  HN           90 ASN  HA          4.40    (#    508:20  Unique         3.18, 3.30 A)
 &rst
  ixpk= 508, nxpk= 20, iat= 384, 372, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  20-2:509     90 ASN  HA          4.40    (#    509:20  Single Ambig)
 &rst
  ixpk= 509, nxpk= 20, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 379, 380, 379, 380,
 &end
#
#    0 AMB  20-2:510    111 ALA  HA          6.00    (#    510:20  Single Ambig)
 &rst
  ixpk= 510, nxpk= 20, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 723, 670,
 &end
#
#  114 GLU  HB+         111 ALA  HA          4.40    (#    511:20  Unique         2.99, 4.94 A)
 &rst
  ixpk= 511, nxpk= 20, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 727, 728,
 &end
#
#   72 ARG  HB+          74 ALA  HA          6.00    (#    512:20  Unique         4.41, 6.24 A)
 &rst
  ixpk= 512, nxpk= 20, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  75,  76,
 &end
#
#   92 HIS  HN           91 GLY  HA+         4.40    (#    513:20  Unique         3.04, 3.30 A)
 &rst
  ixpk= 513, nxpk= 20, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 386, 387,
 &end
#
#   92 HIS  HN           91 GLY  HA-         4.40    (#    514:20  Unique         3.04, 3.30 A)
 &rst
  ixpk= 514, nxpk= 20, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 386, 387,
 &end
#
#   97 ARG  HA           98 GLY  HA+         6.00    (#    516:20  Unique         4.29, 4.83 A)
 &rst
  ixpk= 516, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 490, 491,
 &end
#
#    0 AMB  20-2:517      0 AMB  20-1:517    4.40    (#    517:20  Double Ambig)
 &rst
  ixpk= 517, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr1= 499, 500, 468, 469,
 igr2= 490, 491, 490, 491,
 &end
#
#    0 AMB  20-2:518      0 AMB  20-1:518    6.00    (#    518:20  Double Ambig)
 &rst
  ixpk= 518, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 471, 472, 502, 503,
 igr2= 490, 491, 490, 491,
 &end
#
#   84 ARG  HG+          84 ARG  HD-         3.50    (#    519:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 256, 257,
 igr2= 259, 260,
 &end
#
#   84 ARG  HB-          84 ARG  HD-         2.60    (#    520:20  Unique         2.34, 3.15 A)
 &rst
  ixpk= 520, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 253, 254,
 igr2= 259, 260,
 &end
#
#    0 AMB  20-2:521      0 AMB  20-1:521    2.60    (#    521:20  Double Ambig)
 &rst
  ixpk= 521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 147, 148, 253, 254,
 igr2= 153, 154, 332, 333,
 &end
#
#   84 ARG  HE           84 ARG  HD+         4.40    (#    522:20  Unique         2.33, 2.81 A)
 &rst
  ixpk= 522, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 259, 260,
 &end
#
#  114 GLU  HN          113 LEU  HB+         6.00    (#    523:20  Unique         2.43, 3.31 A)
 &rst
  ixpk= 523, nxpk= 20, iat= 723,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 708, 709,
 &end
#
#  114 GLU  HN          113 LEU  HB-         6.00    (#    524:20  Unique         2.43, 3.31 A)
 &rst
  ixpk= 524, nxpk= 20, iat= 723,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 708, 709,
 &end
#
#   84 ARG  HG+          84 ARG  HD-         3.50    (#    526:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 526, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 256, 257,
 igr2= 259, 260,
 &end
#
#   84 ARG  HE           84 ARG  HD-         4.40    (#    527:20  Unique         2.33, 2.81 A)
 &rst
  ixpk= 527, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 259, 260,
 &end
#
#   76 ASP  HN           76 ASP  HB+         4.40    (#    528:20  Unique         2.44, 2.83 A)
 &rst
  ixpk= 528, nxpk= 20, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 135, 136,
 &end
#
#   77 ARG  HN           76 ASP  HB+         4.40    (#    529:20  Unique         2.12, 3.57 A)
 &rst
  ixpk= 529, nxpk= 20, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:530      0 AMB  20-1:530    6.00    (#    530:20  Double Ambig)
 &rst
  ixpk= 530, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 590, 574,
 igr2= 613, 614, 613, 614,
 &end
#
#  103 ASP  HA          103 ASP  HB-         2.60    (#    532:20  Unique         2.34, 2.72 A)
 &rst
  ixpk= 532, nxpk= 20, iat= 564,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 566, 567,
 &end
#
#  104 VAL  HN          103 ASP  HB+         6.00    (#    533:20  Unique         2.60, 3.41 A)
 &rst
  ixpk= 533, nxpk= 20, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 566, 567,
 &end
#
#  104 VAL  HN          103 ASP  HB-         6.00    (#    534:20  Unique         2.60, 3.41 A)
 &rst
  ixpk= 534, nxpk= 20, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 566, 567,
 &end
#
#   75 ILE  HN           75 ILE  HB          3.50    (#    535:20  Unique         2.39, 2.67 A)
 &rst
  ixpk= 535, nxpk= 20, iat= 112, 116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:536     75 ILE  HB          4.40    (#    536:20  Single Ambig)
 &rst
  ixpk= 536, nxpk= 20, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 131, 199,
 &end
#
#   87 ALA  HA           90 ASN  HB-         4.40    (#    537:20  Unique         2.67, 3.76 A)
 &rst
  ixpk= 537, nxpk= 20, iat= 314,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 374, 375,
 &end
#
#   90 ASN  HA           90 ASN  HB-         4.40    (#    538:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 538, nxpk= 20, iat= 372,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 374, 375,
 &end
#
#   93 ASN  HD2+         93 ASN  HB+         6.00    (#    539:20  Unique         2.26, 3.16 A)
 &rst
  ixpk= 539, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 418, 419,
 igr2= 413, 414,
 &end
#
#   93 ASN  HD2+         93 ASN  HB-         6.00    (#    540:20  Unique         2.26, 3.16 A)
 &rst
  ixpk= 540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 418, 419,
 igr2= 413, 414,
 &end
#
#   94 VAL  HN           93 ASN  HB+         6.00    (#    541:20  Unique         2.96, 4.18 A)
 &rst
  ixpk= 541, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 413, 414,
 &end
#
#   94 VAL  HN           93 ASN  HB-         6.00    (#    542:20  Unique         2.96, 4.18 A)
 &rst
  ixpk= 542, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 413, 414,
 &end
#
#  105 ILE  HA          108 TYR  HB+         3.50    (#    543:20  Unique         2.50, 3.19 A)
 &rst
  ixpk= 543, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 635, 636,
 &end
#
#  105 ILE  HA          108 TYR  HB-         4.40    (#    544:20  Unique         2.50, 3.19 A)
 &rst
  ixpk= 544, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 635, 636,
 &end
#
#   83 ILE  MG2         108 TYR  HB+         4.40    (#    545:20  Unique         2.34, 3.79 A)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 236, 237, 238,
 igr2= 635, 636,
 &end
#
#   83 ILE  MG2         108 TYR  HB-         4.40    (#    546:20  Unique         2.34, 3.79 A)
 &rst
  ixpk= 546, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 236, 237, 238,
 igr2= 635, 636,
 &end
#
#    0 AMB  20-2:547      0 AMB  20-1:547    6.00    (#    547:20  Double Ambig)
 &rst
  ixpk= 547, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 596, 597, 598, 532, 533, 534,
 igr2= 635, 636, 635, 636,
 &end
#
#    0 AMB  20-2:548    108 TYR  HB-         6.00    (#    548:20  Single Ambig)
 &rst
  ixpk= 548, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 580, 581, 582, 584, 585, 586, 596, 597, 598,
 igr2= 635, 636,
 &end
#
#   86 TRP  HE3         108 TYR  HB-         6.00    (#    549:20  Unique         2.80, 3.85 A)
 &rst
  ixpk= 549, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 635, 636,
 &end
#
#  105 ILE  HA          105 ILE  HB          4.40    (#    550:20  Unique         3.04, 3.04 A)
 &rst
  ixpk= 550, nxpk= 20, iat= 592, 594, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   83 ILE  HG1+         83 ILE  HB          4.40    (#    551:20  Unique         2.46, 2.81 A)
 &rst
  ixpk= 551, nxpk= 20, iat=  -1, 234, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 240, 241,
 &end
#
#   83 ILE  HA           83 ILE  HB          4.40    (#    552:20  Unique         3.03, 3.04 A)
 &rst
  ixpk= 552, nxpk= 20, iat= 232, 234, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   80 SER  HA           83 ILE  HB          4.40    (#    553:20  Unique         2.53, 2.84 A)
 &rst
  ixpk= 553, nxpk= 20, iat= 201, 234, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   80 SER  HB-          83 ILE  HB          6.00    (#    554:20  Unique         4.35, 5.19 A)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1, 234, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 203, 204,
 &end
#
#    0 AMB  20-2:555      0 AMB  20-1:555    4.40    (#    555:20  Double Ambig)
 &rst
  ixpk= 555, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 725, 706,
 igr2= 730, 731, 730, 731,
 &end
#
#  114 GLU  HA          114 GLU  HG-         4.40    (#    556:20  Unique         2.33, 3.11 A)
 &rst
  ixpk= 556, nxpk= 20, iat= 725,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 730, 731,
 &end
#
#  114 GLU  HN          114 GLU  HG+         4.40    (#    557:20  Unique         2.33, 3.76 A)
 &rst
  ixpk= 557, nxpk= 20, iat= 723,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 730, 731,
 &end
#
#  114 GLU  HN          114 GLU  HG-         6.00    (#    558:20  Unique         2.33, 3.76 A)
 &rst
  ixpk= 558, nxpk= 20, iat= 723,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 730, 731,
 &end
#
#   83 ILE  MD1          79 GLN  HG-         6.00    (#    559:20  Unique         2.68, 6.29 A)
 &rst
  ixpk= 559, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 243, 244, 245,
 igr2= 189, 190,
 &end
#
#   83 ILE  MD1          79 GLN  HG+         6.00    (#    560:20  Unique         2.68, 6.29 A)
 &rst
  ixpk= 560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 243, 244, 245,
 igr2= 189, 190,
 &end
#
#   79 GLN  HE2+         79 GLN  HG+         6.00    (#    561:20  Unique         2.31, 3.31 A)
 &rst
  ixpk= 561, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 194, 195,
 igr2= 189, 190,
 &end
#
#   79 GLN  HE2+         79 GLN  HG-         6.00    (#    562:20  Unique         2.31, 3.31 A)
 &rst
  ixpk= 562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 194, 195,
 igr2= 189, 190,
 &end
#
#   79 GLN  HN           79 GLN  HG+         4.40    (#    563:20  Unique         2.17, 3.01 A)
 &rst
  ixpk= 563, nxpk= 20, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 189, 190,
 &end
#
#   79 GLN  HN           79 GLN  HG-         4.40    (#    564:20  Unique         2.17, 3.01 A)
 &rst
  ixpk= 564, nxpk= 20, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 189, 190,
 &end
#
#   87 ALA  MB           94 VAL  HB          4.40    (#    565:20  Unique         2.41, 3.26 A)
 &rst
  ixpk= 565, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 316, 317, 318,
 &end
#
#   95 SER  HN           94 VAL  HB          6.00    (#    566:20  Unique         2.83, 3.98 A)
 &rst
  ixpk= 566, nxpk= 20, iat= 439, 427, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:567      0 AMB  20-1:567    4.40    (#    567:20  Double Ambig)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 562, 552,
 igr2= 545, 546, 545, 546,
 &end
#
#  104 VAL  HN          101 PRO  HB+         6.00    (#    568:20  Unique         2.51, 3.70 A)
 &rst
  ixpk= 568, nxpk= 20, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 545, 546,
 &end
#
#  104 VAL  HN          101 PRO  HB-         4.40    (#    569:20  Unique         2.51, 3.70 A)
 &rst
  ixpk= 569, nxpk= 20, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 545, 546,
 &end
#
#    0 AMB  20-2:570    101 PRO  HB-         4.40    (#    570:20  Single Ambig)
 &rst
  ixpk= 570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 562, 552,
 igr2= 545, 546,
 &end
#
#  101 PRO  HA          101 PRO  HB-         4.40    (#    571:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 571, nxpk= 20, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 545, 546,
 &end
#
#  101 PRO  HD+         101 PRO  HB-         4.40    (#    572:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 572, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 539, 540,
 igr2= 545, 546,
 &end
#
#  101 PRO  HD+         101 PRO  HB+         6.00    (#    573:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 573, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 539, 540,
 igr2= 545, 546,
 &end
#
#  101 PRO  HD-         101 PRO  HB-         4.40    (#    574:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 539, 540,
 igr2= 545, 546,
 &end
#
#  104 VAL  MGY         101 PRO  HB+         8.00    (#    575:20  Unique         2.24, 5.73 A)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 545, 546,
 &end
#
#  104 VAL  MGY         101 PRO  HB-         3.50    (#    576:20  Unique         2.24, 5.73 A)
 &rst
  ixpk= 576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 545, 546,
 &end
#
#  101 PRO  HD-         101 PRO  HB+         6.00    (#    577:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 577, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 539, 540,
 igr2= 545, 546,
 &end
#
#   97 ARG  HA           97 ARG  HB-         4.40    (#    578:20  Unique         2.36, 2.68 A)
 &rst
  ixpk= 578, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 468, 469,
 &end
#
#   97 ARG  HD+          97 ARG  HB+         4.40    (#    579:20  Unique         2.43, 3.27 A)
 &rst
  ixpk= 579, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 474, 475,
 igr2= 468, 469,
 &end
#
#   97 ARG  HD+          97 ARG  HB-         4.40    (#    580:20  Unique         2.43, 3.27 A)
 &rst
  ixpk= 580, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 474, 475,
 igr2= 468, 469,
 &end
#
#   87 ALA  MB           92 HIS  HB+         4.40    (#    582:20  Unique         2.37, 4.06 A)
 &rst
  ixpk= 582, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 316, 317, 318,
 igr2= 395, 396,
 &end
#
#  104 VAL  MGY          92 HIS  HB-         4.40    (#    583:20  Unique         2.56, 5.02 A)
 &rst
  ixpk= 583, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 395, 396,
 &end
#
#  104 VAL  MGY          92 HIS  HB+         4.40    (#    584:20  Unique         2.56, 5.02 A)
 &rst
  ixpk= 584, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 395, 396,
 &end
#
#   92 HIS  HA           92 HIS  HB-         4.40    (#    585:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 585, nxpk= 20, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 395, 396,
 &end
#
#   87 ALA  HA           92 HIS  HB-         4.40    (#    586:20  Unique         2.44, 3.36 A)
 &rst
  ixpk= 586, nxpk= 20, iat= 314,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 395, 396,
 &end
#
#   87 ALA  HA           92 HIS  HB+         6.00    (#    587:20  Unique         2.44, 3.36 A)
 &rst
  ixpk= 587, nxpk= 20, iat= 314,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 395, 396,
 &end
#
#    0 AMB  20-2:588     92 HIS  HB-         4.40    (#    588:20  Single Ambig)
 &rst
  ixpk= 588, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 405, 379, 380,
 igr2= 395, 396,
 &end
#
#    0 AMB  20-2:589      0 AMB  20-1:589    6.00    (#    589:20  Double Ambig)
 &rst
  ixpk= 589, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 405, 379, 380,
 igr2= 395, 396, 395, 396,
 &end
#
#   92 HIS  HN           92 HIS  HB-         4.40    (#    590:20  Unique         2.36, 2.95 A)
 &rst
  ixpk= 590, nxpk= 20, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 395, 396,
 &end
#
#   92 HIS  HN           92 HIS  HB+         4.40    (#    591:20  Unique         2.36, 2.95 A)
 &rst
  ixpk= 591, nxpk= 20, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 395, 396,
 &end
#
#  104 VAL  HA          104 VAL  HB          3.50    (#    592:20  Unique         2.53, 2.93 A)
 &rst
  ixpk= 592, nxpk= 20, iat= 576, 578, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 PRO  HD+         104 VAL  HB          4.40    (#    593:20  Unique         2.69, 4.13 A)
 &rst
  ixpk= 593, nxpk= 20, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 539, 540,
 &end
#
#  100 ILE  HN           99 ARG  HB+         4.40    (#    594:20  Unique         2.47, 3.51 A)
 &rst
  ixpk= 594, nxpk= 20, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 499, 500,
 &end
#
#    0 AMB  20-2:595     84 ARG  HB-         4.40    (#    595:20  Single Ambig)
 &rst
  ixpk= 595, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 532, 533, 534, 529, 530,
 igr2= 253, 254,
 &end
#
#    0 AMB  20-2:596      0 AMB  20-1:596    4.40    (#    596:20  Double Ambig)
 &rst
  ixpk= 596, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
 igr1= 532, 533, 534, 529, 530,
 igr2= 253, 254, 253, 254,
 &end
#
#   84 ARG  HG+          84 ARG  HB-         2.60    (#    597:20  Unique         2.27, 2.76 A)
 &rst
  ixpk= 597, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 256, 257,
 igr2= 253, 254,
 &end
#
#   84 ARG  HN           84 ARG  HB-         2.60    (#    598:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 598, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 253, 254,
 &end
#
#    0 AMB  20-2:600      0 AMB  20-1:600    4.40    (#    600:20  Double Ambig)
 &rst
  ixpk= 600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 752, 770,
 igr2= 742, 743, 742, 743,
 &end
#
#    0 AMB  20-2:601    115 HIS  HB-         4.40    (#    601:20  Single Ambig)
 &rst
  ixpk= 601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 752, 770,
 igr2= 742, 743,
 &end
#
#   83 ILE  HA           86 TRP  HB+         3.50    (#    602:20  Unique         2.28, 3.02 A)
 &rst
  ixpk= 602, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 292, 293,
 &end
#
#   86 TRP  HA           86 TRP  HB+         2.60    (#    603:20  Unique         2.40, 2.72 A)
 &rst
  ixpk= 603, nxpk= 20, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 292, 293,
 &end
#
#  108 TYR  HD           86 TRP  HB+         4.40    (#    604:20  Unique         2.42, 4.95 A)
 &rst
  ixpk= 604, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 639, 648,
 igr2= 292, 293,
 &end
#
#  108 TYR  HD           86 TRP  HB-         4.40    (#    605:20  Unique         2.42, 4.95 A)
 &rst
  ixpk= 605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 639, 648,
 igr2= 292, 293,
 &end
#
#  108 TYR  HE           86 TRP  HB+         4.40    (#    606:20  Unique         2.53, 5.32 A)
 &rst
  ixpk= 606, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 641, 646,
 igr2= 292, 293,
 &end
#
#  108 TYR  HE           86 TRP  HB-         4.40    (#    607:20  Unique         2.53, 5.32 A)
 &rst
  ixpk= 607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 641, 646,
 igr2= 292, 293,
 &end
#
#   86 TRP  HD1          86 TRP  HB+         6.00    (#    608:20  Unique         2.62, 3.23 A)
 &rst
  ixpk= 608, nxpk= 20, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 292, 293,
 &end
#
#   87 ALA  HN           86 TRP  HB+         4.40    (#    609:20  Unique         2.52, 3.26 A)
 &rst
  ixpk= 609, nxpk= 20, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 292, 293,
 &end
#
#   87 ALA  HN           86 TRP  HB-         4.40    (#    610:20  Unique         2.52, 3.26 A)
 &rst
  ixpk= 610, nxpk= 20, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 292, 293,
 &end
#
#  109 HIS  HD2         109 HIS  HB+         4.40    (#    611:20  Unique         2.59, 3.27 A)
 &rst
  ixpk= 611, nxpk= 20, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 656, 657,
 &end
#
#    0 AMB  20-2:612      0 AMB  20-1:612    6.00    (#    612:20  Double Ambig)
 &rst
  ixpk= 612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.89, r4=10.39,
 igr1= 708, 709, 674, 675, 676,
 igr2= 656, 657, 656, 657,
 &end
#
#  105 ILE  HA          105 ILE  HG1-        4.40    (#    613:20  Unique         2.50, 2.67 A)
 &rst
  ixpk= 613, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 600, 601,
 &end
#
#  105 ILE  HA          105 ILE  HG1+        4.40    (#    614:20  Unique         2.50, 2.67 A)
 &rst
  ixpk= 614, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 600, 601,
 &end
#
#  105 ILE  HN          105 ILE  HG1+        4.40    (#    615:20  Unique         2.42, 3.17 A)
 &rst
  ixpk= 615, nxpk= 20, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 600, 601,
 &end
#
#   83 ILE  MD1         105 ILE  HG1+        4.40    (#    616:20  Unique         2.22, 3.60 A)
 &rst
  ixpk= 616, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 243, 244, 245,
 igr2= 600, 601,
 &end
#
#  104 VAL  MGY         101 PRO  HG-         3.50    (#    617:20  Unique         2.18, 5.27 A)
 &rst
  ixpk= 617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 542, 543,
 &end
#
#  101 PRO  HB+         101 PRO  HG-         2.60    (#    618:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 545, 546,
 igr2= 542, 543,
 &end
#
#  101 PRO  HD-         101 PRO  HG-         4.40    (#    619:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 539, 540,
 igr2= 542, 543,
 &end
#
#  101 PRO  HD+         101 PRO  HG-         2.60    (#    620:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 539, 540,
 igr2= 542, 543,
 &end
#
#  101 PRO  HA          101 PRO  HG+         6.00    (#    621:20  Unique         3.08, 3.69 A)
 &rst
  ixpk= 621, nxpk= 20, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 542, 543,
 &end
#
#  101 PRO  HA          101 PRO  HG-         4.40    (#    622:20  Unique         3.08, 3.69 A)
 &rst
  ixpk= 622, nxpk= 20, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 542, 543,
 &end
#
#  100 ILE  HN          100 ILE  HG1+        6.00    (#    624:20  Unique         2.24, 3.07 A)
 &rst
  ixpk= 624, nxpk= 20, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 529, 530,
 &end
#
#    0 AMB  20-2:625    100 ILE  HG1-        2.60    (#    625:20  Single Ambig)
 &rst
  ixpk= 625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 521, 539, 540,
 igr2= 529, 530,
 &end
#
#   89 ARG  HD+          89 ARG  HG-         2.60    (#    626:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 626, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 356, 357,
 igr2= 353, 354,
 &end
#
#   89 ARG  HN           89 ARG  HG-         6.00    (#    627:20  Unique         2.41, 3.21 A)
 &rst
  ixpk= 627, nxpk= 20, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 353, 354,
 &end
#
#   89 ARG  HN            0 AMB  20-1:628    4.40    (#    628:20  Single Ambig)
 &rst
  ixpk= 628, nxpk= 20, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 353, 354, 329, 330,
 &end
#
#   83 ILE  MD1          83 ILE  HG1+        3.50    (#    631:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 631, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 243, 244, 245,
 igr2= 240, 241,
 &end
#
#   83 ILE  MD1          83 ILE  HG1-        2.60    (#    632:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 632, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 243, 244, 245,
 igr2= 240, 241,
 &end
#
#   83 ILE  HA           83 ILE  HG1-        4.40    (#    634:20  Unique         2.41, 2.69 A)
 &rst
  ixpk= 634, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 240, 241,
 &end
#
#   83 ILE  HA           83 ILE  HG1+        4.40    (#    635:20  Unique         2.41, 2.69 A)
 &rst
  ixpk= 635, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 240, 241,
 &end
#
#   83 ILE  HN           83 ILE  HG1+        6.00    (#    636:20  Unique         2.20, 2.97 A)
 &rst
  ixpk= 636, nxpk= 20, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 240, 241,
 &end
#
#    0 AMB  20-2:637     75 ILE  HG1-        6.00    (#    637:20  Single Ambig)
 &rst
  ixpk= 637, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 112, 102,
 igr2= 122, 123,
 &end
#
#    0 AMB  20-2:638      0 AMB  20-1:638    4.40    (#    638:20  Double Ambig)
 &rst
  ixpk= 638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 112, 102,
 igr2= 122, 123, 122, 123,
 &end
#
#    0 AMB  20-2:639    104 VAL  MGY         6.00    (#    639:20  Single Ambig)
 &rst
  ixpk= 639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 562, 552,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   87 ALA  MB          104 VAL  MGY         4.40    (#    640:20  Unique         2.38, 4.54 A)
 &rst
  ixpk= 640, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 316, 317, 318,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   84 ARG  HA           94 VAL  MGY         6.00    (#    641:20  Unique         2.26, 3.60 A)
 &rst
  ixpk= 641, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   94 VAL  HN           94 VAL  MGY         4.40    (#    642:20  Unique         2.62, 4.19 A)
 &rst
  ixpk= 642, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   95 SER  HN           94 VAL  MGY         4.40    (#    643:20  Unique         2.31, 3.98 A)
 &rst
  ixpk= 643, nxpk= 20, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  20-2:644    104 VAL  MGX         4.40    (#    644:20  Single Ambig)
 &rst
  ixpk= 644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
 igr1= 395, 396, 566, 567, 635, 636,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   92 HIS  HB+         104 VAL  MGX         6.00    (#    645:20  Unique         2.56, 5.02 A)
 &rst
  ixpk= 645, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 395, 396,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  101 PRO  HD+         104 VAL  MGX         4.40    (#    646:20  Unique         2.43, 4.97 A)
 &rst
  ixpk= 646, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 539, 540,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  108 TYR  HD          112 THR  MG2         6.00    (#    647:20  Unique         3.67, 5.11 A)
 &rst
  ixpk= 647, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 639, 648,
 igr2= 696, 697, 698,
 &end
#
#   86 TRP  HH2         111 ALA  MB          4.40    (#    649:20  Unique         3.54, 4.78 A)
 &rst
  ixpk= 649, nxpk= 20, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 684, 685, 686,
 &end
#
#   92 HIS  HD2          87 ALA  MB          8.00    (#    650:20  Unique         3.47, 4.80 A)
 &rst
  ixpk= 650, nxpk= 20, iat= 405,  -1, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr2= 316, 317, 318,
 &end
#
#  108 TYR  HE           82 ALA  MB          4.40    (#    651:20  Unique         3.17, 5.55 A)
 &rst
  ixpk= 651, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 641, 646,
 igr2= 224, 225, 226,
 &end
#
#    0 AMB  20-2:652    100 ILE  MG2         4.40    (#    652:20  Single Ambig)
 &rst
  ixpk= 652, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 519, 552, 562,
 igr2= 525, 526, 527,
 &end
#
#   83 ILE  MG2         100 ILE  MG2         2.60    (#    653:20  Unique         2.32, 3.86 A)
 &rst
  ixpk= 653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 236, 237, 238,
 igr2= 525, 526, 527,
 &end
#
#    0 AMB  20-2:654     75 ILE  MG2         6.00    (#    654:20  Single Ambig)
 &rst
  ixpk= 654, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 171, 172, 186, 187,
 igr2= 118, 119, 120,
 &end
#
#    0 AMB  20-2:655     75 ILE  MG2         4.40    (#    655:20  Single Ambig)
 &rst
  ixpk= 655, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 203, 204, 201,
 igr2= 118, 119, 120,
 &end
#
#    0 AMB  20-2:656     75 ILE  MG2         4.40    (#    656:20  Single Ambig)
 &rst
  ixpk= 656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 112, 102,
 igr2= 118, 119, 120,
 &end
#
#   86 TRP  HE3          83 ILE  MG2         6.00    (#    657:20  Unique         2.99, 4.16 A)
 &rst
  ixpk= 657, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 236, 237, 238,
 &end
#
#  108 TYR  HD           83 ILE  MG2         4.40    (#    658:20  Unique         3.31, 5.20 A)
 &rst
  ixpk= 658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 639, 648,
 igr2= 236, 237, 238,
 &end
#
#   84 ARG  HA           83 ILE  MG2         4.40    (#    659:20  Unique         3.65, 4.80 A)
 &rst
  ixpk= 659, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 236, 237, 238,
 &end
#
#  108 TYR  HB+          83 ILE  MG2         4.40    (#    660:20  Unique         2.34, 3.79 A)
 &rst
  ixpk= 660, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 635, 636,
 igr2= 236, 237, 238,
 &end
#
#   83 ILE  HG1+         83 ILE  MG2         3.50    (#    662:20  Unique         2.41, 3.50 A)
 &rst
  ixpk= 662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 240, 241,
 igr2= 236, 237, 238,
 &end
#
#  108 TYR  HD           83 ILE  MD1         4.40    (#    664:20  Unique         3.06, 5.07 A)
 &rst
  ixpk= 664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 639, 648,
 igr2= 243, 244, 245,
 &end
#
#   83 ILE  MG2          83 ILE  HA          2.60    (#    665:20  Unique         2.54, 3.22 A)
 &rst
  ixpk= 665, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 236, 237, 238,
 &end
#
#   83 ILE  HG1+         83 ILE  HA          3.50    (#    666:20  Unique         2.41, 2.69 A)
 &rst
  ixpk= 666, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 240, 241,
 &end
#
#   97 ARG  HG+          96 THR  HB          6.00    (#    668:20  Unique         2.81, 5.29 A)
 &rst
  ixpk= 668, nxpk= 20, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 471, 472,
 &end
#
#   97 ARG  HN           96 THR  HB          6.00    (#    670:20  Unique         3.14, 3.87 A)
 &rst
  ixpk= 670, nxpk= 20, iat= 464, 454, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   96 THR  HN           96 THR  HB          6.00    (#    671:20  Unique         3.59, 3.64 A)
 &rst
  ixpk= 671, nxpk= 20, iat= 450, 454, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   83 ILE  MG2         105 ILE  HA          3.50    (#    672:20  Unique         2.49, 3.48 A)
 &rst
  ixpk= 672, nxpk= 20, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 236, 237, 238,
 &end
#
#   83 ILE  MD1          80 SER  HB+         6.00    (#    673:20  Unique         4.25, 6.48 A)
 &rst
  ixpk= 673, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 243, 244, 245,
 igr2= 203, 204,
 &end
#
#   83 ILE  MD1          80 SER  HB-         6.00    (#    674:20  Unique         4.25, 6.48 A)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 243, 244, 245,
 igr2= 203, 204,
 &end
#
#   83 ILE  MD1          80 SER  HA          4.40    (#    677:20  Unique         2.33, 4.13 A)
 &rst
  ixpk= 677, nxpk= 20, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 243, 244, 245,
 &end
#
#   85 GLU  HB+          86 TRP  HA          6.00    (#    678:20  Unique         4.24, 5.01 A)
 &rst
  ixpk= 678, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 277, 278,
 &end
#
#    0 AMB  20-2:679     86 TRP  HA          6.00    (#    679:20  Single Ambig)
 &rst
  ixpk= 679, nxpk= 20, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 280, 281, 374, 375,
 &end
#
#   86 TRP  HD1          86 TRP  HA          6.00    (#    680:20  Unique         3.08, 3.19 A)
 &rst
  ixpk= 680, nxpk= 20, iat= 296, 290, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   80 SER  HB-          80 SER  HA          2.60    (#    681:20  Unique         2.30, 2.65 A)
 &rst
  ixpk= 681, nxpk= 20, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 203, 204,
 &end
#
#  100 ILE  HG1-         80 SER  HA          6.00    (#    682:20  Unique         3.50, 4.94 A)
 &rst
  ixpk= 682, nxpk= 20, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 529, 530,
 &end
#
#   83 ILE  MG2          84 ARG  HA          4.40    (#    683:20  Unique         3.65, 4.80 A)
 &rst
  ixpk= 683, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 236, 237, 238,
 &end
#
#   88 ARG  HN           84 ARG  HA          6.00    (#    685:20  Unique         3.82, 3.96 A)
 &rst
  ixpk= 685, nxpk= 20, iat= 322, 251, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  100 ILE  HG1+        100 ILE  HA          2.60    (#    686:20  Unique         2.33, 2.70 A)
 &rst
  ixpk= 686, nxpk= 20, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 529, 530,
 &end
#
#   90 ASN  HN           88 ARG  HA          6.00    (#    687:20  Unique         4.23, 4.34 A)
 &rst
  ixpk= 687, nxpk= 20, iat= 370, 324, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   91 GLY  HN           88 ARG  HA          6.00    (#    688:20  Unique         3.40, 3.56 A)
 &rst
  ixpk= 688, nxpk= 20, iat= 384, 324, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   87 ALA  HN           85 GLU  HA          6.00    (#    689:20  Unique         4.42, 4.55 A)
 &rst
  ixpk= 689, nxpk= 20, iat= 312, 275, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:690     88 ARG  HA          6.00    (#    690:20  Single Ambig)
 &rst
  ixpk= 690, nxpk= 20, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 411, 393,
 &end
#
#   88 ARG  HG+          88 ARG  HA          2.60    (#    691:20  Unique         2.44, 2.81 A)
 &rst
  ixpk= 691, nxpk= 20, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 329, 330,
 &end
#
#   88 ARG  HB+          88 ARG  HA          2.60    (#    692:20  Unique         2.47, 2.78 A)
 &rst
  ixpk= 692, nxpk= 20, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 326, 327,
 &end
#
#   88 ARG  HN           88 ARG  HA          3.50    (#    693:20  Unique         2.83, 2.86 A)
 &rst
  ixpk= 693, nxpk= 20, iat= 322, 324, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 GLU  HB+          78 GLU  HA          2.60    (#    694:20  Unique         2.40, 2.77 A)
 &rst
  ixpk= 694, nxpk= 20, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 171, 172,
 &end
#
#    0 AMB  20-2:695     78 GLU  HA          3.50    (#    695:20  Single Ambig)
 &rst
  ixpk= 695, nxpk= 20, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 174, 175, 189, 190,
 &end
#
#   81 ALA  MB           78 GLU  HA          6.00    (#    696:20  Unique         2.29, 4.33 A)
 &rst
  ixpk= 696, nxpk= 20, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 214, 215, 216,
 &end
#
#    0 AMB  20-2:697     79 GLN  HA          6.00    (#    697:20  Single Ambig)
 &rst
  ixpk= 697, nxpk= 20, iat=  -1, 184, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 230, 210,
 &end
#
#   89 ARG  HD+          89 ARG  HA          4.40    (#    698:20  Unique         2.43, 4.49 A)
 &rst
  ixpk= 698, nxpk= 20, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 356, 357,
 &end
#
#   90 ASN  HN           89 ARG  HA          4.40    (#    699:20  Unique         3.43, 3.52 A)
 &rst
  ixpk= 699, nxpk= 20, iat= 370, 348, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   91 GLY  HN           89 ARG  HA          6.00    (#    700:20  Unique         3.61, 3.94 A)
 &rst
  ixpk= 700, nxpk= 20, iat= 384, 348, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   88 ARG  HN           89 ARG  HA          6.00    (#    701:20  Unique         5.33, 5.49 A)
 &rst
  ixpk= 701, nxpk= 20, iat= 322, 348, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  110 ALA  HN          106 ASP  HA          6.00    (#    704:20  Unique         3.94, 3.98 A)
 &rst
  ixpk= 704, nxpk= 20, iat= 670, 611, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  105 ILE  HB          106 ASP  HA          6.00    (#    705:20  Unique         4.61, 4.69 A)
 &rst
  ixpk= 705, nxpk= 20, iat= 594, 611, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  103 ASP  HB+         103 ASP  HA          2.60    (#    706:20  Unique         2.34, 2.72 A)
 &rst
  ixpk= 706, nxpk= 20, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 566, 567,
 &end
#
#    0 AMB  20-2:707     99 ARG  HA          6.00    (#    707:20  Single Ambig)
 &rst
  ixpk= 707, nxpk= 20, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 529, 530, 532, 533, 534,
 &end
#
#    0 AMB  20-2:708    102 ALA  HA          6.00    (#    708:20  Single Ambig)
 &rst
  ixpk= 708, nxpk= 20, iat=  -1, 554, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 548, 564, 611,
 &end
#
#  106 ASP  HN          102 ALA  HA          6.00    (#    709:20  Unique         3.68, 3.79 A)
 &rst
  ixpk= 709, nxpk= 20, iat= 609, 554, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   92 HIS  HN           87 ALA  HA          6.00    (#    710:20  Unique         3.08, 3.45 A)
 &rst
  ixpk= 710, nxpk= 20, iat= 391, 314, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   89 ARG  HN           87 ALA  HA          6.00    (#    711:20  Unique         4.34, 4.58 A)
 &rst
  ixpk= 711, nxpk= 20, iat= 346, 314, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   85 GLU  HG+          82 ALA  HA          6.00    (#    712:20  Unique         4.01, 5.23 A)
 &rst
  ixpk= 712, nxpk= 20, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 280, 281,
 &end
#
#    0 AMB  20-2:713    110 ALA  HA          4.40    (#    713:20  Single Ambig)
 &rst
  ixpk= 713, nxpk= 20, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 713, 714, 715, 717, 718, 719, 713, 714, 715, 717,
       718, 719,
 &end
#
#  113 LEU  HB+         110 ALA  HA          3.50    (#    714:20  Unique         2.36, 4.04 A)
 &rst
  ixpk= 714, nxpk= 20, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 708, 709,
 &end
#
#  111 ALA  HN          110 ALA  HA          4.40    (#    715:20  Unique         3.59, 3.62 A)
 &rst
  ixpk= 715, nxpk= 20, iat= 680, 672, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  113 LEU  HN          110 ALA  HA          6.00    (#    716:20  Unique         3.22, 3.72 A)
 &rst
  ixpk= 716, nxpk= 20, iat= 704, 672, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   78 GLU  HB+          76 ASP  HA          8.00    (#    717:20  Unique         3.68, 6.44 A)
 &rst
  ixpk= 717, nxpk= 20, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 171, 172,
 &end
#
#  101 PRO  HB+         101 PRO  HD+         6.00    (#    719:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 719, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 545, 546,
 igr2= 539, 540,
 &end
#
#  101 PRO  HB+         101 PRO  HD-         6.00    (#    720:20  Unique         2.80, 3.71 A)
 &rst
  ixpk= 720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 545, 546,
 igr2= 539, 540,
 &end
#
#   72 ARG  HA           72 ARG  HD+         4.40    (#    723:20  Unique         2.19, 4.30 A)
 &rst
  ixpk= 723, nxpk= 20, iat=  73,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=  81,  82,
 &end
#
#    0 AMB  20-2:725      0 AMB  20-1:725    6.00    (#    725:20  Double Ambig)
 &rst
  ixpk= 725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 114, 145,
 igr2= 135, 136, 135, 136,
 &end
#
#    0 AMB  20-2:726     76 ASP  HB-         6.00    (#    726:20  Single Ambig)
 &rst
  ixpk= 726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 114, 145,
 igr2= 135, 136,
 &end
#
#  107 ALA  MB          106 ASP  HB+         6.00    (#    727:20  Unique         4.32, 5.84 A)
 &rst
  ixpk= 727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 625, 626, 627,
 igr2= 613, 614,
 &end
#
#    0 AMB  20-2:728      0 AMB  20-1:728    6.00    (#    728:20  Double Ambig)
 &rst
  ixpk= 728, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 556, 557, 558, 674, 675, 676,
 igr2= 613, 614, 613, 614,
 &end
#
#    0 AMB  20-2:729      0 AMB  20-1:729    6.00    (#    729:20  Double Ambig)
 &rst
  ixpk= 729, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 596, 597, 598, 603, 604, 605,
 igr2= 613, 614, 613, 614,
 &end
#
#   87 ALA  HA           90 ASN  HB+         6.00    (#    730:20  Unique         2.67, 3.76 A)
 &rst
  ixpk= 730, nxpk= 20, iat= 314,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 374, 375,
 &end
#
#    0 AMB  20-2:734      0 AMB  20-1:734    4.40    (#    734:20  Double Ambig)
 &rst
  ixpk= 734, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr1= 379, 380, 379, 380,
 igr2= 350, 351, 350, 351,
 &end
#
#   85 GLU  HN           84 ARG  HB-         4.40    (#    735:20  Unique         2.34, 3.14 A)
 &rst
  ixpk= 735, nxpk= 20, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 253, 254,
 &end
#
#  105 ILE  HB          105 ILE  HG1+        4.40    (#    739:20  Unique         2.71, 2.88 A)
 &rst
  ixpk= 739, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 600, 601,
 &end
#
#    0 AMB  20-2:740      0 AMB  20-1:740    4.40    (#    740:20  Double Ambig)
 &rst
  ixpk= 740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 521, 539, 540,
 igr2= 529, 530, 529, 530,
 &end
#
#   88 ARG  HB+          88 ARG  HG-         2.60    (#    744:20  Unique         2.28, 2.76 A)
 &rst
  ixpk= 744, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 326, 327,
 igr2= 329, 330,
 &end
#
#    0 AMB  20-2:745      0 AMB  20-1:745    2.60    (#    745:20  Double Ambig)
 &rst
  ixpk= 745, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 326, 327, 326, 327,
 igr2= 329, 330, 353, 354,
 &end
#
#   88 ARG  HN           88 ARG  HG-         4.40    (#    746:20  Unique         2.45, 4.27 A)
 &rst
  ixpk= 746, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 329, 330,
 &end
#
#   88 ARG  HN           88 ARG  HG+         4.40    (#    747:20  Unique         2.45, 4.27 A)
 &rst
  ixpk= 747, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 329, 330,
 &end
#
#   88 ARG  HD+          88 ARG  HG-         2.60    (#    749:20  Unique         2.34, 2.68 A)
 &rst
  ixpk= 749, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 332, 333,
 igr2= 329, 330,
 &end
#
#   75 ILE  HA           75 ILE  HG1-        6.00    (#    750:20  Unique         2.31, 3.06 A)
 &rst
  ixpk= 750, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 122, 123,
 &end
#
#   75 ILE  HA           75 ILE  HG1+        6.00    (#    751:20  Unique         2.31, 3.06 A)
 &rst
  ixpk= 751, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 122, 123,
 &end
#
#   75 ILE  HB           75 ILE  HG1+        4.40    (#    752:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 752, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 122, 123,
 &end
#
#  101 PRO  HG+         104 VAL  MGY         2.60    (#    753:20  Unique         2.18, 5.27 A)
 &rst
  ixpk= 753, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 542, 543,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#  101 PRO  HB+         104 VAL  MGY         4.40    (#    754:20  Unique         2.24, 5.73 A)
 &rst
  ixpk= 754, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 545, 546,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  20-2:755    104 VAL  MGY         4.40    (#    755:20  Single Ambig)
 &rst
  ixpk= 755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 395, 396, 566, 567,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#   96 THR  HN           96 THR  MG2         6.00    (#    756:20  Unique         2.38, 3.37 A)
 &rst
  ixpk= 756, nxpk= 20, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 456, 457, 458,
 &end
#
#   95 SER  HA           96 THR  MG2         6.00    (#    757:20  Unique         3.68, 4.94 A)
 &rst
  ixpk= 757, nxpk= 20, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 456, 457, 458,
 &end
#
#   86 TRP  HH2         104 VAL  MGX         6.00    (#    758:20  Unique         4.32, 6.41 A)
 &rst
  ixpk= 758, nxpk= 20, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  20-2:759    104 VAL  MGX         3.50    (#    759:20  Single Ambig)
 &rst
  ixpk= 759, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 574, 590,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  20-2:760    104 VAL  MGX         6.00    (#    760:20  Single Ambig)
 &rst
  ixpk= 760, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 631, 609,
 igr2= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  20-2:761     94 VAL  MGX         6.00    (#    761:20  Single Ambig)
 &rst
  ixpk= 761, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 411, 393,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   95 SER  HN           94 VAL  MGX         6.00    (#    762:20  Unique         2.31, 3.98 A)
 &rst
  ixpk= 762, nxpk= 20, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#  112 THR  HA          112 THR  MG2         2.60    (#    763:20  Unique         2.44, 3.09 A)
 &rst
  ixpk= 763, nxpk= 20, iat= 692,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 696, 697, 698,
 &end
#
#    0 AMB  20-2:766    111 ALA  MB          4.40    (#    766:20  Single Ambig)
 &rst
  ixpk= 766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 670, 723,
 igr2= 684, 685, 686,
 &end
#
#  106 ASP  HN          102 ALA  MB          6.00    (#    767:20  Unique         4.38, 5.21 A)
 &rst
  ixpk= 767, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 556, 557, 558,
 &end
#
#   83 ILE  MG2          87 ALA  MB          4.40    (#    768:20  Unique         3.52, 5.23 A)
 &rst
  ixpk= 768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 236, 237, 238,
 igr2= 316, 317, 318,
 &end
#
#  106 ASP  HB+         107 ALA  MB          4.40    (#    769:20  Unique         4.32, 5.84 A)
 &rst
  ixpk= 769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 613, 614,
 igr2= 625, 626, 627,
 &end
#
#  104 VAL  HB          107 ALA  MB          4.40    (#    770:20  Unique         4.61, 5.68 A)
 &rst
  ixpk= 770, nxpk= 20, iat= 578,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 625, 626, 627,
 &end
#
#  108 TYR  HA          107 ALA  MB          6.00    (#    771:20  Unique         4.45, 5.02 A)
 &rst
  ixpk= 771, nxpk= 20, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 625, 626, 627,
 &end
#
#  104 VAL  MGY         107 ALA  MB          4.40    (#    772:20  Unique         3.06, 5.41 A)
 &rst
  ixpk= 772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 625, 626, 627,
 &end
#
#   92 HIS  HE1         107 ALA  MB          6.00    (#    773:20  Unique         3.62, 6.07 A)
 &rst
  ixpk= 773, nxpk= 20, iat= 401,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 625, 626, 627,
 &end
#
#  111 ALA  HN          107 ALA  MB          6.00    (#    774:20  Unique         5.01, 5.84 A)
 &rst
  ixpk= 774, nxpk= 20, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 625, 626, 627,
 &end
#
#    0 AMB  20-2:775     83 ILE  MG2         6.00    (#    775:20  Single Ambig)
 &rst
  ixpk= 775, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 292, 293, 576, 314,
 igr2= 236, 237, 238,
 &end
#
#    0 AMB  20-2:776     83 ILE  MG2         6.00    (#    776:20  Single Ambig)
 &rst
  ixpk= 776, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 201, 203, 204,
 igr2= 236, 237, 238,
 &end
#
#    0 AMB  20-2:777    100 ILE  MG2         6.00    (#    777:20  Single Ambig)
 &rst
  ixpk= 777, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 554, 201, 203, 204,
 igr2= 525, 526, 527,
 &end
#
#  102 ALA  HA          105 ILE  MG2         4.40    (#    778:20  Unique         4.01, 4.53 A)
 &rst
  ixpk= 778, nxpk= 20, iat= 554,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 596, 597, 598,
 &end
#
#  109 HIS  HB+         105 ILE  MG2         6.00    (#    779:20  Unique         4.27, 6.02 A)
 &rst
  ixpk= 779, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 656, 657,
 igr2= 596, 597, 598,
 &end
#
#    0 AMB  20-2:780    105 ILE  MG2         4.40    (#    780:20  Single Ambig)
 &rst
  ixpk= 780, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 590, 574,
 igr2= 596, 597, 598,
 &end
#
#  108 TYR  HN           83 ILE  MG2         6.00    (#    781:20  Unique         3.90, 5.04 A)
 &rst
  ixpk= 781, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 236, 237, 238,
 &end
#
#   87 ALA  HN           83 ILE  MG2         6.00    (#    782:20  Unique         4.23, 5.01 A)
 &rst
  ixpk= 782, nxpk= 20, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 236, 237, 238,
 &end
#
#  108 TYR  HE           83 ILE  MG2         6.00    (#    783:20  Unique         4.94, 6.60 A)
 &rst
  ixpk= 783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 641, 646,
 igr2= 236, 237, 238,
 &end
#
#  108 TYR  HD          105 ILE  MG2         6.00    (#    784:20  Unique         3.48, 6.74 A)
 &rst
  ixpk= 784, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 639, 648,
 igr2= 596, 597, 598,
 &end
#
#   83 ILE  HB          100 ILE  MD1         3.50    (#    785:20  Unique         2.41, 3.13 A)
 &rst
  ixpk= 785, nxpk= 20, iat= 234,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 532, 533, 534,
 &end
#
#  108 TYR  HE           83 ILE  MD1         6.00    (#    786:20  Unique         3.26, 5.57 A)
 &rst
  ixpk= 786, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 641, 646,
 igr2= 243, 244, 245,
 &end
#
#    0 AMB  20-2:787     83 ILE  MD1         4.40    (#    787:20  Single Ambig)
 &rst
  ixpk= 787, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 230, 210,
 igr2= 243, 244, 245,
 &end
#
#   83 ILE  HA           83 ILE  MD1         6.00    (#    788:20  Unique         4.39, 4.65 A)
 &rst
  ixpk= 788, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 243, 244, 245,
 &end
#
#  105 ILE  HA           83 ILE  MD1         6.00    (#    789:20  Unique         2.36, 3.76 A)
 &rst
  ixpk= 789, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 243, 244, 245,
 &end
#
#   79 GLN  HG-          83 ILE  MD1         8.00    (#    790:20  Unique         2.68, 6.29 A)
 &rst
  ixpk= 790, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 189, 190,
 igr2= 243, 244, 245,
 &end
#
#  108 TYR  HD          108 TYR  HE          3.50    (#    791:20  Unique         2.48, 3.74 A)
 &rst
  ixpk= 791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 639, 648,
 igr2= 641, 646,
 &end
#
#   86 TRP  HB-         108 TYR  HE          6.00    (#    792:20  Unique         2.53, 5.32 A)
 &rst
  ixpk= 792, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 292, 293,
 igr2= 641, 646,
 &end
#
#   86 TRP  HB+         108 TYR  HE          6.00    (#    793:20  Unique         2.53, 5.32 A)
 &rst
  ixpk= 793, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 292, 293,
 igr2= 641, 646,
 &end
#
#  112 THR  MG2         108 TYR  HE          6.00    (#    795:20  Unique         3.17, 4.51 A)
 &rst
  ixpk= 795, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 696, 697, 698,
 igr2= 641, 646,
 &end
#
#   86 TRP  HH2          86 TRP  HZ2         3.50    (#    796:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 796, nxpk= 20, iat= 303, 301, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HE1          86 TRP  HZ2         4.40    (#    797:20  Unique         2.88, 2.89 A)
 &rst
  ixpk= 797, nxpk= 20, iat= 298, 301, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  111 ALA  MB           86 TRP  HZ2         4.40    (#    798:20  Unique         2.26, 2.96 A)
 &rst
  ixpk= 798, nxpk= 20, iat=  -1, 301, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 684, 685, 686,
 &end
#
#   77 ARG  HB+          76 ASP  HA          6.00    (#    800:20  Unique         4.17, 5.60 A)
 &rst
  ixpk= 800, nxpk= 20, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 147, 148,
 &end
#
#   75 ILE  MG2          76 ASP  HA          6.00    (#    801:20  Unique         3.71, 5.02 A)
 &rst
  ixpk= 801, nxpk= 20, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 118, 119, 120,
 &end
#
#   66 SER  HB+          66 SER  HA          4.40    (#    802:20  Unique         2.38, 2.70 A)
 &rst
  ixpk= 802, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=   8,   9,
 &end
#
#   94 VAL  HA           95 SER  HB-         4.40    (#    805:20  Unique         4.42, 4.87 A)
 &rst
  ixpk= 805, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 443, 444,
 &end
#
#    0 AMB  20-2:807     77 ARG  HA          3.50    (#    807:20  Single Ambig)
 &rst
  ixpk= 807, nxpk= 20, iat=  -1, 145, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 143, 167,
 &end
#
#   79 GLN  HG-          77 ARG  HA          6.00    (#    808:20  Unique         3.70, 5.96 A)
 &rst
  ixpk= 808, nxpk= 20, iat=  -1, 145, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 189, 190,
 &end
#
#    0 AMB  20-2:814      0 AMB  20-1:814    6.00    (#    814:20  Double Ambig)
 &rst
  ixpk= 814, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 143, 167,
 igr2= 150, 151, 150, 151,
 &end
#
#    0 AMB  20-2:815      0 AMB  20-1:815    2.60    (#    815:20  Double Ambig)
 &rst
  ixpk= 815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 145, 324,
 igr2= 150, 151, 329, 330,
 &end
#
#    0 AMB  20-2:816      0 AMB  20-1:816    2.60    (#    816:20  Double Ambig)
 &rst
  ixpk= 816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 332, 333, 153, 154,
 igr2= 329, 330, 150, 151,
 &end
#
#   78 GLU  HN           78 GLU  HA          3.50    (#    817:20  Unique         2.63, 2.82 A)
 &rst
  ixpk= 817, nxpk= 20, iat= 167, 169, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:818      0 AMB  20-1:818    3.50    (#    818:20  Double Ambig)
 &rst
  ixpk= 818, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 131, 199,
 igr2= 171, 172, 171, 172,
 &end
#
#    0 AMB  20-2:819      0 AMB  20-1:819    4.40    (#    819:20  Double Ambig)
 &rst
  ixpk= 819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
 igr1= 214, 215, 216, 224, 225, 226,
 igr2= 171, 172, 277, 278, 171, 172,
 &end
#
#   75 ILE  MG2          78 GLU  HB+         4.40    (#    820:20  Unique         2.25, 4.38 A)
 &rst
  ixpk= 820, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 118, 119, 120,
 igr2= 171, 172,
 &end
#
#   79 GLN  HN           79 GLN  HB+         2.60    (#    822:20  Unique         2.36, 3.03 A)
 &rst
  ixpk= 822, nxpk= 20, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 186, 187,
 &end
#
#   80 SER  HN           79 GLN  HB+         3.50    (#    823:20  Unique         2.60, 3.56 A)
 &rst
  ixpk= 823, nxpk= 20, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 186, 187,
 &end
#
#   79 GLN  HG+          79 GLN  HB+         2.60    (#    825:20  Unique         2.36, 2.72 A)
 &rst
  ixpk= 825, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 189, 190,
 igr2= 186, 187,
 &end
#
#   79 GLN  HG-          79 GLN  HB+         2.60    (#    826:20  Unique         2.36, 2.72 A)
 &rst
  ixpk= 826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 189, 190,
 igr2= 186, 187,
 &end
#
#   81 ALA  HA           81 ALA  MB          2.60    (#    827:20  Unique         2.43, 2.66 A)
 &rst
  ixpk= 827, nxpk= 20, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 214, 215, 216,
 &end
#
#  107 ALA  MB          107 ALA  HA          2.60    (#    828:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 828, nxpk= 20, iat=  -1, 623, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr1= 625, 626, 627,
 &end
#
#  117 HIS  HB-         114 GLU  HB+         3.50    (#    829:20  Unique         2.42, 4.61 A)
 &rst
  ixpk= 829, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 778, 779,
 igr2= 727, 728,
 &end
#
#  117 HIS  HB+         114 GLU  HB+         4.40    (#    831:20  Unique         2.42, 4.61 A)
 &rst
  ixpk= 831, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 778, 779,
 igr2= 727, 728,
 &end
#
#   97 ARG  HN           97 ARG  HG+         6.00    (#    833:20  Unique         2.33, 3.71 A)
 &rst
  ixpk= 833, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 471, 472,
 &end
#
#    0 AMB  20-2:834      0 AMB  20-1:834    2.60    (#    834:20  Double Ambig)
 &rst
  ixpk= 834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 273, 210,
 igr2= 277, 278, 171, 172,
 &end
#
#    0 AMB  20-2:835      0 AMB  20-1:835    2.60    (#    835:20  Double Ambig)
 &rst
  ixpk= 835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 280, 281, 189, 190,
 igr2= 277, 278, 171, 172,
 &end
#
#   89 ARG  HD+          89 ARG  HG+         2.60    (#    836:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 356, 357,
 igr2= 353, 354,
 &end
#
#   96 THR  MG2          95 SER  HA          6.00    (#    838:20  Unique         3.68, 4.94 A)
 &rst
  ixpk= 838, nxpk= 20, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 456, 457, 458,
 &end
#
#   96 THR  HN           96 THR  HA          6.00    (#    839:20  Unique         2.24, 2.89 A)
 &rst
  ixpk= 839, nxpk= 20, iat= 450, 452, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   97 ARG  HN           97 ARG  HA          4.40    (#    840:20  Unique         2.88, 2.99 A)
 &rst
  ixpk= 840, nxpk= 20, iat= 464, 466, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   97 ARG  HG+          97 ARG  HB+         2.60    (#    841:20  Unique         2.24, 2.71 A)
 &rst
  ixpk= 841, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 471, 472,
 igr2= 468, 469,
 &end
#
#   97 ARG  HG+          97 ARG  HB-         2.60    (#    842:20  Unique         2.24, 2.71 A)
 &rst
  ixpk= 842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 471, 472,
 igr2= 468, 469,
 &end
#
#   97 ARG  HA           97 ARG  HG+         3.50    (#    843:20  Unique         2.47, 3.32 A)
 &rst
  ixpk= 843, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 471, 472,
 &end
#
#   99 ARG  HN           99 ARG  HG+         4.40    (#    844:20  Unique         2.36, 3.53 A)
 &rst
  ixpk= 844, nxpk= 20, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 502, 503,
 &end
#
#   97 ARG  HB+          97 ARG  HG+         2.60    (#    845:20  Unique         2.24, 2.71 A)
 &rst
  ixpk= 845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 468, 469,
 igr2= 471, 472,
 &end
#
#    0 AMB  20-2:846      0 AMB  20-1:846    2.60    (#    846:20  Double Ambig)
 &rst
  ixpk= 846, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 505, 506, 474, 475,
 igr2= 502, 503, 471, 472,
 &end
#
#   99 ARG  HD+          99 ARG  HA          6.00    (#    847:20  Unique         3.82, 4.51 A)
 &rst
  ixpk= 847, nxpk= 20, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 505, 506,
 &end
#
#   99 ARG  HG+          99 ARG  HB+         2.60    (#    848:20  Unique         2.35, 2.76 A)
 &rst
  ixpk= 848, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 502, 503,
 igr2= 499, 500,
 &end
#
#  100 ILE  HN           99 ARG  HG+         6.00    (#    849:20  Unique         2.60, 4.03 A)
 &rst
  ixpk= 849, nxpk= 20, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 502, 503,
 &end
#
#   99 ARG  HN           99 ARG  HG+         4.40    (#    850:20  Unique         2.36, 3.53 A)
 &rst
  ixpk= 850, nxpk= 20, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 502, 503,
 &end
#
#   97 ARG  HN           97 ARG  HG+         6.00    (#    851:20  Unique         2.33, 3.71 A)
 &rst
  ixpk= 851, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 471, 472,
 &end
#
#   99 ARG  HA           99 ARG  HG+         3.50    (#    852:20  Unique         2.40, 2.80 A)
 &rst
  ixpk= 852, nxpk= 20, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 502, 503,
 &end
#
#    0 AMB  20-2:853      0 AMB  20-1:853    2.60    (#    853:20  Double Ambig)
 &rst
  ixpk= 853, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 505, 506, 474, 475,
 igr2= 502, 503, 471, 472,
 &end
#
#  100 ILE  HN          100 ILE  MD1         4.40    (#    855:20  Unique         4.08, 4.72 A)
 &rst
  ixpk= 855, nxpk= 20, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 532, 533, 534,
 &end
#
#    0 AMB  20-2:858    105 ILE  MD1         6.00    (#    858:20  Single Ambig)
 &rst
  ixpk= 858, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 590, 574,
 igr2= 603, 604, 605,
 &end
#
#  105 ILE  HA          105 ILE  MD1         4.40    (#    859:20  Unique         4.42, 4.61 A)
 &rst
  ixpk= 859, nxpk= 20, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 603, 604, 605,
 &end
#
#  105 ILE  HB          105 ILE  MD1         3.50    (#    860:20  Unique         2.48, 2.96 A)
 &rst
  ixpk= 860, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 603, 604, 605,
 &end
#
#    0 AMB  20-2:861    105 ILE  MD1         6.00    (#    861:20  Single Ambig)
 &rst
  ixpk= 861, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 519, 552, 562,
 igr2= 603, 604, 605,
 &end
#
#    0 AMB  20-2:862      0 AMB  20-1:862    3.50    (#    862:20  Double Ambig)
 &rst
  ixpk= 862, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 554,  97,  98,
 igr2= 603, 604, 605, 125, 126, 127,
 &end
#
#  110 ALA  HN          107 ALA  HA          3.50    (#    863:20  Unique         3.40, 3.51 A)
 &rst
  ixpk= 863, nxpk= 20, iat= 670, 623, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 VAL  MGX         107 ALA  MB          4.40    (#    864:20  Unique         3.06, 5.41 A)
 &rst
  ixpk= 864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 580, 581, 582, 584, 585, 586,
 igr2= 625, 626, 627,
 &end
#
#  108 TYR  HA          108 TYR  HB+         2.60    (#    865:20  Unique         2.34, 2.71 A)
 &rst
  ixpk= 865, nxpk= 20, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 635, 636,
 &end
#
#  108 TYR  HA          108 TYR  HB-         2.60    (#    866:20  Unique         2.34, 2.71 A)
 &rst
  ixpk= 866, nxpk= 20, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 635, 636,
 &end
#
#  117 HIS  HN          116 HIS  HB+         4.40    (#    867:20  Unique         2.85, 4.24 A)
 &rst
  ixpk= 867, nxpk= 20, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 760, 761,
 &end
#
#  116 HIS  HA          116 HIS  HB+         3.50    (#    868:20  Unique         2.36, 2.66 A)
 &rst
  ixpk= 868, nxpk= 20, iat= 758,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 760, 761,
 &end
#
#  113 LEU  HB-         113 LEU  HA          2.60    (#    869:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 869, nxpk= 20, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 708, 709,
 &end
#
#  113 LEU  HA          113 LEU  MDX         4.40    (#    870:20  Unique         2.25, 3.87 A)
 &rst
  ixpk= 870, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  109 HIS  HB+         113 LEU  MDX         6.00    (#    871:20  Unique         2.51, 6.25 A)
 &rst
  ixpk= 871, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 656, 657,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  HB-         113 LEU  MDX         4.40    (#    872:20  Unique         2.42, 3.32 A)
 &rst
  ixpk= 872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 708, 709,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  HA          113 LEU  MDY         3.50    (#    873:20  Unique         2.25, 3.87 A)
 &rst
  ixpk= 873, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  HB-         113 LEU  MDY         3.50    (#    874:20  Unique         2.42, 3.32 A)
 &rst
  ixpk= 874, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 708, 709,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  HG          113 LEU  MDY         3.50    (#    875:20  Unique         2.45, 2.66 A)
 &rst
  ixpk= 875, nxpk= 20, iat= 711,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  HB+         113 LEU  MDY         4.40    (#    876:20  Unique         2.42, 3.32 A)
 &rst
  ixpk= 876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 708, 709,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#    0 AMB  20-2:877    113 LEU  MDY         6.00    (#    877:20  Single Ambig)
 &rst
  ixpk= 877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 723, 670,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  HN          113 LEU  MDY         6.00    (#    878:20  Unique         3.59, 4.93 A)
 &rst
  ixpk= 878, nxpk= 20, iat= 704,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 713, 714, 715, 717, 718, 719,
 &end
#
#  113 LEU  MDX         114 GLU  HB+         6.00    (#    880:20  Unique         4.74, 7.63 A)
 &rst
  ixpk= 880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 713, 714, 715, 717, 718, 719,
 igr2= 727, 728,
 &end
#
#   70 ARG  HN           70 ARG  HA          6.00    (#    882:20  Unique         2.27, 2.80 A)
 &rst
  ixpk= 882, nxpk= 20, iat=  40,  42, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:883     70 ARG  HA          4.40    (#    883:20  Single Ambig)
 &rst
  ixpk= 883, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1=  66,  67,  35,  36,
 &end
#
#   70 ARG  HA            0 AMB  20-1:884    3.50    (#    884:20  Single Ambig)
 &rst
  ixpk= 884, nxpk= 20, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=  44,  45,  75,  76,
 &end
#
#   70 ARG  HA            0 AMB  20-1:885    3.50    (#    885:20  Single Ambig)
 &rst
  ixpk= 885, nxpk= 20, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=  44,  45,  75,  76,
 &end
#
#    0 AMB  20-2:886      0 AMB  20-1:886    2.60    (#    886:20  Double Ambig)
 &rst
  ixpk= 886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  78,  79,  47,  48,  78,  79,
 igr2=  75,  76,  44,  45,  44,  45,
 &end
#
#    0 AMB  20-2:889     77 ARG  HG-         6.00    (#    889:20  Single Ambig)
 &rst
  ixpk= 889, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 143, 167,
 igr2= 150, 151,
 &end
#
#   70 ARG  HA            0 AMB  20-1:890    4.40    (#    890:20  Single Ambig)
 &rst
  ixpk= 890, nxpk= 20, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2=  47,  48,  78,  79,
 &end
#
#   77 ARG  HA           77 ARG  HG-         3.50    (#    891:20  Unique         2.43, 3.12 A)
 &rst
  ixpk= 891, nxpk= 20, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 150, 151,
 &end
#
#    0 AMB  20-2:892      0 AMB  20-1:892    2.60    (#    892:20  Double Ambig)
 &rst
  ixpk= 892, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1=  81,  82,  50,  51,
 igr2=  78,  79,  47,  48,
 &end
#
#  108 TYR  HB-         108 TYR  HA          2.60    (#    896:20  Unique         2.34, 2.71 A)
 &rst
  ixpk= 896, nxpk= 20, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 635, 636,
 &end
#
#   94 VAL  MGY          94 VAL  HB          3.50    (#    898:20  Unique         2.36, 2.64 A)
 &rst
  ixpk= 898, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#  115 HIS  HD2         115 HIS  HA          6.00    (#    899:20  Unique         2.41, 3.81 A)
 &rst
  ixpk= 899, nxpk= 20, iat= 752, 740, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  115 HIS  HB+         115 HIS  HA          2.60    (#    900:20  Unique         2.21, 2.74 A)
 &rst
  ixpk= 900, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 742, 743,
 &end
#
#  115 HIS  HB-         115 HIS  HA          2.60    (#    901:20  Unique         2.21, 2.74 A)
 &rst
  ixpk= 901, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 742, 743,
 &end
#
#   84 ARG  HA           84 ARG  HG+         4.40    (#    902:20  Unique         2.41, 2.85 A)
 &rst
  ixpk= 902, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 256, 257,
 &end
#
#   84 ARG  HD+          84 ARG  HG+         4.40    (#    903:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 903, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 259, 260,
 igr2= 256, 257,
 &end
#
#   84 ARG  HD-          84 ARG  HG+         6.00    (#    904:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 904, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 259, 260,
 igr2= 256, 257,
 &end
#
#   84 ARG  HN           84 ARG  HG+         6.00    (#    905:20  Unique         2.19, 4.17 A)
 &rst
  ixpk= 905, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 256, 257,
 &end
#
#   84 ARG  HB+          84 ARG  HG+         2.60    (#    906:20  Unique         2.27, 2.76 A)
 &rst
  ixpk= 906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1= 253, 254,
 igr2= 256, 257,
 &end
#
#  112 THR  MG2         111 ALA  MB          4.40    (#    909:20  Unique         3.06, 5.17 A)
 &rst
  ixpk= 909, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 696, 697, 698,
 igr2= 684, 685, 686,
 &end
#
#   97 ARG  HN           95 SER  HB+         6.00    (#    910:20  Unique         2.81, 3.98 A)
 &rst
  ixpk= 910, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 443, 444,
 &end
#
#   84 ARG  HA           84 ARG  HB-         3.50    (#    911:20  Unique         2.33, 2.79 A)
 &rst
  ixpk= 911, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 253, 254,
 &end
#
#   84 ARG  HD+          84 ARG  HB-         3.50    (#    912:20  Unique         2.34, 3.15 A)
 &rst
  ixpk= 912, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 259, 260,
 igr2= 253, 254,
 &end
#
#   84 ARG  HD-          84 ARG  HB-         3.50    (#    913:20  Unique         2.34, 3.15 A)
 &rst
  ixpk= 913, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 259, 260,
 igr2= 253, 254,
 &end
#
#  108 TYR  HE          108 TYR  HB+         6.00    (#    914:20  Unique         4.67, 5.09 A)
 &rst
  ixpk= 914, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 641, 646,
 igr2= 635, 636,
 &end
#
#  108 TYR  HE          108 TYR  HB-         6.00    (#    915:20  Unique         4.67, 5.09 A)
 &rst
  ixpk= 915, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 641, 646,
 igr2= 635, 636,
 &end
#
#  105 ILE  HB          102 ALA  MB          3.50    (#    916:20  Unique         3.83, 4.47 A)
 &rst
  ixpk= 916, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 556, 557, 558,
 &end
#
#   86 TRP  HE3          86 TRP  HB-         3.50    (#    917:20  Unique         2.60, 3.40 A)
 &rst
  ixpk= 917, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 292, 293,
 &end
#
#   86 TRP  HE3          86 TRP  HB+         3.50    (#    918:20  Unique         2.60, 3.40 A)
 &rst
  ixpk= 918, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 292, 293,
 &end
#
#   84 ARG  HN           87 ALA  MB          6.00    (#    920:20  Unique         5.00, 5.81 A)
 &rst
  ixpk= 920, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 316, 317, 318,
 &end
#
#   84 ARG  HN            0 AMB  20-1:921    4.40    (#    921:20  Single Ambig)
 &rst
  ixpk= 921, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 224, 225, 226, 214, 215, 216,
 &end
#
#    0 AMB  20-2:922      0 AMB  20-1:922    4.40    (#    922:20  Double Ambig)
 &rst
  ixpk= 922, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 189, 190, 280, 281,
 igr2= 224, 225, 226, 214, 215, 216,
 &end
#
#   80 SER  HN            0 AMB  20-1:923    6.00    (#    923:20  Single Ambig)
 &rst
  ixpk= 923, nxpk= 20, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 214, 215, 216, 224, 225, 226,
 &end
#
#  102 ALA  HA          103 ASP  HA          6.00    (#    924:20  Unique         4.77, 4.86 A)
 &rst
  ixpk= 924, nxpk= 20, iat= 554, 564, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  104 VAL  HA          103 ASP  HA          6.00    (#    925:20  Unique         4.66, 4.74 A)
 &rst
  ixpk= 925, nxpk= 20, iat= 576, 564, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  101 PRO  HD+          95 SER  HB-         4.40    (#    926:20  Unique         2.27, 5.09 A)
 &rst
  ixpk= 926, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 539, 540,
 igr2= 443, 444,
 &end
#
#   86 TRP  HN           85 GLU  HG+         4.40    (#    927:20  Unique         3.52, 4.49 A)
 &rst
  ixpk= 927, nxpk= 20, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 280, 281,
 &end
#
#   94 VAL  MGY          94 VAL  HA          3.50    (#    928:20  Unique         2.31, 3.52 A)
 &rst
  ixpk= 928, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#   95 SER  HB-          94 VAL  HA          4.40    (#    929:20  Unique         4.42, 4.87 A)
 &rst
  ixpk= 929, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 443, 444,
 &end
#
#    0 AMB  20-2:930     94 VAL  HA          4.40    (#    930:20  Single Ambig)
 &rst
  ixpk= 930, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 443, 444, 324,
 &end
#
#   95 SER  HA           94 VAL  HA          4.40    (#    931:20  Unique         4.27, 4.40 A)
 &rst
  ixpk= 931, nxpk= 20, iat= 441, 425, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   84 ARG  HA           94 VAL  HA          6.00    (#    932:20  Unique         5.74, 5.90 A)
 &rst
  ixpk= 932, nxpk= 20, iat= 251, 425, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   86 TRP  HZ2          86 TRP  HH2         3.50    (#    933:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 933, nxpk= 20, iat= 301, 303, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HZ3          86 TRP  HH2         3.50    (#    934:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 934, nxpk= 20, iat= 305, 303, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 ALA  MB           86 TRP  HH2         4.40    (#    935:20  Unique         2.20, 3.12 A)
 &rst
  ixpk= 935, nxpk= 20, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 625, 626, 627,
 &end
#
#   86 TRP  HB-          86 TRP  HD1         6.00    (#    936:20  Unique         2.62, 3.23 A)
 &rst
  ixpk= 936, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 292, 293,
 &end
#
#   86 TRP  HB+          86 TRP  HD1         6.00    (#    937:20  Unique         2.62, 3.23 A)
 &rst
  ixpk= 937, nxpk= 20, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 292, 293,
 &end
#
#    0 AMB  20-2:938     94 VAL  MGX         4.40    (#    938:20  Single Ambig)
 &rst
  ixpk= 938, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 324, 443, 444,
 igr2= 429, 430, 431, 433, 434, 435,
 &end
#
#   75 ILE  MG2          75 ILE  HG1-        3.50    (#    939:20  Unique         2.27, 3.48 A)
 &rst
  ixpk= 939, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 118, 119, 120,
 igr2= 122, 123,
 &end
#
#   75 ILE  MG2          75 ILE  HG1+        2.60    (#    940:20  Unique         2.27, 3.48 A)
 &rst
  ixpk= 940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 118, 119, 120,
 igr2= 122, 123,
 &end
#
#   75 ILE  MG2          77 ARG  HB+         4.40    (#    942:20  Unique         2.58, 5.92 A)
 &rst
  ixpk= 942, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 118, 119, 120,
 igr2= 147, 148,
 &end
#
#   94 VAL  MGY          84 ARG  HA          6.00    (#    943:20  Unique         2.26, 3.60 A)
 &rst
  ixpk= 943, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#   84 ARG  HD+          81 ALA  HA          6.00    (#    944:20  Unique         2.21, 4.48 A)
 &rst
  ixpk= 944, nxpk= 20, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 259, 260,
 &end
#
#   76 ASP  HN           75 ILE  HG1-        6.00    (#    945:20  Unique         2.58, 4.77 A)
 &rst
  ixpk= 945, nxpk= 20, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 122, 123,
 &end
#
#   76 ASP  HN           75 ILE  HG1+        6.00    (#    946:20  Unique         2.58, 4.77 A)
 &rst
  ixpk= 946, nxpk= 20, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 122, 123,
 &end
#
#   83 ILE  HG1+         83 ILE  MD1         3.50    (#    947:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 947, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 240, 241,
 igr2= 243, 244, 245,
 &end
#
#  116 HIS  HB+         116 HIS  HA          2.60    (#    948:20  Unique         2.36, 2.66 A)
 &rst
  ixpk= 948, nxpk= 20, iat=  -1, 758, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr1= 760, 761,
 &end
#
#  116 HIS  HD2         116 HIS  HA          6.00    (#    949:20  Unique         2.40, 3.79 A)
 &rst
  ixpk= 949, nxpk= 20, iat= 770, 758, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:950     79 GLN  HA          6.00    (#    950:20  Single Ambig)
 &rst
  ixpk= 950, nxpk= 20, iat=  -1, 184, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 230, 210,
 &end
#
#  113 LEU  HB+         113 LEU  HA          3.50    (#    951:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 951, nxpk= 20, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 708, 709,
 &end
#
#  113 LEU  HN          112 THR  HA          4.40    (#    952:20  Unique         3.43, 3.58 A)
 &rst
  ixpk= 952, nxpk= 20, iat= 704, 692, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  20-2:953      0 AMB  20-1:953    6.00    (#    953:20  Double Ambig)
 &rst
  ixpk= 953, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 133, 740,
 igr2= 147, 148, 727, 728,
 &end
#
#   86 TRP  HA           86 TRP  HD1         6.00    (#    954:20  Unique         3.08, 3.19 A)
 &rst
  ixpk= 954, nxpk= 20, iat= 290, 296, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   86 TRP  HE1          86 TRP  HD1         4.40    (#    955:20  Unique         2.56, 2.57 A)
 &rst
  ixpk= 955, nxpk= 20, iat= 298, 296, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  108 TYR  HE          108 TYR  HD          3.50    (#    956:20  Unique         2.48, 3.74 A)
 &rst
  ixpk= 956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 641, 646,
 igr2= 639, 648,
 &end
#
#   75 ILE  HA           74 ALA  HA          4.40    (#    957:20  Unique         4.36, 4.44 A)
 &rst
  ixpk= 957, nxpk= 20, iat= 114, 104, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#    0 AMB  10-2:1      100 ILE  HN          2.80    (#      1:10  Single Ambig)
 &rst
  ixpk= 1, nxpk= 10, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 497, 521,
 &end
#
#    0 AMB  10-2:2      100 ILE  HN          2.80    (#      2:10  Single Ambig)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 523, 499, 500,
 &end
#
#  101 PRO  HA          102 ALA  HN          2.80    (#      3:10  Unique         2.21, 2.23 A)
 &rst
  ixpk= 3, nxpk= 10, iat= 548, 552, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  102 ALA  HA          102 ALA  HN          4.20    (#      4:10  Unique         2.75, 2.78 A)
 &rst
  ixpk= 4, nxpk= 10, iat= 554, 552, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  102 ALA  MB          102 ALA  HN          2.80    (#      5:10  Unique         2.38, 2.85 A)
 &rst
  ixpk= 5, nxpk= 10, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 556, 557, 558,
 &end
#
#   92 HIS  HN           91 GLY  HN          4.20    (#      6:10  Unique         2.53, 2.69 A)
 &rst
  ixpk= 6, nxpk= 10, iat= 391, 384, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   90 ASN  HN           91 GLY  HN          4.20    (#      7:10  Unique         2.54, 2.60 A)
 &rst
  ixpk= 7, nxpk= 10, iat= 370, 384, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   91 GLY  HA+          91 GLY  HN          2.80    (#      8:10  Unique         2.28, 2.59 A)
 &rst
  ixpk= 8, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 386, 387,
 &end
#
#   91 GLY  HA-          91 GLY  HN          2.80    (#      9:10  Unique         2.28, 2.59 A)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 386, 387,
 &end
#
#   76 ASP  HA           76 ASP  HN          4.20    (#     14:10  Unique         2.28, 2.94 A)
 &rst
  ixpk= 14, nxpk= 10, iat= 133, 131, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   75 ILE  HA           76 ASP  HN          2.80    (#     15:10  Unique         2.12, 2.24 A)
 &rst
  ixpk= 15, nxpk= 10, iat= 114, 131, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   76 ASP  HB+          76 ASP  HN          6.00    (#     16:10  Unique         2.44, 2.83 A)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 135, 136,
 &end
#
#   76 ASP  HB-          76 ASP  HN          4.20    (#     17:10  Unique         2.44, 2.83 A)
 &rst
  ixpk= 17, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 135, 136,
 &end
#
#   73 GLY  HA+          74 ALA  HN          4.20    (#     19:10  Unique         2.19, 2.88 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1=  97,  98,
 &end
#
#   74 ALA  MB           74 ALA  HN          4.20    (#     20:10  Unique         2.41, 3.18 A)
 &rst
  ixpk= 20, nxpk= 10, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 106, 107, 108,
 &end
#
#  107 ALA  HA          107 ALA  HN          4.20    (#     21:10  Unique         2.74, 2.74 A)
 &rst
  ixpk= 21, nxpk= 10, iat= 623, 621, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  106 ASP  HB+         107 ALA  HN          2.80    (#     23:10  Unique         2.53, 3.24 A)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1, 621, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 613, 614,
 &end
#
#  107 ALA  MB          107 ALA  HN          2.80    (#     24:10  Unique         2.35, 2.83 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1, 621, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 625, 626, 627,
 &end
#
#   82 ALA  HN           81 ALA  HN          4.20    (#     25:10  Unique         2.32, 2.82 A)
 &rst
  ixpk= 25, nxpk= 10, iat= 220, 210, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:26      81 ALA  HN          4.20    (#     26:10  Single Ambig)
 &rst
  ixpk= 26, nxpk= 10, iat=  -1, 210, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 212, 145,
 &end
#
#    0 AMB  10-2:27      81 ALA  HN          4.20    (#     27:10  Single Ambig)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 210, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 203, 204, 201,
 &end
#
#   81 ALA  MB           81 ALA  HN          2.80    (#     28:10  Unique         2.40, 2.85 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 210, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 214, 215, 216,
 &end
#
#  114 GLU  HN          113 LEU  HN          4.20    (#     29:10  Unique         2.10, 2.51 A)
 &rst
  ixpk= 29, nxpk= 10, iat= 723, 704, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:30     113 LEU  HN          4.20    (#     30:10  Single Ambig)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 706, 725,
 &end
#
#    0 AMB  10-2:31     113 LEU  HN          4.20    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 672, 692,
 &end
#
#  113 LEU  HB+         113 LEU  HN          2.80    (#     32:10  Unique         2.28, 2.68 A)
 &rst
  ixpk= 32, nxpk= 10, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 708, 709,
 &end
#
#  113 LEU  HB-         113 LEU  HN          4.20    (#     33:10  Unique         2.28, 2.68 A)
 &rst
  ixpk= 33, nxpk= 10, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 708, 709,
 &end
#
#   86 TRP  HN           87 ALA  HN          4.20    (#     34:10  Unique         2.78, 2.93 A)
 &rst
  ixpk= 34, nxpk= 10, iat= 288, 312, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   88 ARG  HN           87 ALA  HN          4.20    (#     35:10  Unique         2.76, 2.82 A)
 &rst
  ixpk= 35, nxpk= 10, iat= 322, 312, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:36      87 ALA  HN          4.20    (#     36:10  Single Ambig)
 &rst
  ixpk= 36, nxpk= 10, iat=  -1, 312, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 292, 293, 314,
 &end
#
#  104 VAL  HA          104 VAL  HN          6.00    (#     37:10  Unique         2.88, 2.89 A)
 &rst
  ixpk= 37, nxpk= 10, iat= 576, 574, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:38     104 VAL  HN          4.20    (#     38:10  Single Ambig)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 562, 552,
 &end
#
#    0 AMB  10-2:39     104 VAL  HN          2.80    (#     39:10  Single Ambig)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 578, 545, 546, 542, 543,
 &end
#
#  104 VAL  MGY         104 VAL  HN          2.80    (#     40:10  Unique         1.99, 3.86 A)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#  107 ALA  HN          108 TYR  HN          4.20    (#     41:10  Unique         2.92, 2.95 A)
 &rst
  ixpk= 41, nxpk= 10, iat= 621, 631, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  108 TYR  HB+         108 TYR  HN          2.80    (#     42:10  Unique         2.22, 2.47 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 635, 636,
 &end
#
#  108 TYR  HB-         108 TYR  HN          2.80    (#     43:10  Unique         2.22, 2.47 A)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 635, 636,
 &end
#
#  108 TYR  HA          108 TYR  HN          4.20    (#     44:10  Unique         2.83, 2.85 A)
 &rst
  ixpk= 44, nxpk= 10, iat= 633, 631, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  107 ALA  MB          108 TYR  HN          4.20    (#     45:10  Unique         2.51, 3.39 A)
 &rst
  ixpk= 45, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 625, 626, 627,
 &end
#
#   93 ASN  HA           94 VAL  HN          2.80    (#     46:10  Unique         2.13, 2.18 A)
 &rst
  ixpk= 46, nxpk= 10, iat= 411, 423, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   94 VAL  HA           94 VAL  HN          6.00    (#     47:10  Unique         2.89, 2.92 A)
 &rst
  ixpk= 47, nxpk= 10, iat= 425, 423, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   94 VAL  MGX          94 VAL  HN          4.20    (#     48:10  Unique         2.62, 4.19 A)
 &rst
  ixpk= 48, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  10-2:50      82 ALA  HN          4.20    (#     50:10  Single Ambig)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 222, 169,
 &end
#
#    0 AMB  10-2:51      82 ALA  HN          2.80    (#     51:10  Single Ambig)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 224, 225, 226, 214, 215, 216,
 &end
#
#  109 HIS  HN          110 ALA  HN          4.20    (#     52:10  Unique         2.80, 2.88 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 652, 670, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  111 ALA  HN          110 ALA  HN          4.20    (#     53:10  Unique         2.79, 2.85 A)
 &rst
  ixpk= 53, nxpk= 10, iat= 680, 670, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  110 ALA  HA          110 ALA  HN          4.20    (#     54:10  Unique         2.79, 2.83 A)
 &rst
  ixpk= 54, nxpk= 10, iat= 672, 670, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  109 HIS  HB+         110 ALA  HN          4.20    (#     55:10  Unique         2.72, 3.31 A)
 &rst
  ixpk= 55, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 656, 657,
 &end
#
#  110 ALA  MB          110 ALA  HN          2.80    (#     56:10  Unique         2.42, 2.87 A)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 674, 675, 676,
 &end
#
#   76 ASP  HA            0 AMB  10-1:58     4.20    (#     58:10  Single Ambig)
 &rst
  ixpk= 58, nxpk= 10, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 143, 167,
 &end
#
#    0 AMB  10-2:59       0 AMB  10-1:59     2.80    (#     59:10  Double Ambig)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 147, 148, 147, 148,
 igr2= 143, 167,
 &end
#
#   94 VAL  HA           95 SER  HN          2.80    (#     61:10  Unique         2.16, 2.26 A)
 &rst
  ixpk= 61, nxpk= 10, iat= 425, 439, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   95 SER  HB-          95 SER  HN          6.00    (#     62:10  Unique         2.39, 2.78 A)
 &rst
  ixpk= 62, nxpk= 10, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 443, 444,
 &end
#
#    0 AMB  10-2:63      78 GLU  HN          4.20    (#     63:10  Single Ambig)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 169, 114,
 &end
#
#   78 GLU  HG+          78 GLU  HN          4.20    (#     64:10  Unique         2.14, 3.84 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 174, 175,
 &end
#
#   78 GLU  HB+          78 GLU  HN          2.80    (#     65:10  Unique         2.24, 2.73 A)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 171, 172,
 &end
#
#  106 ASP  HN          105 ILE  HN          4.20    (#     66:10  Unique         2.70, 2.80 A)
 &rst
  ixpk= 66, nxpk= 10, iat= 609, 590, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  105 ILE  HA          105 ILE  HN          6.00    (#     67:10  Unique         2.88, 2.89 A)
 &rst
  ixpk= 67, nxpk= 10, iat= 592, 590, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:68     105 ILE  HN          4.20    (#     68:10  Single Ambig)
 &rst
  ixpk= 68, nxpk= 10, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 578, 542, 543, 545, 546,
 &end
#
#  105 ILE  HB          105 ILE  HN          2.80    (#     69:10  Unique         2.30, 2.33 A)
 &rst
  ixpk= 69, nxpk= 10, iat= 594, 590, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  105 ILE  HG1-        105 ILE  HN          2.80    (#     70:10  Unique         2.42, 3.17 A)
 &rst
  ixpk= 70, nxpk= 10, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 600, 601,
 &end
#
#    0 AMB  10-2:71     105 ILE  HN          2.80    (#     71:10  Single Ambig)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 603, 604, 605, 596, 597, 598,
 &end
#
#   79 GLN  HA           79 GLN  HN          4.20    (#     72:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 72, nxpk= 10, iat= 184, 182, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:73      79 GLN  HN          2.80    (#     73:10  Single Ambig)
 &rst
  ixpk= 73, nxpk= 10, iat=  -1, 182, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 171, 172, 186, 187,
 &end
#
#   87 ALA  HN           86 TRP  HN          4.20    (#     74:10  Unique         2.78, 2.93 A)
 &rst
  ixpk= 74, nxpk= 10, iat= 312, 288, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   86 TRP  HA           86 TRP  HN          4.20    (#     75:10  Unique         2.75, 2.77 A)
 &rst
  ixpk= 75, nxpk= 10, iat= 290, 288, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   86 TRP  HB+          86 TRP  HN          2.80    (#     76:10  Unique         2.37, 2.47 A)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 292, 293,
 &end
#
#   86 TRP  HB-          86 TRP  HN          2.80    (#     77:10  Unique         2.37, 2.47 A)
 &rst
  ixpk= 77, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 292, 293,
 &end
#
#   85 GLU  HB+          86 TRP  HN          4.20    (#     78:10  Unique         2.46, 3.23 A)
 &rst
  ixpk= 78, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 277, 278,
 &end
#
#   98 GLY  HA+          99 ARG  HN          2.80    (#     80:10  Unique         2.21, 2.59 A)
 &rst
  ixpk= 80, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 490, 491,
 &end
#
#   99 ARG  HB+          99 ARG  HN          2.80    (#     81:10  Unique         2.30, 2.91 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 499, 500,
 &end
#
#  113 LEU  HN          114 GLU  HN          4.20    (#     82:10  Unique         2.10, 2.51 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 704, 723, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:83     114 GLU  HN          2.80    (#     83:10  Single Ambig)
 &rst
  ixpk= 83, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 725, 706,
 &end
#
#  114 GLU  HB+         114 GLU  HN          2.80    (#     84:10  Unique         2.19, 2.98 A)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 727, 728,
 &end
#
#   82 ALA  HN           83 ILE  HN          4.20    (#     85:10  Unique         2.65, 2.83 A)
 &rst
  ixpk= 85, nxpk= 10, iat= 220, 230, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:86      83 ILE  HN          2.80    (#     86:10  Single Ambig)
 &rst
  ixpk= 86, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 234, 224, 225, 226,
 &end
#
#   83 ILE  HG1-         83 ILE  HN          2.80    (#     87:10  Unique         2.20, 2.97 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 240, 241,
 &end
#
#    0 AMB  10-2:88      84 ARG  HN          2.80    (#     88:10  Single Ambig)
 &rst
  ixpk= 88, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 230, 273,
 &end
#
#   84 ARG  HB-          84 ARG  HN          2.80    (#     89:10  Unique         2.27, 2.63 A)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 253, 254,
 &end
#
#   83 ILE  HB           84 ARG  HN          4.20    (#     90:10  Unique         2.61, 2.78 A)
 &rst
  ixpk= 90, nxpk= 10, iat= 234, 249, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   74 ALA  HA           75 ILE  HN          2.80    (#     91:10  Unique         2.18, 2.39 A)
 &rst
  ixpk= 91, nxpk= 10, iat= 104, 112, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 ILE  HB           75 ILE  HN          4.20    (#     92:10  Unique         2.39, 2.67 A)
 &rst
  ixpk= 92, nxpk= 10, iat= 116, 112, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  110 ALA  HN          111 ALA  HN          4.20    (#     93:10  Unique         2.79, 2.85 A)
 &rst
  ixpk= 93, nxpk= 10, iat= 670, 680, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  112 THR  HN          111 ALA  HN          2.80    (#     94:10  Unique         2.80, 2.84 A)
 &rst
  ixpk= 94, nxpk= 10, iat= 690, 680, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  111 ALA  HA          111 ALA  HN          4.20    (#     95:10  Unique         2.74, 2.78 A)
 &rst
  ixpk= 95, nxpk= 10, iat= 682, 680, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:96     111 ALA  HN          2.80    (#     96:10  Single Ambig)
 &rst
  ixpk= 96, nxpk= 10, iat=  -1, 680, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 684, 685, 686, 674, 675, 676,
 &end
#
#   85 GLU  HA           85 GLU  HN          2.80    (#     97:10  Unique         2.78, 2.79 A)
 &rst
  ixpk= 97, nxpk= 10, iat= 275, 273, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   85 GLU  HB+          85 GLU  HN          2.80    (#     98:10  Unique         2.19, 2.59 A)
 &rst
  ixpk= 98, nxpk= 10, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 277, 278,
 &end
#
#   84 ARG  HB-          85 GLU  HN          4.20    (#     99:10  Unique         2.34, 3.14 A)
 &rst
  ixpk= 99, nxpk= 10, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 253, 254,
 &end
#
#   85 GLU  HG+          85 GLU  HN          4.20    (#    100:10  Unique         2.29, 4.23 A)
 &rst
  ixpk= 100, nxpk= 10, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 280, 281,
 &end
#
#    0 AMB  10-2:101    106 ASP  HN          6.00    (#    101:10  Single Ambig)
 &rst
  ixpk= 101, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 652, 662,
 &end
#
#  107 ALA  HN          106 ASP  HN          4.20    (#    102:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 102, nxpk= 10, iat= 621, 609, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:103    106 ASP  HN          4.20    (#    103:10  Single Ambig)
 &rst
  ixpk= 103, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 590, 574,
 &end
#
#  106 ASP  HA          106 ASP  HN          4.20    (#    104:10  Unique         2.78, 2.78 A)
 &rst
  ixpk= 104, nxpk= 10, iat= 611, 609, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  106 ASP  HB+         106 ASP  HN          2.80    (#    105:10  Unique         2.41, 2.50 A)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 613, 614,
 &end
#
#    0 AMB  10-2:106      0 AMB  10-1:106    4.20    (#    106:10  Double Ambig)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 723, 670,
 igr2= 738, 652,
 &end
#
#  109 HIS  HB+         109 HIS  HN          2.80    (#    107:10  Unique         2.27, 3.02 A)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 656, 657,
 &end
#
#  108 TYR  HB+         109 HIS  HN          4.20    (#    108:10  Unique         2.52, 3.29 A)
 &rst
  ixpk= 108, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 635, 636,
 &end
#
#   92 HIS  HB-          92 HIS  HN          4.20    (#    111:10  Unique         2.36, 2.95 A)
 &rst
  ixpk= 111, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 395, 396,
 &end
#
#   88 ARG  HN           89 ARG  HN          4.20    (#    112:10  Unique         2.63, 2.82 A)
 &rst
  ixpk= 112, nxpk= 10, iat= 322, 346, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:113     89 ARG  HN          6.00    (#    113:10  Single Ambig)
 &rst
  ixpk= 113, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 379, 380, 379, 380,
 &end
#
#   90 ASN  HN           89 ARG  HN          4.20    (#    114:10  Unique         2.60, 2.73 A)
 &rst
  ixpk= 114, nxpk= 10, iat= 370, 346, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:115     89 ARG  HN          4.20    (#    115:10  Single Ambig)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 348, 275,
 &end
#
#   88 ARG  HB+          89 ARG  HN          4.20    (#    116:10  Unique         2.50, 3.20 A)
 &rst
  ixpk= 116, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 326, 327,
 &end
#
#    0 AMB  10-2:117     89 ARG  HN          2.80    (#    117:10  Single Ambig)
 &rst
  ixpk= 117, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 350, 351, 353, 354,
 &end
#
#   87 ALA  HN           88 ARG  HN          4.20    (#    118:10  Unique         2.76, 2.82 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 312, 322, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   89 ARG  HN           88 ARG  HN          4.20    (#    119:10  Unique         2.63, 2.82 A)
 &rst
  ixpk= 119, nxpk= 10, iat= 346, 322, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   88 ARG  HA           88 ARG  HN          4.20    (#    120:10  Unique         2.83, 2.86 A)
 &rst
  ixpk= 120, nxpk= 10, iat= 324, 322, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   88 ARG  HB+          88 ARG  HN          2.80    (#    121:10  Unique         2.25, 2.55 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 326, 327,
 &end
#
#   88 ARG  HG-          88 ARG  HN          4.20    (#    122:10  Unique         2.45, 4.27 A)
 &rst
  ixpk= 122, nxpk= 10, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 329, 330,
 &end
#
#   87 ALA  MB           88 ARG  HN          4.20    (#    123:10  Unique         2.56, 3.43 A)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 316, 317, 318,
 &end
#
#   89 ARG  HN           90 ASN  HN          4.20    (#    125:10  Unique         2.60, 2.73 A)
 &rst
  ixpk= 125, nxpk= 10, iat= 346, 370, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   91 GLY  HN           90 ASN  HN          4.20    (#    126:10  Unique         2.54, 2.60 A)
 &rst
  ixpk= 126, nxpk= 10, iat= 384, 370, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:127     90 ASN  HN          4.20    (#    127:10  Single Ambig)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 379, 380, 379, 380,
 &end
#
#   90 ASN  HB-          90 ASN  HN          4.20    (#    128:10  Unique         2.34, 3.02 A)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 374, 375,
 &end
#
#   79 GLN  HN           80 SER  HN          4.20    (#    129:10  Unique         2.39, 2.74 A)
 &rst
  ixpk= 129, nxpk= 10, iat= 182, 199, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   81 ALA  HN           80 SER  HN          6.00    (#    130:10  Unique         2.42, 2.81 A)
 &rst
  ixpk= 130, nxpk= 10, iat= 210, 199, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   79 GLN  HA           80 SER  HN          4.20    (#    132:10  Unique         3.43, 3.55 A)
 &rst
  ixpk= 132, nxpk= 10, iat= 184, 199, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:133     80 SER  HN          2.80    (#    133:10  Single Ambig)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 203, 204, 201,
 &end
#
#   80 SER  HB-          80 SER  HN          4.20    (#    134:10  Unique         2.37, 3.06 A)
 &rst
  ixpk= 134, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 203, 204,
 &end
#
#    0 AMB  10-2:135     80 SER  HN          4.20    (#    135:10  Single Ambig)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 186, 187, 171, 172,
 &end
#
#    0 AMB  10-2:136    103 ASP  HN          2.80    (#    136:10  Single Ambig)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 574, 590,
 &end
#
#    0 AMB  10-2:137    103 ASP  HN          2.80    (#    137:10  Single Ambig)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 564, 548,
 &end
#
#  103 ASP  HB+         103 ASP  HN          4.20    (#    138:10  Unique         2.39, 2.62 A)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 566, 567,
 &end
#
#  103 ASP  HB-         103 ASP  HN          4.20    (#    139:10  Unique         2.39, 2.62 A)
 &rst
  ixpk= 139, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 566, 567,
 &end
#
#  102 ALA  MB          103 ASP  HN          4.20    (#    140:10  Unique         2.84, 3.68 A)
 &rst
  ixpk= 140, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 556, 557, 558,
 &end
#
#   86 TRP  HD1          86 TRP  HE1         2.80    (#    149:10  Unique         2.56, 2.57 A)
 &rst
  ixpk= 149, nxpk= 10, iat= 296, 298, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  111 ALA  MB           86 TRP  HE1         4.20    (#    150:10  Unique         2.33, 3.24 A)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1, 298, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 684, 685, 686,
 &end
#
#    0 AMB  10-2:153     71 GLY  HN          4.20    (#    153:10  Single Ambig)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1=  66,  67,  35,  36,
 &end
#
#   70 ARG  HA           71 GLY  HN          4.20    (#    154:10  Unique         2.08, 2.82 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  42,  64, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  112 THR  MG2         112 THR  HN          6.00    (#    155:10  Unique         2.25, 3.33 A)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 696, 697, 698,
 &end
#
#    0 AMB  10-2:156    112 THR  HN          4.20    (#    156:10  Single Ambig)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 692, 672,
 &end
#
#    0 AMB  10-2:157    112 THR  HN          4.20    (#    157:10  Single Ambig)
 &rst
  ixpk= 157, nxpk= 10, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 654, 694,
 &end
#
#    0 AMB  10-2:158    112 THR  HN          4.20    (#    158:10  Single Ambig)
 &rst
  ixpk= 158, nxpk= 10, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 684, 685, 686, 708, 709,
 &end
#
#   97 ARG  HA           98 GLY  HN          6.00    (#    159:10  Unique         2.29, 3.03 A)
 &rst
  ixpk= 159, nxpk= 10, iat= 466, 488, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   98 GLY  HA+          98 GLY  HN          4.20    (#    160:10  Unique         2.29, 2.63 A)
 &rst
  ixpk= 160, nxpk= 10, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 490, 491,
 &end
#
#  100 ILE  HG1+        100 ILE  HN          4.20    (#    161:10  Unique         2.24, 3.07 A)
 &rst
  ixpk= 161, nxpk= 10, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 529, 530,
 &end
#
#    0 AMB  10-2:162    102 ALA  HN          6.00    (#    162:10  Single Ambig)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 545, 546, 542, 543,
 &end
#
#  101 PRO  HB+         102 ALA  HN          6.00    (#    163:10  Unique         3.07, 3.60 A)
 &rst
  ixpk= 163, nxpk= 10, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 545, 546,
 &end
#
#   90 ASN  HA           91 GLY  HN          4.20    (#    165:10  Unique         3.18, 3.30 A)
 &rst
  ixpk= 165, nxpk= 10, iat= 372, 384, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  116 HIS  HA          117 HIS  HN          4.20    (#    167:10  Unique         2.65, 3.14 A)
 &rst
  ixpk= 167, nxpk= 10, iat= 758, 774, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   88 ARG  HA           91 GLY  HN          6.00    (#    168:10  Unique         3.40, 3.56 A)
 &rst
  ixpk= 168, nxpk= 10, iat= 324, 384, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   84 ARG  HD+          84 ARG  HE          6.00    (#    169:10  Unique         2.33, 2.81 A)
 &rst
  ixpk= 169, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 259, 260,
 &end
#
#   84 ARG  HD-          84 ARG  HE          6.00    (#    170:10  Unique         2.33, 2.81 A)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 259, 260,
 &end
#
#   78 GLU  HB+          76 ASP  HN          4.20    (#    172:10  Unique         3.92, 4.83 A)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 171, 172,
 &end
#
#   75 ILE  HB           76 ASP  HN          4.20    (#    173:10  Unique         3.89, 4.15 A)
 &rst
  ixpk= 173, nxpk= 10, iat= 116, 131, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   75 ILE  MG2          76 ASP  HN          6.00    (#    174:10  Unique         2.44, 3.52 A)
 &rst
  ixpk= 174, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 118, 119, 120,
 &end
#
#   74 ALA  HA           74 ALA  HN          6.00    (#    175:10  Unique         2.27, 2.90 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 104, 102, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:179    107 ALA  HN          4.20    (#    179:10  Single Ambig)
 &rst
  ixpk= 179, nxpk= 10, iat=  -1, 621, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 611, 564,
 &end
#
#  104 VAL  HA          107 ALA  HN          4.20    (#    180:10  Unique         3.02, 3.10 A)
 &rst
  ixpk= 180, nxpk= 10, iat= 576, 621, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   80 SER  HN           81 ALA  HN          4.20    (#    181:10  Unique         2.42, 2.81 A)
 &rst
  ixpk= 181, nxpk= 10, iat= 199, 210, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   78 GLU  HA           81 ALA  HN          6.00    (#    182:10  Unique         2.94, 3.85 A)
 &rst
  ixpk= 182, nxpk= 10, iat= 169, 210, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   86 TRP  HE3          87 ALA  HN          6.00    (#    184:10  Unique         2.64, 2.74 A)
 &rst
  ixpk= 184, nxpk= 10, iat= 307, 312, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   86 TRP  HB+          87 ALA  HN          4.20    (#    185:10  Unique         2.52, 3.26 A)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1, 312, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 292, 293,
 &end
#
#   84 ARG  HA           87 ALA  HN          6.00    (#    186:10  Unique         3.40, 3.55 A)
 &rst
  ixpk= 186, nxpk= 10, iat= 251, 312, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   86 TRP  HA           87 ALA  HN          6.00    (#    187:10  Unique         3.59, 3.61 A)
 &rst
  ixpk= 187, nxpk= 10, iat= 290, 312, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   87 ALA  MB           87 ALA  HN          2.80    (#    188:10  Unique         2.40, 2.84 A)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1, 312, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 316, 317, 318,
 &end
#
#    0 AMB  10-2:189    113 LEU  HN          4.20    (#    189:10  Single Ambig)
 &rst
  ixpk= 189, nxpk= 10, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 654, 694,
 &end
#
#    0 AMB  10-2:190    113 LEU  HN          4.20    (#    190:10  Single Ambig)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1= 713, 714, 715, 717, 718, 719, 713, 714, 715, 717,
       718, 719, 696, 697, 698,
 &end
#
#  104 VAL  MGX         104 VAL  HN          4.20    (#    191:10  Unique         1.99, 3.86 A)
 &rst
  ixpk= 191, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#  101 PRO  HB+         104 VAL  HN          6.00    (#    192:10  Unique         2.51, 3.70 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 545, 546,
 &end
#
#  103 ASP  HB-         104 VAL  HN          6.00    (#    193:10  Unique         2.60, 3.41 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 566, 567,
 &end
#
#  103 ASP  HB+         104 VAL  HN          6.00    (#    194:10  Unique         2.60, 3.41 A)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 566, 567,
 &end
#
#  102 ALA  HA          104 VAL  HN          6.00    (#    195:10  Unique         4.02, 4.10 A)
 &rst
  ixpk= 195, nxpk= 10, iat= 554, 574, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:196    104 VAL  HN          6.00    (#    196:10  Single Ambig)
 &rst
  ixpk= 196, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 564, 548,
 &end
#
#    0 AMB  10-2:197    104 VAL  HN          6.00    (#    197:10  Single Ambig)
 &rst
  ixpk= 197, nxpk= 10, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 609, 631,
 &end
#
#   86 TRP  HZ3         108 TYR  HN          6.00    (#    198:10  Unique         3.13, 3.55 A)
 &rst
  ixpk= 198, nxpk= 10, iat= 305, 631, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  108 TYR  HD          108 TYR  HN          6.00    (#    199:10  Unique         4.34, 4.68 A)
 &rst
  ixpk= 199, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 639, 648,
 &end
#
#  107 ALA  HA          108 TYR  HN          6.00    (#    200:10  Unique         3.59, 3.59 A)
 &rst
  ixpk= 200, nxpk= 10, iat= 623, 631, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  105 ILE  HA          108 TYR  HN          4.20    (#    201:10  Unique         3.37, 3.48 A)
 &rst
  ixpk= 201, nxpk= 10, iat= 592, 631, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:202    108 TYR  HN          6.00    (#    202:10  Single Ambig)
 &rst
  ixpk= 202, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 576, 292, 293,
 &end
#
#  104 VAL  MGX         108 TYR  HN          6.00    (#    203:10  Unique         4.02, 5.77 A)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 580, 581, 582, 584, 585, 586,
 &end
#
#    0 AMB  10-2:204    108 TYR  HN          6.00    (#    204:10  Single Ambig)
 &rst
  ixpk= 204, nxpk= 10, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 684, 685, 686, 674, 675, 676,
 &end
#
#   93 ASN  HB+          94 VAL  HN          6.00    (#    206:10  Unique         2.96, 4.18 A)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 413, 414,
 &end
#
#   94 VAL  HB           94 VAL  HN          4.20    (#    207:10  Unique         3.34, 3.45 A)
 &rst
  ixpk= 207, nxpk= 10, iat= 427, 423, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:208     82 ALA  HN          6.00    (#    208:10  Single Ambig)
 &rst
  ixpk= 208, nxpk= 10, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 171, 172, 186, 187, 277, 278,
 &end
#
#   81 ALA  HA           82 ALA  HN          4.20    (#    210:10  Unique         3.57, 3.60 A)
 &rst
  ixpk= 210, nxpk= 10, iat= 212, 220, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:211     82 ALA  HN          2.80    (#    211:10  Single Ambig)
 &rst
  ixpk= 211, nxpk= 10, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 210, 230,
 &end
#
#  107 ALA  HA          110 ALA  HN          4.20    (#    212:10  Unique         3.40, 3.51 A)
 &rst
  ixpk= 212, nxpk= 10, iat= 623, 670, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   76 ASP  HB+          77 ARG  HN          4.20    (#    213:10  Unique         2.12, 3.57 A)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 143, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 135, 136,
 &end
#
#   76 ASP  HB-          77 ARG  HN          4.20    (#    214:10  Unique         2.12, 3.57 A)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1, 143, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 135, 136,
 &end
#
#    0 AMB  10-2:215      0 AMB  10-1:215    4.20    (#    215:10  Double Ambig)
 &rst
  ixpk= 215, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 150, 151, 150, 151,
 igr2= 143, 167,
 &end
#
#   77 ARG  HG-           0 AMB  10-1:216    4.20    (#    216:10  Single Ambig)
 &rst
  ixpk= 216, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 150, 151,
 igr2= 143, 167,
 &end
#
#   95 SER  HB+          95 SER  HN          4.20    (#    217:10  Unique         2.39, 2.78 A)
 &rst
  ixpk= 217, nxpk= 10, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 443, 444,
 &end
#
#   95 SER  HA           95 SER  HN          4.20    (#    218:10  Unique         2.80, 2.90 A)
 &rst
  ixpk= 218, nxpk= 10, iat= 441, 439, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   94 VAL  HB           95 SER  HN          4.20    (#    219:10  Unique         2.83, 3.98 A)
 &rst
  ixpk= 219, nxpk= 10, iat= 427, 439, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   94 VAL  MGY          95 SER  HN          4.20    (#    220:10  Unique         2.31, 3.98 A)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  10-2:221     79 GLN  HN          4.20    (#    221:10  Single Ambig)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1, 182, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 189, 190, 174, 175,
 &end
#
#   79 GLN  HG+          79 GLN  HN          4.20    (#    222:10  Unique         2.17, 3.01 A)
 &rst
  ixpk= 222, nxpk= 10, iat=  -1, 182, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 189, 190,
 &end
#
#   80 SER  HN           79 GLN  HN          4.20    (#    224:10  Unique         2.39, 2.74 A)
 &rst
  ixpk= 224, nxpk= 10, iat= 199, 182, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:225     86 TRP  HN          4.20    (#    225:10  Single Ambig)
 &rst
  ixpk= 225, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 280, 281, 635, 636,
 &end
#
#   87 ALA  MB           86 TRP  HN          6.00    (#    226:10  Unique         4.83, 5.60 A)
 &rst
  ixpk= 226, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 316, 317, 318,
 &end
#
#    0 AMB  10-2:227     86 TRP  HN          4.20    (#    227:10  Single Ambig)
 &rst
  ixpk= 227, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 232, 356, 357,
 &end
#
#   84 ARG  HA           86 TRP  HN          6.00    (#    228:10  Unique         4.67, 4.76 A)
 &rst
  ixpk= 228, nxpk= 10, iat= 251, 288, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   85 GLU  HA           86 TRP  HN          4.20    (#    229:10  Unique         3.57, 3.63 A)
 &rst
  ixpk= 229, nxpk= 10, iat= 275, 288, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  108 TYR  HE           86 TRP  HN          6.00    (#    230:10  Unique         4.17, 6.78 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 641, 646,
 &end
#
#   86 TRP  HE3          86 TRP  HN          6.00    (#    231:10  Unique         4.58, 4.67 A)
 &rst
  ixpk= 231, nxpk= 10, iat= 307, 288, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:232    105 ILE  HN          6.00    (#    232:10  Single Ambig)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 564, 611, 548,
 &end
#
#  102 ALA  HA          105 ILE  HN          4.20    (#    233:10  Unique         3.07, 3.12 A)
 &rst
  ixpk= 233, nxpk= 10, iat= 554, 590, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  104 VAL  HA          105 ILE  HN          6.00    (#    234:10  Unique         3.52, 3.56 A)
 &rst
  ixpk= 234, nxpk= 10, iat= 576, 590, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:235    105 ILE  HN          2.80    (#    235:10  Single Ambig)
 &rst
  ixpk= 235, nxpk= 10, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 600, 601, 580, 581, 582, 584, 585, 586,
 &end
#
#   99 ARG  HA           99 ARG  HN          4.20    (#    236:10  Unique         2.28, 2.88 A)
 &rst
  ixpk= 236, nxpk= 10, iat= 497, 495, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   99 ARG  HG+          99 ARG  HN          4.20    (#    237:10  Unique         2.36, 3.53 A)
 &rst
  ixpk= 237, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 502, 503,
 &end
#
#  114 GLU  HG+         114 GLU  HN          6.00    (#    239:10  Unique         2.33, 3.76 A)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 730, 731,
 &end
#
#  114 GLU  HG-         114 GLU  HN          6.00    (#    240:10  Unique         2.33, 3.76 A)
 &rst
  ixpk= 240, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 730, 731,
 &end
#
#  113 LEU  HB-         114 GLU  HN          4.20    (#    241:10  Unique         2.43, 3.31 A)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 708, 709,
 &end
#
#  113 LEU  HB+         114 GLU  HN          4.20    (#    242:10  Unique         2.43, 3.31 A)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 708, 709,
 &end
#
#   83 ILE  MD1          83 ILE  HN          4.20    (#    244:10  Unique         3.53, 4.37 A)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 243, 244, 245,
 &end
#
#   83 ILE  HG1+         83 ILE  HN          4.20    (#    245:10  Unique         2.20, 2.97 A)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 240, 241,
 &end
#
#   83 ILE  HA           83 ILE  HN          4.20    (#    246:10  Unique         2.87, 2.89 A)
 &rst
  ixpk= 246, nxpk= 10, iat= 232, 230, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:247     83 ILE  HN          6.00    (#    247:10  Single Ambig)
 &rst
  ixpk= 247, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 201, 203, 204,
 &end
#
#   82 ALA  HA           83 ILE  HN          4.20    (#    248:10  Unique         3.58, 3.61 A)
 &rst
  ixpk= 248, nxpk= 10, iat= 222, 230, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   84 ARG  HA           84 ARG  HN          4.20    (#    249:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 249, nxpk= 10, iat= 251, 249, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   83 ILE  HA           84 ARG  HN          6.00    (#    250:10  Unique         3.55, 3.59 A)
 &rst
  ixpk= 250, nxpk= 10, iat= 232, 249, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   81 ALA  HA           84 ARG  HN          6.00    (#    251:10  Unique         3.08, 3.46 A)
 &rst
  ixpk= 251, nxpk= 10, iat= 212, 249, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   84 ARG  HG+          84 ARG  HN          6.00    (#    252:10  Unique         2.19, 4.17 A)
 &rst
  ixpk= 252, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 256, 257,
 &end
#
#   83 ILE  MG2          84 ARG  HN          6.00    (#    253:10  Unique         3.50, 4.36 A)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 236, 237, 238,
 &end
#
#    0 AMB  10-2:254     84 ARG  HN          6.00    (#    254:10  Single Ambig)
 &rst
  ixpk= 254, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 429, 430, 431, 433, 434, 435, 525, 526, 527,
 &end
#
#    0 AMB  10-2:255     84 ARG  HN          6.00    (#    255:10  Single Ambig)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 532, 533, 534, 529, 530,
 &end
#
#   75 ILE  HG1-         75 ILE  HN          4.20    (#    256:10  Unique         2.14, 3.50 A)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 122, 123,
 &end
#
#   74 ALA  MB           75 ILE  HN          6.00    (#    257:10  Unique         2.46, 3.82 A)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 106, 107, 108,
 &end
#
#   75 ILE  HG1+         75 ILE  HN          4.20    (#    258:10  Unique         2.14, 3.50 A)
 &rst
  ixpk= 258, nxpk= 10, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 122, 123,
 &end
#
#   75 ILE  MG2          75 ILE  HN          6.00    (#    259:10  Unique         2.53, 4.52 A)
 &rst
  ixpk= 259, nxpk= 10, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 118, 119, 120,
 &end
#
#   75 ILE  HA           75 ILE  HN          4.20    (#    260:10  Unique         2.25, 2.91 A)
 &rst
  ixpk= 260, nxpk= 10, iat= 114, 112, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:261    111 ALA  HN          6.00    (#    261:10  Single Ambig)
 &rst
  ixpk= 261, nxpk= 10, iat=  -1, 680, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 672, 692,
 &end
#
#  108 TYR  HA          111 ALA  HN          6.00    (#    262:10  Unique         3.39, 3.55 A)
 &rst
  ixpk= 262, nxpk= 10, iat= 633, 680, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:263     85 GLU  HN          4.20    (#    263:10  Single Ambig)
 &rst
  ixpk= 263, nxpk= 10, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 214, 215, 216, 234, 224, 225, 226,
 &end
#
#   84 ARG  HA           85 GLU  HN          6.00    (#    264:10  Unique         3.59, 3.61 A)
 &rst
  ixpk= 264, nxpk= 10, iat= 251, 273, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  108 TYR  HD          109 HIS  HN          6.00    (#    265:10  Unique         2.83, 4.25 A)
 &rst
  ixpk= 265, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 639, 648,
 &end
#
#  106 ASP  HA          109 HIS  HN          6.00    (#    266:10  Unique         3.34, 3.40 A)
 &rst
  ixpk= 266, nxpk= 10, iat= 611, 652, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  109 HIS  HA          109 HIS  HN          4.20    (#    267:10  Unique         2.86, 2.87 A)
 &rst
  ixpk= 267, nxpk= 10, iat= 654, 652, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  102 ALA  HA          106 ASP  HN          6.00    (#    268:10  Unique         3.68, 3.79 A)
 &rst
  ixpk= 268, nxpk= 10, iat= 554, 609, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  105 ILE  HA          106 ASP  HN          6.00    (#    269:10  Unique         3.61, 3.62 A)
 &rst
  ixpk= 269, nxpk= 10, iat= 592, 609, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  108 TYR  HB-         109 HIS  HN          6.00    (#    270:10  Unique         2.52, 3.29 A)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 635, 636,
 &end
#
#  108 TYR  HA          109 HIS  HN          6.00    (#    271:10  Unique         3.62, 3.63 A)
 &rst
  ixpk= 271, nxpk= 10, iat= 633, 652, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:272    109 HIS  HN          6.00    (#    272:10  Single Ambig)
 &rst
  ixpk= 272, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 674, 675, 676, 684, 685, 686, 708, 709,
 &end
#
#    0 AMB  10-2:273    106 ASP  HN          4.20    (#    273:10  Single Ambig)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 596, 597, 598, 603, 604, 605,
 &end
#
#    0 AMB  10-2:274      0 AMB  10-1:274    6.00    (#    274:10  Double Ambig)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 596, 597, 598, 713, 714, 715, 717, 718, 719,
 igr2= 652, 738,
 &end
#
#  105 ILE  HB          106 ASP  HN          4.20    (#    275:10  Unique         2.61, 2.63 A)
 &rst
  ixpk= 275, nxpk= 10, iat= 594, 609, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  114 GLU  HA          115 HIS  HN          4.20    (#    276:10  Unique         2.07, 2.70 A)
 &rst
  ixpk= 276, nxpk= 10, iat= 725, 738, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  115 HIS  HB-         115 HIS  HN          6.00    (#    277:10  Unique         2.15, 2.97 A)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 742, 743,
 &end
#
#  115 HIS  HA          115 HIS  HN          6.00    (#    278:10  Unique         2.21, 2.73 A)
 &rst
  ixpk= 278, nxpk= 10, iat= 740, 738, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   92 HIS  HB+          92 HIS  HN          4.20    (#    279:10  Unique         2.36, 2.95 A)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 395, 396,
 &end
#
#   91 GLY  HA-          92 HIS  HN          6.00    (#    280:10  Unique         3.04, 3.30 A)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 386, 387,
 &end
#
#   91 GLY  HA+          92 HIS  HN          6.00    (#    281:10  Unique         3.04, 3.30 A)
 &rst
  ixpk= 281, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 386, 387,
 &end
#
#   88 ARG  HA           92 HIS  HN          6.00    (#    282:10  Unique         3.71, 4.03 A)
 &rst
  ixpk= 282, nxpk= 10, iat= 324, 391, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   92 HIS  HA           92 HIS  HN          4.20    (#    283:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 283, nxpk= 10, iat= 393, 391, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   87 ALA  HA           92 HIS  HN          6.00    (#    285:10  Unique         3.08, 3.45 A)
 &rst
  ixpk= 285, nxpk= 10, iat= 314, 391, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   91 GLY  HN           92 HIS  HN          4.20    (#    286:10  Unique         2.53, 2.69 A)
 &rst
  ixpk= 286, nxpk= 10, iat= 384, 391, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:287     92 HIS  HN          6.00    (#    287:10  Single Ambig)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 405, 379, 380,
 &end
#
#   89 ARG  HD+          89 ARG  HN          6.00    (#    288:10  Unique         2.91, 4.35 A)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 356, 357,
 &end
#
#   86 TRP  HA           89 ARG  HN          4.20    (#    289:10  Unique         3.51, 3.61 A)
 &rst
  ixpk= 289, nxpk= 10, iat= 290, 346, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   89 ARG  HG-          89 ARG  HN          4.20    (#    290:10  Unique         2.41, 3.21 A)
 &rst
  ixpk= 290, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 353, 354,
 &end
#
#    0 AMB  10-2:291     88 ARG  HN          6.00    (#    291:10  Single Ambig)
 &rst
  ixpk= 291, nxpk= 10, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 314, 292, 293,
 &end
#
#    0 AMB  10-2:292     88 ARG  HN          6.00    (#    292:10  Single Ambig)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 251, 386, 387,
 &end
#
#   95 SER  HA           96 THR  HN          4.20    (#    293:10  Unique         2.19, 2.32 A)
 &rst
  ixpk= 293, nxpk= 10, iat= 441, 450, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#    0 AMB  10-2:294     96 THR  HN          6.00    (#    294:10  Single Ambig)
 &rst
  ixpk= 294, nxpk= 10, iat=  -1, 450, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 452, 443, 444,
 &end
#
#   96 THR  MG2          96 THR  HN          6.00    (#    295:10  Unique         2.38, 3.37 A)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1, 450, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 456, 457, 458,
 &end
#
#   89 ARG  HB+          90 ASN  HN          4.20    (#    296:10  Unique         2.73, 3.37 A)
 &rst
  ixpk= 296, nxpk= 10, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 350, 351,
 &end
#
#   90 ASN  HB+          90 ASN  HN          4.20    (#    297:10  Unique         2.34, 3.02 A)
 &rst
  ixpk= 297, nxpk= 10, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 374, 375,
 &end
#
#   87 ALA  HA           90 ASN  HN          6.00    (#    298:10  Unique         3.27, 3.47 A)
 &rst
  ixpk= 298, nxpk= 10, iat= 314, 370, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   89 ARG  HA           90 ASN  HN          4.20    (#    299:10  Unique         3.43, 3.52 A)
 &rst
  ixpk= 299, nxpk= 10, iat= 348, 370, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   90 ASN  HA           90 ASN  HN          4.20    (#    300:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 300, nxpk= 10, iat= 372, 370, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   92 HIS  HN           90 ASN  HN          6.00    (#    301:10  Unique         3.62, 3.79 A)
 &rst
  ixpk= 301, nxpk= 10, iat= 391, 370, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   88 ARG  HN           90 ASN  HN          6.00    (#    302:10  Unique         3.97, 4.17 A)
 &rst
  ixpk= 302, nxpk= 10, iat= 322, 370, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   90 ASN  HB-           0 AMB  10-1:303    4.20    (#    303:10  Single Ambig)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 374, 375,
 igr2= 379, 380, 379, 380,
 &end
#
#    0 AMB  10-2:304      0 AMB  10-1:304    4.20    (#    304:10  Double Ambig)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 350, 351, 350, 351,
 igr2= 379, 380, 379, 380,
 &end
#
#    0 AMB  10-2:305      0 AMB  10-1:305    4.20    (#    305:10  Double Ambig)
 &rst
  ixpk= 305, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 350, 351, 350, 351,
 igr2= 379, 380, 379, 380,
 &end
#
#   90 ASN  HB-           0 AMB  10-1:306    4.20    (#    306:10  Single Ambig)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 374, 375,
 igr2= 379, 380, 379, 380,
 &end
#
#    0 AMB  10-2:307      0 AMB  10-1:307    6.00    (#    307:10  Double Ambig)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 374, 375, 374, 375,
 igr2= 379, 380, 379, 380,
 &end
#
#    0 AMB  10-2:308      0 AMB  10-1:308    6.00    (#    308:10  Double Ambig)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 374, 375, 374, 375,
 igr2= 379, 380, 379, 380,
 &end
#
#   86 TRP  HA            0 AMB  10-1:309    6.00    (#    309:10  Single Ambig)
 &rst
  ixpk= 309, nxpk= 10, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 379, 380, 379, 380,
 &end
#
#   86 TRP  HA            0 AMB  10-1:310    6.00    (#    310:10  Single Ambig)
 &rst
  ixpk= 310, nxpk= 10, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 379, 380, 379, 380,
 &end
#
#    0 AMB  10-2:311      0 AMB  10-1:311    4.20    (#    311:10  Double Ambig)
 &rst
  ixpk= 311, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 370, 301,
 igr2= 379, 380, 379, 380, 379, 380,
 &end
#
#   86 TRP  HZ2           0 AMB  10-1:312    4.20    (#    312:10  Single Ambig)
 &rst
  ixpk= 312, nxpk= 10, iat= 301,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr2= 379, 380, 379, 380,
 &end
#
#    0 AMB  10-2:313     80 SER  HN          8.00    (#    313:10  Single Ambig)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 145, 212,
 &end
#
#    0 AMB  10-2:314     80 SER  HN          6.00    (#    314:10  Single Ambig)
 &rst
  ixpk= 314, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 174, 175, 189, 190,
 &end
#
#    0 AMB  10-2:315     80 SER  HN          6.00    (#    315:10  Single Ambig)
 &rst
  ixpk= 315, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 8.30, r4= 8.80,
 igr1= 214, 215, 216, 234, 224, 225, 226,
 &end
#
#   75 ILE  MG2          80 SER  HN          6.00    (#    316:10  Unique         2.48, 5.34 A)
 &rst
  ixpk= 316, nxpk= 10, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 118, 119, 120,
 &end
#
#  102 ALA  HA          103 ASP  HN          6.00    (#    317:10  Unique         3.53, 3.55 A)
 &rst
  ixpk= 317, nxpk= 10, iat= 554, 562, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:318    103 ASP  HN          4.20    (#    318:10  Single Ambig)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 545, 546, 542, 543,
 &end
#
#  101 PRO  HB+         103 ASP  HN          6.00    (#    319:10  Unique         2.83, 3.51 A)
 &rst
  ixpk= 319, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 545, 546,
 &end
#
#    0 AMB  10-2:320    103 ASP  HN          6.00    (#    320:10  Single Ambig)
 &rst
  ixpk= 320, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 580, 581, 582, 584, 585, 586, 600, 601,
 &end
#
#   93 ASN  HB+          93 ASN  HD2+        6.00    (#    321:10  Unique         2.26, 3.16 A)
 &rst
  ixpk= 321, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 413, 414,
 igr2= 418, 419,
 &end
#
#   93 ASN  HB-          93 ASN  HD2+        6.00    (#    322:10  Unique         2.26, 3.16 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 413, 414,
 igr2= 418, 419,
 &end
#
#   79 GLN  HG+          79 GLN  HE2+        6.00    (#    326:10  Unique         2.31, 3.31 A)
 &rst
  ixpk= 326, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 189, 190,
 igr2= 194, 195,
 &end
#
#   79 GLN  HG-          79 GLN  HE2+        6.00    (#    327:10  Unique         2.31, 3.31 A)
 &rst
  ixpk= 327, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 189, 190,
 igr2= 194, 195,
 &end
#
#    0 AMB  10-2:328      0 AMB  10-1:328    6.00    (#    328:10  Double Ambig)
 &rst
  ixpk= 328, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 186, 187, 171, 172,
 igr2= 194, 195, 194, 195,
 &end
#
#    0 AMB  10-2:330     86 TRP  HE1         4.20    (#    330:10  Single Ambig)
 &rst
  ixpk= 330, nxpk= 10, iat=  -1, 298, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 379, 380, 379, 380,
 &end
#
#  111 ALA  HA          112 THR  HN          4.20    (#    331:10  Unique         3.53, 3.59 A)
 &rst
  ixpk= 331, nxpk= 10, iat= 682, 690, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   70 ARG  HA           72 ARG  HN          6.00    (#    334:10  Unique         3.53, 5.27 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  42,  71, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:335     72 ARG  HN          6.00    (#    335:10  Single Ambig)
 &rst
  ixpk= 335, nxpk= 10, iat=  -1,  71, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  75,  76,  44,  45,
 &end
#
#   83 ILE  MG2          83 ILE  HN          6.00    (#    337:10  Unique         4.40, 4.58 A)
 &rst
  ixpk= 337, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 236, 237, 238,
 &end
#
#   89 ARG  HG+          88 ARG  HN          6.00    (#    338:10  Unique         4.72, 5.74 A)
 &rst
  ixpk= 338, nxpk= 10, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 353, 354,
 &end
#
#   94 VAL  MGY          94 VAL  HN          6.00    (#    339:10  Unique         2.62, 4.19 A)
 &rst
  ixpk= 339, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 429, 430, 431, 433, 434, 435,
 &end
#
#   96 THR  HB           96 THR  HN          6.00    (#    340:10  Unique         3.59, 3.64 A)
 &rst
  ixpk= 340, nxpk= 10, iat= 454, 450, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   97 ARG  HA           97 ARG  HN          6.00    (#    341:10  Unique         2.88, 2.99 A)
 &rst
  ixpk= 341, nxpk= 10, iat= 466, 464, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:342     97 ARG  HN          6.00    (#    342:10  Single Ambig)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 443, 444, 452,
 &end
#
#   97 ARG  HB-          97 ARG  HN          6.00    (#    343:10  Unique         2.41, 3.20 A)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 468, 469,
 &end
#
#   97 ARG  HG+          97 ARG  HN          6.00    (#    344:10  Unique         2.33, 3.71 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 471, 472,
 &end
#
#   97 ARG  HB+          97 ARG  HN          6.00    (#    345:10  Unique         2.41, 3.20 A)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 468, 469,
 &end
#
#    0 AMB  10-2:346    100 ILE  HN          4.20    (#    346:10  Single Ambig)
 &rst
  ixpk= 346, nxpk= 10, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 525, 526, 527, 429, 430, 431, 433, 434, 435,
 &end
#
#    0 AMB  10-2:347    105 ILE  HN          6.00    (#    347:10  Single Ambig)
 &rst
  ixpk= 347, nxpk= 10, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 613, 614, 566, 567,
 &end
#
#    0 AMB  10-2:348    114 GLU  HN          6.00    (#    348:10  Single Ambig)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 713, 714, 715, 717, 718, 719, 713, 714, 715, 717,
       718, 719,
 &end
#
#   84 ARG  HN           83 ILE  HN          2.80    (#    349:10  Unique         2.52, 2.73 A)
 &rst
  ixpk= 349, nxpk= 10, iat= 249, 230, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:350    107 ALA  HN          2.80    (#    350:10  Single Ambig)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1, 621, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 609, 631,
 &end
#
#  112 THR  HN          110 ALA  HN          6.00    (#    351:10  Unique         4.24, 4.32 A)
 &rst
  ixpk= 351, nxpk= 10, iat= 690, 670, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  113 LEU  HG          113 LEU  HN          4.20    (#    352:10  Unique         2.24, 3.67 A)
 &rst
  ixpk= 352, nxpk= 10, iat= 711, 704, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   86 TRP  HE1           0 AMB  10-1:356    6.00    (#    356:10  Single Ambig)
 &rst
  ixpk= 356, nxpk= 10, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 379, 380, 379, 380,
 &end
#
#   86 TRP  HE1           0 AMB  10-1:357    6.00    (#    357:10  Single Ambig)
 &rst
  ixpk= 357, nxpk= 10, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 379, 380, 379, 380,
 &end
#
#   93 ASN  HB+          93 ASN  HD2-        6.00    (#    358:10  Unique         2.26, 3.16 A)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 413, 414,
 igr2= 418, 419,
 &end
#
#   93 ASN  HB-          93 ASN  HD2-        6.00    (#    359:10  Unique         2.26, 3.16 A)
 &rst
  ixpk= 359, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 413, 414,
 igr2= 418, 419,
 &end
#
#   84 ARG  HB+          84 ARG  HN          2.80    (#    360:10  Unique         2.27, 2.63 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 253, 254,
 &end
#
#   78 GLU  HA           79 GLN  HN          4.20    (#    361:10  Unique         2.17, 3.35 A)
 &rst
  ixpk= 361, nxpk= 10, iat= 169, 182, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   84 ARG  HB+          85 GLU  HN          4.20    (#    362:10  Unique         2.34, 3.14 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 253, 254,
 &end
#
#  113 LEU  HG          114 GLU  HN          4.20    (#    363:10  Unique         3.34, 3.93 A)
 &rst
  ixpk= 363, nxpk= 10, iat= 711, 723, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  109 HIS  HB+         114 GLU  HN          6.00    (#    364:10  Unique         5.99, 6.77 A)
 &rst
  ixpk= 364, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 656, 657,
 &end
#
#    0 AMB  10-2:365    114 GLU  HN          6.00    (#    365:10  Single Ambig)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 694, 654,
 &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER  66           H1       SER  66  28.649 -12.197 -13.966
    2    H2   SER  66           H2       SER  66  29.800 -13.015 -13.137
    3    H3   SER  66           H3       SER  66  28.223 -13.434 -12.980
    4    HA   SER  66           HA       SER  66  28.925 -12.257 -11.032
    5    HB2  SER  66           HB2      SER  66  29.575  -9.960 -12.931
    6    HB3  SER  66           HB3      SER  66  29.712  -9.947 -11.166
    7    HG   SER  66           HG       SER  66  31.727 -10.410 -12.173
    8    H    GLY  67           H        GLY  67  27.507 -10.845  -9.855
    9    HA2  GLY  67           HA2      GLY  67  25.560  -9.676  -9.407
   10    HA3  GLY  67           HA3      GLY  67  25.321  -9.400 -11.125
   11    H    SER  68           H        SER  68  23.067  -9.728 -10.122
   12    HA   SER  68           HA       SER  68  22.131 -12.349  -9.437
   13    HB2  SER  68           HB2      SER  68  20.531  -9.966 -10.433
   14    HB3  SER  68           HB3      SER  68  19.903 -11.361  -9.538
   15    HG   SER  68           HG       SER  68  21.197 -10.714  -7.750
   16    H    GLY  69           H        GLY  69  20.817 -13.808 -10.561
   17    HA2  GLY  69           HA2      GLY  69  19.944 -13.543 -13.291
   18    HA3  GLY  69           HA3      GLY  69  21.469 -14.436 -13.219
   19    H    ARG  70           H        ARG  70  20.038 -16.104 -14.207
   20    HA   ARG  70           HA       ARG  70  17.920 -17.343 -12.755
   21    HB2  ARG  70           HB2      ARG  70  17.954 -19.047 -14.441
   22    HB3  ARG  70           HB3      ARG  70  18.197 -17.472 -15.187
   23    HG2  ARG  70           HG2      ARG  70  20.662 -17.950 -15.332
   24    HG3  ARG  70           HG3      ARG  70  20.376 -19.555 -14.640
   25    HD2  ARG  70           HD2      ARG  70  19.164 -18.500 -17.233
   26    HD3  ARG  70           HD3      ARG  70  20.585 -19.532 -17.144
   27    HE   ARG  70           HE       ARG  70  17.775 -20.311 -16.771
   28   HH11  ARG  70          HH11      ARG  70  21.090 -21.415 -16.323
   29   HH12  ARG  70          HH12      ARG  70  20.606 -23.083 -16.233
   30   HH21  ARG  70          HH21      ARG  70  17.250 -22.453 -16.632
   31   HH22  ARG  70          HH22      ARG  70  18.485 -23.651 -16.392
   32    H    GLY  71           H        GLY  71  21.309 -17.752 -12.287
   33    HA2  GLY  71           HA2      GLY  71  21.445 -20.337 -11.128
   34    HA3  GLY  71           HA3      GLY  71  22.533 -18.983 -10.793
   35    H    ARG  72           H        ARG  72  19.913 -17.508  -9.810
   36    HA   ARG  72           HA       ARG  72  20.031 -18.128  -6.983
   37    HB2  ARG  72           HB2      ARG  72  17.962 -16.654  -8.663
   38    HB3  ARG  72           HB3      ARG  72  17.961 -16.700  -6.901
   39    HG2  ARG  72           HG2      ARG  72  20.116 -15.582  -6.772
   40    HG3  ARG  72           HG3      ARG  72  20.290 -15.578  -8.526
   41    HD2  ARG  72           HD2      ARG  72  18.063 -14.174  -7.001
   42    HD3  ARG  72           HD3      ARG  72  19.538 -13.396  -7.607
   43    HE   ARG  72           HE       ARG  72  18.413 -14.682  -9.833
   44   HH11  ARG  72          HH11      ARG  72  17.386 -12.098  -7.696
   45   HH12  ARG  72          HH12      ARG  72  16.341 -11.387  -8.894
   46   HH21  ARG  72          HH21      ARG  72  17.007 -13.763 -11.296
   47   HH22  ARG  72          HH22      ARG  72  16.144 -12.309 -10.889
   48    H    GLY  73           H        GLY  73  18.196 -19.574  -9.584
   49    HA2  GLY  73           HA2      GLY  73  16.929 -21.479  -9.628
   50    HA3  GLY  73           HA3      GLY  73  17.298 -21.744  -7.925
   51    H    ALA  74           H        ALA  74  15.789 -18.696  -8.446
   52    HA   ALA  74           HA       ALA  74  13.382 -19.532  -7.044
   53    HB1  ALA  74           HB1      ALA  74  14.489 -17.372  -6.595
   54    HB2  ALA  74           HB2      ALA  74  14.149 -16.845  -8.259
   55    HB3  ALA  74           HB3      ALA  74  12.816 -17.149  -7.125
   56    H    ILE  75           H        ILE  75  11.283 -19.500  -7.706
   57    HA   ILE  75           HA       ILE  75  10.796 -19.816 -10.633
   58    HB   ILE  75           HB       ILE  75   9.383 -21.013  -8.236
   59   HG12  ILE  75          HG11      ILE  75  11.529 -22.085  -8.507
   60   HG13  ILE  75          HG12      ILE  75  10.235 -23.172  -8.947
   61   HG21  ILE  75          HG21      ILE  75   8.192 -22.467  -9.882
   62   HG22  ILE  75          HG22      ILE  75   7.718 -20.778  -9.950
   63   HG23  ILE  75          HG23      ILE  75   8.813 -21.438 -11.190
   64   HD11  ILE  75          HD11      ILE  75  12.046 -21.698 -10.911
   65   HD12  ILE  75          HD12      ILE  75  12.120 -23.407 -10.476
   66   HD13  ILE  75          HD13      ILE  75  10.721 -22.799 -11.364
   67    H    ASP  76           H        ASP  76   8.830 -19.018 -11.534
   68    HA   ASP  76           HA       ASP  76   8.091 -16.374 -10.468
   69    HB2  ASP  76           HB2      ASP  76   8.699 -16.686 -12.821
   70    HB3  ASP  76           HB3      ASP  76   7.345 -17.788 -13.054
   71    H    ARG  77           H        ARG  77   6.382 -19.397 -11.291
   72    HA   ARG  77           HA       ARG  77   3.947 -18.548  -9.775
   73    HB2  ARG  77           HB2      ARG  77   4.355 -20.861 -11.715
   74    HB3  ARG  77           HB3      ARG  77   2.844 -20.444 -10.888
   75    HG2  ARG  77           HG2      ARG  77   2.877 -18.200 -11.993
   76    HG3  ARG  77           HG3      ARG  77   4.326 -18.692 -12.895
   77    HD2  ARG  77           HD2      ARG  77   3.069 -20.561 -13.906
   78    HD3  ARG  77           HD3      ARG  77   1.612 -20.050 -13.021
   79    HE   ARG  77           HE       ARG  77   2.626 -17.827 -14.494
   80   HH11  ARG  77          HH21      ARG  77   0.992 -20.852 -15.178
   81   HH12  ARG  77          HH22      ARG  77   0.309 -20.251 -16.665
   82   HH21  ARG  77          HH11      ARG  77   1.710 -17.120 -16.381
   83   HH22  ARG  77          HH12      ARG  77   0.704 -18.177 -17.321
   84    H    GLU  78           H        GLU  78   6.130 -18.930  -8.267
   85    HA   GLU  78           HA       GLU  78   6.754 -21.538  -7.394
   86    HB2  GLU  78           HB2      GLU  78   8.063 -19.428  -7.249
   87    HB3  GLU  78           HB3      GLU  78   7.077 -18.924  -5.879
   88    HG2  GLU  78           HG2      GLU  78   7.928 -20.791  -4.543
   89    HG3  GLU  78           HG3      GLU  78   8.731 -21.488  -5.955
   90    H    GLN  79           H        GLN  79   3.936 -19.735  -6.514
   91    HA   GLN  79           HA       GLN  79   3.316 -20.991  -3.998
   92    HB2  GLN  79           HB2      GLN  79   1.492 -19.957  -6.209
   93    HB3  GLN  79           HB3      GLN  79   0.948 -20.415  -4.602
   94    HG2  GLN  79           HG2      GLN  79   2.911 -18.151  -5.203
   95    HG3  GLN  79           HG3      GLN  79   1.194 -17.963  -4.899
   96   HE21  GLN  79          HE22      GLN  79   2.864 -16.501  -3.316
   97   HE22  GLN  79          HE21      GLN  79   2.908 -17.200  -1.702
   98    H    SER  80           H        SER  80   3.564 -22.410  -7.156
   99    HA   SER  80           HA       SER  80   1.781 -24.598  -7.027
  100    HB2  SER  80           HB2      SER  80   3.473 -25.771  -8.393
  101    HB3  SER  80           HB3      SER  80   3.203 -24.110  -8.964
  102    HG   SER  80           HG       SER  80   5.450 -24.618  -8.836
  103    H    ALA  81           H        ALA  81   5.048 -24.310  -5.508
  104    HA   ALA  81           HA       ALA  81   5.066 -26.820  -4.283
  105    HB1  ALA  81           HB1      ALA  81   6.857 -25.845  -2.874
  106    HB2  ALA  81           HB2      ALA  81   7.040 -25.389  -4.580
  107    HB3  ALA  81           HB3      ALA  81   6.391 -24.216  -3.409
  108    H    ALA  82           H        ALA  82   3.651 -23.755  -3.101
  109    HA   ALA  82           HA       ALA  82   2.957 -24.740  -0.470
  110    HB1  ALA  82           HB1      ALA  82   3.239 -22.344  -0.978
  111    HB2  ALA  82           HB2      ALA  82   1.852 -22.394  -2.083
  112    HB3  ALA  82           HB3      ALA  82   1.616 -22.684  -0.351
  113    H    ILE  83           H        ILE  83   1.177 -24.580  -3.597
  114    HA   ILE  83           HA       ILE  83  -1.255 -25.748  -2.558
  115    HB   ILE  83           HB       ILE  83  -0.187 -25.597  -5.405
  116   HG12  ILE  83          HG12      ILE  83  -2.239 -23.934  -3.879
  117   HG13  ILE  83          HG13      ILE  83  -0.622 -23.403  -4.268
  118   HG21  ILE  83          HG21      ILE  83  -1.866 -27.437  -5.190
  119   HG22  ILE  83          HG22      ILE  83  -3.000 -26.305  -4.420
  120   HG23  ILE  83          HG23      ILE  83  -2.509 -26.096  -6.117
  121   HD11  ILE  83          HD11      ILE  83  -1.186 -23.622  -6.722
  122   HD12  ILE  83          HD12      ILE  83  -2.883 -23.879  -6.230
  123   HD13  ILE  83          HD13      ILE  83  -2.069 -22.365  -5.832
  124    H    ARG  84           H        ARG  84   1.655 -27.217  -4.070
  125    HA   ARG  84           HA       ARG  84   0.819 -29.958  -3.931
  126    HB2  ARG  84           HB2      ARG  84   2.833 -29.097  -5.157
  127    HB3  ARG  84           HB3      ARG  84   3.604 -28.745  -3.619
  128    HG2  ARG  84           HG2      ARG  84   3.468 -31.248  -3.079
  129    HG3  ARG  84           HG3      ARG  84   2.857 -31.481  -4.721
  130    HD2  ARG  84           HD2      ARG  84   5.228 -31.935  -4.696
  131    HD3  ARG  84           HD3      ARG  84   4.960 -30.439  -5.608
  132    HE   ARG  84           HE       ARG  84   5.514 -29.969  -2.777
  133   HH11  ARG  84          H111      ARG  84   7.279 -30.782  -5.704
  134   HH12  ARG  84          HH12      ARG  84   8.661 -29.838  -5.215
  135   HH21  ARG  84          HH21      ARG  84   7.352 -28.863  -2.197
  136   HH22  ARG  84          HH22      ARG  84   8.722 -28.852  -3.263
  137    H    GLU  85           H        GLU  85   2.633 -28.031  -1.464
  138    HA   GLU  85           HA       GLU  85   2.640 -30.029   0.472
  139    HB2  GLU  85           HB2      GLU  85   3.985 -27.890   0.455
  140    HB3  GLU  85           HB3      GLU  85   2.544 -27.052   1.064
  141    HG2  GLU  85           HG2      GLU  85   2.504 -28.698   2.986
  142    HG3  GLU  85           HG3      GLU  85   4.017 -29.380   2.388
  143    H    TRP  86           H        TRP  86   0.202 -27.367   0.062
  144    HA   TRP  86           HA       TRP  86  -1.523 -28.088   2.106
  145    HB2  TRP  86           HB2      TRP  86  -1.778 -26.022   0.910
  146    HB3  TRP  86           HB3      TRP  86  -2.053 -26.857  -0.612
  147    HD1  TRP  86           HD1      TRP  86  -3.815 -25.907   2.623
  148    HE1  TRP  86           HE1      TRP  86  -6.343 -26.327   2.403
  149    HE3  TRP  86           HE3      TRP  86  -3.876 -28.158  -1.982
  150    HZ2  TRP  86           HZ2      TRP  86  -8.120 -27.690   0.580
  151    HZ3  TRP  86           HZ3      TRP  86  -6.015 -28.978  -2.949
  152    HH2  TRP  86           HH2      TRP  86  -8.131 -28.783  -1.651
  153    H    ALA  87           H        ALA  87  -1.522 -29.328  -1.278
  154    HA   ALA  87           HA       ALA  87  -3.736 -31.084  -0.976
  155    HB1  ALA  87           HB1      ALA  87  -1.315 -31.150  -2.836
  156    HB2  ALA  87           HB2      ALA  87  -2.759 -32.172  -3.024
  157    HB3  ALA  87           HB3      ALA  87  -2.894 -30.404  -3.147
  158    H    ARG  88           H        ARG  88  -0.220 -31.711  -0.466
  159    HA   ARG  88           HA       ARG  88  -0.480 -34.446   0.353
  160    HB2  ARG  88           HB2      ARG  88   1.632 -33.356  -0.322
  161    HB3  ARG  88           HB3      ARG  88   1.607 -32.360   1.136
  162    HG2  ARG  88           HG2      ARG  88   1.765 -34.382   2.555
  163    HG3  ARG  88           HG3      ARG  88   1.731 -35.418   1.119
  164    HD2  ARG  88           HD2      ARG  88   3.861 -33.309   1.678
  165    HD3  ARG  88           HD3      ARG  88   4.004 -35.012   2.139
  166    HE   ARG  88           HE       ARG  88   3.406 -35.016  -0.606
  167   HH11  ARG  88          HH11      ARG  88   6.080 -33.932   1.390
  168   HH12  ARG  88          HH12      ARG  88   7.255 -34.197   0.133
  169   HH21  ARG  88          HH21      ARG  88   4.965 -35.365  -2.162
  170   HH22  ARG  88          HH22      ARG  88   6.626 -34.991  -1.828
  171    H    ARG  89           H        ARG  89  -0.492 -31.467   2.350
  172    HA   ARG  89           HA       ARG  89  -0.892 -32.704   4.908
  173    HB2  ARG  89           HB2      ARG  89  -1.666 -29.970   3.797
  174    HB3  ARG  89           HB3      ARG  89  -1.954 -30.425   5.475
  175    HG2  ARG  89           HG2      ARG  89   0.430 -30.775   5.874
  176    HG3  ARG  89           HG3      ARG  89   0.811 -30.428   4.181
  177    HD2  ARG  89           HD2      ARG  89  -0.148 -28.152   4.432
  178    HD3  ARG  89           HD3      ARG  89  -0.518 -28.471   6.123
  179    HE   ARG  89           HE       ARG  89   2.088 -27.804   4.940
  180   HH11  ARG  89          HH11      ARG  89   0.684 -29.213   7.861
  181   HH12  ARG  89          HH12      ARG  89   2.123 -28.856   8.773
  182   HH21  ARG  89          HH21      ARG  89   3.730 -27.384   6.075
  183   HH22  ARG  89          HH22      ARG  89   3.862 -27.814   7.784
  184    H    ASN  90           H        ASN  90  -3.253 -31.929   2.393
  185    HA   ASN  90           HA       ASN  90  -5.499 -32.866   4.094
  186    HB2  ASN  90           HB2      ASN  90  -5.351 -31.510   1.371
  187    HB3  ASN  90           HB3      ASN  90  -6.842 -32.140   2.063
  188   HD21  ASN  90          HD22      ASN  90  -4.349 -29.660   2.481
  189   HD22  ASN  90          HD21      ASN  90  -5.304 -28.704   3.608
  190    H    GLY  91           H        GLY  91  -3.250 -34.556   2.386
  191    HA2  GLY  91           HA2      GLY  91  -3.165 -36.733   1.693
  192    HA3  GLY  91           HA3      GLY  91  -4.802 -36.965   2.310
  193    H    HIS  92           H        HIS  92  -4.276 -34.523  -0.148
  194    HA   HIS  92           HA       HIS  92  -5.991 -36.013  -2.063
  195    HB2  HIS  92           HB2      HIS  92  -4.912 -33.169  -2.160
  196    HB3  HIS  92           HB3      HIS  92  -6.091 -33.865  -3.268
  197    HD1  HIS  92           HD1      HIS  92  -7.778 -35.225  -0.621
  198    HD2  HIS  92           HD2      HIS  92  -6.714 -31.242  -1.554
  199    HE1  HIS  92           HE1      HIS  92  -9.477 -33.722   0.584
  200    HE2  HIS  92           HE2      HIS  92  -8.838 -31.293   0.004
  201    H    ASN  93           H        ASN  93  -5.431 -36.406  -4.225
  202    HA   ASN  93           HA       ASN  93  -2.710 -37.272  -4.662
  203    HB2  ASN  93           HB2      ASN  93  -4.745 -38.399  -5.563
  204    HB3  ASN  93           HB3      ASN  93  -5.048 -37.007  -6.606
  205   HD21  ASN  93          HD22      ASN  93  -4.983 -38.933  -8.196
  206   HD22  ASN  93          HD21      ASN  93  -3.400 -39.288  -8.871
  207    H    VAL  94           H        VAL  94  -1.014 -36.181  -5.466
  208    HA   VAL  94           HA       VAL  94  -1.279 -34.054  -7.436
  209    HB   VAL  94           HB       VAL  94  -1.578 -32.864  -5.251
  210   HG11  VAL  94          HG11      VAL  94   1.334 -33.581  -4.714
  211   HG12  VAL  94          HG12      VAL  94   0.333 -32.471  -3.773
  212   HG13  VAL  94          HG13      VAL  94  -0.072 -34.193  -3.814
  213   HG21  VAL  94          HG21      VAL  94  -0.682 -31.748  -7.293
  214   HG22  VAL  94          HG22      VAL  94  -0.174 -31.010  -5.771
  215   HG23  VAL  94          HG23      VAL  94   0.967 -32.020  -6.677
  216    H    SER  95           H        SER  95   0.650 -33.704  -8.623
  217    HA   SER  95           HA       SER  95   2.587 -35.874  -8.526
  218    HB2  SER  95           HB2      SER  95   1.807 -34.745 -10.634
  219    HB3  SER  95           HB3      SER  95   2.759 -33.321 -10.157
  220    HG   SER  95           HG       SER  95   3.950 -34.762 -11.518
  221    H    THR  96           H        THR  96   4.912 -35.621  -8.287
  222    HA   THR  96           HA       THR  96   5.650 -34.029  -5.958
  223    HB   THR  96           HB       THR  96   7.921 -35.008  -6.369
  224    HG1  THR  96           HG1      THR  96   8.044 -36.630  -7.975
  225   HG21  THR  96          HG21      THR  96   6.239 -36.185  -4.955
  226   HG22  THR  96          HG22      THR  96   5.659 -37.056  -6.390
  227   HG23  THR  96          HG23      THR  96   7.316 -37.309  -5.803
  228    H    ARG  97           H        ARG  97   6.154 -33.754  -9.437
  229    HA   ARG  97           HA       ARG  97   7.394 -31.047  -9.134
  230    HB2  ARG  97           HB2      ARG  97   8.417 -33.340 -10.879
  231    HB3  ARG  97           HB3      ARG  97   8.993 -31.673 -10.969
  232    HG2  ARG  97           HG2      ARG  97   9.768 -31.805  -8.602
  233    HG3  ARG  97           HG3      ARG  97   9.273 -33.511  -8.552
  234    HD2  ARG  97           HD2      ARG  97  10.806 -34.008 -10.434
  235    HD3  ARG  97           HD3      ARG  97  11.329 -32.309 -10.451
  236    HE   ARG  97           HE       ARG  97  11.685 -33.284  -7.813
  237   HH11  ARG  97          HH11      ARG  97  13.111 -33.885 -10.960
  238   HH12  ARG  97          HH12      ARG  97  14.637 -34.382 -10.278
  239   HH21  ARG  97          HH21      ARG  97  13.656 -33.949  -7.009
  240   HH22  ARG  97          HH22      ARG  97  14.928 -34.416  -8.097
  241    H    GLY  98           H        GLY  98   7.404 -29.821 -11.172
  242    HA2  GLY  98           HA2      GLY  98   6.463 -29.018 -13.139
  243    HA3  GLY  98           HA3      GLY  98   5.730 -30.594 -13.404
  244    H    ARG  99           H        ARG  99   3.799 -29.694 -14.126
  245    HA   ARG  99           HA       ARG  99   2.341 -27.641 -12.689
  246    HB2  ARG  99           HB2      ARG  99   1.531 -29.449 -15.012
  247    HB3  ARG  99           HB3      ARG  99   0.556 -28.114 -14.397
  248    HG2  ARG  99           HG2      ARG  99   2.415 -26.523 -14.874
  249    HG3  ARG  99           HG3      ARG  99   3.353 -27.840 -15.591
  250    HD2  ARG  99           HD2      ARG  99   0.624 -26.883 -16.552
  251    HD3  ARG  99           HD3      ARG  99   2.154 -26.426 -17.277
  252    HE   ARG  99           HE       ARG  99   0.739 -28.990 -17.531
  253   HH11  ARG  99          HH21      ARG  99   3.826 -27.412 -18.110
  254   HH12  ARG  99          HH22      ARG  99   4.323 -28.619 -19.264
  255   HH21  ARG  99          HH11      ARG  99   1.446 -30.491 -19.002
  256   HH22  ARG  99          HH12      ARG  99   2.997 -30.304 -19.767
  257    H    ILE 100           H        ILE 100   0.254 -27.737 -11.868
  258    HA   ILE 100           HA       ILE 100  -0.509 -30.267 -10.467
  259    HB   ILE 100           HB       ILE 100  -0.788 -27.371  -9.635
  260   HG12  ILE 100          HG11      ILE 100   0.718 -29.772  -8.491
  261   HG13  ILE 100          HG12      ILE 100   1.428 -28.371  -9.285
  262   HG21  ILE 100          HG21      ILE 100  -1.935 -28.096  -7.615
  263   HG22  ILE 100          HG22      ILE 100  -2.875 -28.605  -8.994
  264   HG23  ILE 100          HG23      ILE 100  -1.868 -29.792  -8.122
  265   HD11  ILE 100          HD11      ILE 100   0.074 -28.434  -6.577
  266   HD12  ILE 100          HD12      ILE 100   1.770 -28.102  -6.968
  267   HD13  ILE 100          HD13      ILE 100   0.522 -26.924  -7.429
  268    HA   PRO 101           HA       PRO 101  -4.195 -30.080 -12.987
  269    HB2  PRO 101           HB2      PRO 101  -5.756 -31.299 -10.753
  270    HB3  PRO 101           HB3      PRO 101  -5.528 -31.887 -12.421
  271    HG2  PRO 101           HG2      PRO 101  -4.269 -33.051 -10.288
  272    HG3  PRO 101           HG3      PRO 101  -3.455 -32.888 -11.881
  273    HD2  PRO 101           HD2      PRO 101  -3.149 -31.161  -9.424
  274    HD3  PRO 101           HD3      PRO 101  -1.897 -31.809 -10.525
  275    H    ALA 102           H        ALA 102  -5.767 -28.550 -13.354
  276    HA   ALA 102           HA       ALA 102  -6.045 -26.354 -11.661
  277    HB1  ALA 102           HB1      ALA 102  -7.767 -25.612 -13.170
  278    HB2  ALA 102           HB2      ALA 102  -6.423 -26.335 -14.081
  279    HB3  ALA 102           HB3      ALA 102  -7.939 -27.254 -13.843
  280    H    ASP 103           H        ASP 103  -8.058 -29.286 -11.757
  281    HA   ASP 103           HA       ASP 103 -10.134 -28.460 -10.116
  282    HB2  ASP 103           HB2      ASP 103  -8.790 -31.177 -10.362
  283    HB3  ASP 103           HB3      ASP 103 -10.313 -30.897  -9.520
  284    H    VAL 104           H        VAL 104  -6.834 -29.482  -9.202
  285    HA   VAL 104           HA       VAL 104  -7.403 -29.508  -6.365
  286    HB   VAL 104           HB       VAL 104  -4.728 -29.625  -7.719
  287   HG11  VAL 104          HG11      VAL 104  -4.533 -29.102  -5.324
  288   HG12  VAL 104          HG12      VAL 104  -5.571 -30.492  -4.930
  289   HG13  VAL 104          HG13      VAL 104  -3.964 -30.739  -5.650
  290   HG21  VAL 104          HG21      VAL 104  -6.092 -31.547  -8.496
  291   HG22  VAL 104          HG22      VAL 104  -4.828 -32.088  -7.396
  292   HG23  VAL 104          HG23      VAL 104  -6.499 -31.936  -6.812
  293    H    ILE 105           H        ILE 105  -5.895 -27.280  -8.715
  294    HA   ILE 105           HA       ILE 105  -5.147 -25.235  -6.819
  295    HB   ILE 105           HB       ILE 105  -5.888 -25.203  -9.766
  296   HG12  ILE 105          HG11      ILE 105  -3.150 -24.561  -8.623
  297   HG13  ILE 105          HG12      ILE 105  -3.650 -26.245  -8.603
  298   HG21  ILE 105          HG21      ILE 105  -6.387 -22.964  -8.981
  299   HG22  ILE 105          HG22      ILE 105  -4.869 -22.890  -8.053
  300   HG23  ILE 105          HG23      ILE 105  -4.843 -22.917  -9.833
  301   HD11  ILE 105          HD11      ILE 105  -3.631 -24.537 -11.115
  302   HD12  ILE 105          HD12      ILE 105  -2.360 -25.678 -10.626
  303   HD13  ILE 105          HD13      ILE 105  -3.988 -26.280 -10.972
  304    H    ASP 106           H        ASP 106  -8.224 -25.735  -8.658
  305    HA   ASP 106           HA       ASP 106  -9.687 -23.709  -7.436
  306    HB2  ASP 106           HB2      ASP 106 -10.402 -24.926  -9.439
  307    HB3  ASP 106           HB3      ASP 106 -10.633 -26.393  -8.488
  308    H    ALA 107           H        ALA 107  -9.343 -27.167  -6.383
  309    HA   ALA 107           HA       ALA 107 -10.863 -27.068  -4.097
  310    HB1  ALA 107           HB1      ALA 107  -8.264 -28.622  -4.530
  311    HB2  ALA 107           HB2      ALA 107  -9.563 -29.022  -3.391
  312    HB3  ALA 107           HB3      ALA 107  -9.864 -29.105  -5.127
  313    H    TYR 108           H        TYR 108  -7.400 -26.187  -4.416
  314    HA   TYR 108           HA       TYR 108  -6.943 -25.390  -1.711
  315    HB2  TYR 108           HB2      TYR 108  -5.094 -25.811  -3.125
  316    HB3  TYR 108           HB3      TYR 108  -5.664 -24.724  -4.372
  317    HD1  TYR 108           HD2      TYR 108  -4.382 -24.777  -0.853
  318    HD2  TYR 108           HD1      TYR 108  -4.974 -22.468  -4.448
  319    HE1  TYR 108           HE2      TYR 108  -2.975 -22.951   0.093
  320    HE2  TYR 108           HE1      TYR 108  -3.584 -20.630  -3.488
  321    HH   TYR 108           HH       TYR 108  -2.328 -19.911  -1.694
  322    H    HIS 109           H        HIS 109  -7.932 -23.391  -4.578
  323    HA   HIS 109           HA       HIS 109  -8.241 -20.950  -3.119
  324    HB2  HIS 109           HB2      HIS 109  -9.717 -21.919  -5.601
  325    HB3  HIS 109           HB3      HIS 109  -9.756 -20.277  -4.978
  326    HD1  HIS 109           HD1      HIS 109  -8.626 -20.943  -7.888
  327    HD2  HIS 109           HD2      HIS 109  -6.434 -20.253  -4.347
  328    HE1  HIS 109           HE1      HIS 109  -6.297 -20.114  -8.622
  329    HE2  HIS 109           HE2      HIS 109  -4.974 -19.682  -6.454
  330    H    ALA 110           H        ALA 110 -10.653 -23.586  -3.592
  331    HA   ALA 110           HA       ALA 110 -12.767 -22.257  -2.253
  332    HB1  ALA 110           HB1      ALA 110 -13.056 -24.291  -3.617
  333    HB2  ALA 110           HB2      ALA 110 -12.155 -25.244  -2.417
  334    HB3  ALA 110           HB3      ALA 110 -13.717 -24.517  -1.985
  335    H    ALA 111           H        ALA 111 -10.152 -24.367  -0.879
  336    HA   ALA 111           HA       ALA 111 -11.033 -24.226   1.759
  337    HB1  ALA 111           HB1      ALA 111  -8.216 -24.603   0.675
  338    HB2  ALA 111           HB2      ALA 111  -8.769 -25.022   2.310
  339    HB3  ALA 111           HB3      ALA 111  -9.450 -25.870   0.908
  340    H    THR 112           H        THR 112  -8.770 -22.042  -0.006
  341    HA   THR 112           HA       THR 112  -8.254 -20.417   2.364
  342    HB   THR 112           HB       THR 112  -7.073 -18.890   0.862
  343    HG1  THR 112           HG1      THR 112  -6.932 -19.342  -1.305
  344   HG21  THR 112          HG21      THR 112  -5.291 -20.399   0.177
  345   HG22  THR 112          HG22      THR 112  -5.910 -20.891   1.759
  346   HG23  THR 112          HG23      THR 112  -6.366 -21.802   0.304
  347    H    LEU 113           H        LEU 113 -10.704 -20.153  -0.198
  348    HA   LEU 113           HA       LEU 113 -11.441 -17.462   0.696
  349    HB2  LEU 113           HB2      LEU 113 -11.225 -17.996  -1.676
  350    HB3  LEU 113           HB3      LEU 113 -12.425 -19.285  -1.519
  351    HG   LEU 113           HG       LEU 113 -14.164 -17.677  -0.982
  352   HD11  LEU 113          HD11      LEU 113 -12.904 -15.827   0.042
  353   HD12  LEU 113          HD12      LEU 113 -12.024 -15.550  -1.477
  354   HD13  LEU 113          HD13      LEU 113 -13.770 -15.232  -1.370
  355   HD21  LEU 113          HD21      LEU 113 -13.751 -18.327  -3.330
  356   HD22  LEU 113          HD22      LEU 113 -14.343 -16.661  -3.228
  357   HD23  LEU 113          HD23      LEU 113 -12.618 -16.969  -3.518
  358    H    GLU 114           H        GLU 114 -12.996 -20.700   0.629
  359    HA   GLU 114           HA       GLU 114 -15.448 -19.527   1.696
  360    HB2  GLU 114           HB2      GLU 114 -14.882 -22.425   1.091
  361    HB3  GLU 114           HB3      GLU 114 -16.444 -21.706   1.473
  362    HG2  GLU 114           HG2      GLU 114 -14.746 -21.073  -0.974
  363    HG3  GLU 114           HG3      GLU 114 -16.173 -22.100  -0.930
  364    H    HIS 115           H        HIS 115 -12.785 -21.174   3.250
  365    HA   HIS 115           HA       HIS 115 -14.187 -22.271   5.458
  366    HB2  HIS 115           HB2      HIS 115 -11.866 -22.804   4.703
  367    HB3  HIS 115           HB3      HIS 115 -11.302 -21.282   5.382
  368    HD1  HIS 115           HD1      HIS 115 -12.583 -24.755   6.441
  369    HD2  HIS 115           HD2      HIS 115 -10.907 -21.223   8.042
  370    HE1  HIS 115           HE1      HIS 115 -11.895 -25.308   8.862
  371    HE2  HIS 115           HE2      HIS 115 -10.884 -23.144   9.834
  372    H    HIS 116           H        HIS 116 -13.479 -18.948   4.889
  373    HA   HIS 116           HA       HIS 116 -14.605 -18.191   7.568
  374    HB2  HIS 116           HB2      HIS 116 -13.386 -16.042   7.309
  375    HB3  HIS 116           HB3      HIS 116 -12.345 -17.442   7.434
  376    HD1  HIS 116           HD1      HIS 116 -13.471 -14.860   4.794
  377    HD2  HIS 116           HD2      HIS 116 -10.761 -18.044   5.388
  378    HE1  HIS 116           HE1      HIS 116 -11.879 -14.851   2.762
  379    HE2  HIS 116           HE2      HIS 116 -10.248 -16.837   3.120
  380    H    HIS 117           H        HIS 117 -16.094 -18.973   5.148
  381    HA   HIS 117           HA       HIS 117 -17.890 -16.590   4.932
  382    HB2  HIS 117           HB2      HIS 117 -16.344 -16.486   3.010
  383    HB3  HIS 117           HB3      HIS 117 -16.741 -18.153   2.580
  384    HD1  HIS 117           HD1      HIS 117 -18.317 -18.216   0.576
  385    HD2  HIS 117           HD2      HIS 117 -18.913 -14.902   3.144
  386    HE1  HIS 117           HE1      HIS 117 -20.268 -16.840  -0.431
  387    HE2  HIS 117           HE2      HIS 117 -20.614 -14.823   1.141
  388    H    HIS 118           H        HIS 118 -17.566 -20.072   4.056
  389    HA   HIS 118           HA       HIS 118 -20.502 -20.441   4.550
  390    HB2  HIS 118           HB2      HIS 118 -19.630 -20.364   2.119
  391    HB3  HIS 118           HB3      HIS 118 -18.899 -21.926   2.442
  392    HD1  HIS 118           HD1      HIS 118 -20.846 -23.874   3.230
  393    HD2  HIS 118           HD2      HIS 118 -22.114 -20.302   1.375
  394    HE1  HIS 118           HE1      HIS 118 -23.234 -24.322   2.340
  395    HE2  HIS 118           HE2      HIS 118 -23.996 -22.131   1.217
  396    H    HIS 119           H        HIS 119 -18.530 -20.756   6.543
  397    HA   HIS 119           HA       HIS 119 -18.859 -23.597   7.328
  398    HB2  HIS 119           HB2      HIS 119 -16.745 -23.617   6.091
  399    HB3  HIS 119           HB3      HIS 119 -16.172 -22.203   6.965
  400    HD1  HIS 119           HD1      HIS 119 -16.869 -25.965   7.600
  401    HD2  HIS 119           HD2      HIS 119 -14.984 -22.580   9.300
  402    HE1  HIS 119           HE1      HIS 119 -15.597 -26.804   9.679
  403    HE2  HIS 119           HE2      HIS 119 -14.459 -24.733  10.715
  404    H    HIS 120           H        HIS 120 -18.562 -23.961   9.571
  405    HA   HIS 120           HA       HIS 120 -18.034 -21.713  11.390
  406    HB2  HIS 120           HB2      HIS 120 -20.081 -22.172  12.726
  407    HB3  HIS 120           HB3      HIS 120 -20.385 -21.436  11.162
  408    HD1  HIS 120           HD1      HIS 120 -19.955 -25.232  11.694
  409    HD2  HIS 120           HD2      HIS 120 -22.847 -22.300  10.774
  410    HE1  HIS 120           HE1      HIS 120 -22.128 -26.517  11.055
  411    HE2  HIS 120           HE2      HIS 120 -23.877 -24.706  10.480
  Start of MODEL    2
    1    H1   SER  66           H1       SER  66  20.503 -16.206 -29.083
    2    H2   SER  66           H2       SER  66  19.414 -16.772 -28.004
    3    H3   SER  66           H3       SER  66  19.042 -15.486 -28.957
    4    HA   SER  66           HA       SER  66  21.149 -15.513 -26.897
    5    HB2  SER  66           HB2      SER  66  21.193 -13.025 -27.262
    6    HB3  SER  66           HB3      SER  66  21.818 -13.994 -28.604
    7    HG   SER  66           HG       SER  66  20.399 -12.365 -29.360
    8    H    GLY  67           H        GLY  67  18.326 -13.353 -27.503
    9    HA2  GLY  67           HA2      GLY  67  16.448 -12.912 -26.205
   10    HA3  GLY  67           HA3      GLY  67  16.834 -14.284 -25.171
   11    H    SER  68           H        SER  68  15.962 -12.611 -23.620
   12    HA   SER  68           HA       SER  68  18.179 -11.212 -22.251
   13    HB2  SER  68           HB2      SER  68  16.837  -9.160 -21.986
   14    HB3  SER  68           HB3      SER  68  17.255  -9.485 -23.676
   15    HG   SER  68           HG       SER  68  15.053  -8.868 -23.438
   16    H    GLY  69           H        GLY  69  17.666 -10.561 -20.056
   17    HA2  GLY  69           HA2      GLY  69  16.204 -12.593 -18.587
   18    HA3  GLY  69           HA3      GLY  69  17.070 -11.211 -17.920
   19    H    ARG  70           H        ARG  70  14.795 -11.979 -16.725
   20    HA   ARG  70           HA       ARG  70  12.413 -10.673 -17.727
   21    HB2  ARG  70           HB2      ARG  70  12.388 -12.753 -16.407
   22    HB3  ARG  70           HB3      ARG  70  13.074 -11.916 -15.015
   23    HG2  ARG  70           HG2      ARG  70  10.667 -12.341 -14.753
   24    HG3  ARG  70           HG3      ARG  70  11.031 -10.625 -14.711
   25    HD2  ARG  70           HD2      ARG  70  10.329 -10.519 -17.180
   26    HD3  ARG  70           HD3      ARG  70   9.821 -12.194 -17.018
   27    HE   ARG  70           HE       ARG  70   7.964 -11.522 -15.801
   28   HH11  ARG  70          HH11      ARG  70  10.098  -8.707 -16.026
   29   HH12  ARG  70          HH12      ARG  70   8.824  -7.626 -15.527
   30   HH21  ARG  70          HH22      ARG  70   6.443 -10.072 -15.115
   31   HH22  ARG  70          HH21      ARG  70   6.829  -8.384 -14.974
   32    H    GLY  71           H        GLY  71  15.023  -9.430 -15.869
   33    HA2  GLY  71           HA2      GLY  71  15.516  -7.252 -15.322
   34    HA3  GLY  71           HA3      GLY  71  13.949  -6.758 -15.959
   35    H    ARG  72           H        ARG  72  12.456  -8.496 -14.067
   36    HA   ARG  72           HA       ARG  72  13.012  -7.356 -11.350
   37    HB2  ARG  72           HB2      ARG  72  10.315  -7.572 -12.772
   38    HB3  ARG  72           HB3      ARG  72  10.505  -7.168 -11.076
   39    HG2  ARG  72           HG2      ARG  72  11.549  -5.438 -13.363
   40    HG3  ARG  72           HG3      ARG  72   9.999  -5.252 -12.565
   41    HD2  ARG  72           HD2      ARG  72  11.349  -3.653 -11.547
   42    HD3  ARG  72           HD3      ARG  72  11.235  -4.964 -10.364
   43    HE   ARG  72           HE       ARG  72  13.563  -5.237 -12.089
   44   HH11  ARG  72          HH21      ARG  72  12.528  -3.390  -9.295
   45   HH12  ARG  72          HH22      ARG  72  14.157  -3.190  -8.712
   46   HH21  ARG  72          HH11      ARG  72  15.573  -4.975 -11.317
   47   HH22  ARG  72          HH12      ARG  72  15.861  -4.062  -9.859
   48    H    GLY  73           H        GLY  73  11.913  -8.569  -9.622
   49    HA2  GLY  73           HA2      GLY  73  12.431 -11.397  -9.785
   50    HA3  GLY  73           HA3      GLY  73  11.648 -10.553  -8.450
   51    H    ALA  74           H        ALA  74  11.067 -13.144  -9.930
   52    HA   ALA  74           HA       ALA  74   8.136 -12.853 -10.122
   53    HB1  ALA  74           HB1      ALA  74   8.947 -12.423 -12.429
   54    HB2  ALA  74           HB2      ALA  74   9.856 -13.948 -12.402
   55    HB3  ALA  74           HB3      ALA  74   8.084 -13.970 -12.339
   56    H    ILE  75           H        ILE  75   7.029 -14.939 -10.146
   57    HA   ILE  75           HA       ILE  75   8.200 -16.879  -8.339
   58    HB   ILE  75           HB       ILE  75   5.633 -16.880  -9.958
   59   HG12  ILE  75          HG11      ILE  75   6.178 -16.526  -6.969
   60   HG13  ILE  75          HG12      ILE  75   5.858 -15.212  -8.094
   61   HG21  ILE  75          HG21      ILE  75   6.507 -18.930  -7.864
   62   HG22  ILE  75          HG22      ILE  75   4.904 -18.835  -8.626
   63   HG23  ILE  75          HG23      ILE  75   6.287 -19.248  -9.598
   64   HD11  ILE  75          HD11      ILE  75   3.837 -15.632  -6.916
   65   HD12  ILE  75          HD12      ILE  75   3.599 -16.223  -8.579
   66   HD13  ILE  75          HD13      ILE  75   3.902 -17.366  -7.240
   67    H    ASP  76           H        ASP  76   9.140 -18.768  -8.686
   68    HA   ASP  76           HA       ASP  76   9.425 -19.814 -11.488
   69    HB2  ASP  76           HB2      ASP  76  11.563 -19.065 -10.490
   70    HB3  ASP  76           HB3      ASP  76  11.300 -20.154  -9.126
   71    H    ARG  77           H        ARG  77   8.864 -20.671  -8.074
   72    HA   ARG  77           HA       ARG  77   7.203 -23.018  -8.900
   73    HB2  ARG  77           HB2      ARG  77   9.579 -23.197  -6.978
   74    HB3  ARG  77           HB3      ARG  77   8.373 -24.462  -7.178
   75    HG2  ARG  77           HG2      ARG  77  10.310 -23.543  -9.333
   76    HG3  ARG  77           HG3      ARG  77  10.467 -24.973  -8.323
   77    HD2  ARG  77           HD2      ARG  77   8.370 -25.898  -9.249
   78    HD3  ARG  77           HD3      ARG  77   8.196 -24.499 -10.304
   79    HE   ARG  77           HE       ARG  77  10.055 -26.750 -10.591
   80   HH11  ARG  77          HH21      ARG  77   9.466 -23.466 -11.671
   81   HH12  ARG  77          HH22      ARG  77  10.480 -23.654 -13.078
   82   HH21  ARG  77          HH11      ARG  77  11.308 -26.931 -12.417
   83   HH22  ARG  77          HH12      ARG  77  11.445 -25.591 -13.516
   84    H    GLU  78           H        GLU  78   7.892 -20.537  -6.620
   85    HA   GLU  78           HA       GLU  78   7.082 -21.384  -4.205
   86    HB2  GLU  78           HB2      GLU  78   6.429 -18.654  -5.392
   87    HB3  GLU  78           HB3      GLU  78   6.463 -19.071  -3.682
   88    HG2  GLU  78           HG2      GLU  78   8.544 -18.228  -3.806
   89    HG3  GLU  78           HG3      GLU  78   8.949 -19.875  -4.254
   90    H    GLN  79           H        GLN  79   4.532 -19.913  -6.377
   91    HA   GLN  79           HA       GLN  79   2.477 -20.553  -4.471
   92    HB2  GLN  79           HB2      GLN  79   0.898 -19.800  -6.049
   93    HB3  GLN  79           HB3      GLN  79   2.308 -18.747  -6.136
   94    HG2  GLN  79           HG2      GLN  79   3.022 -20.058  -8.215
   95    HG3  GLN  79           HG3      GLN  79   1.486 -20.915  -8.126
   96   HE21  GLN  79          HE22      GLN  79   1.837 -19.713 -10.466
   97   HE22  GLN  79          HE21      GLN  79   0.916 -18.216 -10.557
   98    H    SER  80           H        SER  80   3.662 -22.311  -7.316
   99    HA   SER  80           HA       SER  80   1.728 -24.424  -7.315
  100    HB2  SER  80           HB2      SER  80   4.614 -24.322  -8.285
  101    HB3  SER  80           HB3      SER  80   3.452 -25.625  -8.651
  102    HG   SER  80           HG       SER  80   3.508 -24.008 -10.311
  103    H    ALA  81           H        ALA  81   4.967 -24.169  -5.727
  104    HA   ALA  81           HA       ALA  81   4.887 -26.652  -4.420
  105    HB1  ALA  81           HB1      ALA  81   6.260 -24.053  -3.605
  106    HB2  ALA  81           HB2      ALA  81   6.652 -25.680  -2.999
  107    HB3  ALA  81           HB3      ALA  81   6.911 -25.285  -4.708
  108    H    ALA  82           H        ALA  82   3.683 -23.428  -3.268
  109    HA   ALA  82           HA       ALA  82   2.801 -24.314  -0.723
  110    HB1  ALA  82           HB1      ALA  82   2.994 -21.947  -1.398
  111    HB2  ALA  82           HB2      ALA  82   1.615 -22.140  -2.509
  112    HB3  ALA  82           HB3      ALA  82   1.384 -22.310  -0.757
  113    H    ILE  83           H        ILE  83   1.024 -24.339  -3.850
  114    HA   ILE  83           HA       ILE  83  -1.378 -25.531  -2.788
  115    HB   ILE  83           HB       ILE  83  -0.267 -25.404  -5.618
  116   HG12  ILE  83          HG11      ILE  83  -2.511 -23.875  -4.231
  117   HG13  ILE  83          HG12      ILE  83  -0.899 -23.237  -4.450
  118   HG21  ILE  83          HG21      ILE  83  -2.550 -26.032  -6.380
  119   HG22  ILE  83          HG22      ILE  83  -1.830 -27.336  -5.458
  120   HG23  ILE  83          HG23      ILE  83  -3.049 -26.295  -4.696
  121   HD11  ILE  83          HD11      ILE  83  -2.948 -23.814  -6.605
  122   HD12  ILE  83          HD12      ILE  83  -2.235 -22.267  -6.140
  123   HD13  ILE  83          HD13      ILE  83  -1.227 -23.476  -6.961
  124    H    ARG  84           H        ARG  84   1.542 -27.026  -4.302
  125    HA   ARG  84           HA       ARG  84   0.703 -29.740  -4.118
  126    HB2  ARG  84           HB2      ARG  84   2.793 -28.853  -5.297
  127    HB3  ARG  84           HB3      ARG  84   3.545 -28.673  -3.717
  128    HG2  ARG  84           HG2      ARG  84   3.007 -31.242  -3.416
  129    HG3  ARG  84           HG3      ARG  84   2.695 -31.209  -5.147
  130    HD2  ARG  84           HD2      ARG  84   4.921 -31.926  -4.940
  131    HD3  ARG  84           HD3      ARG  84   5.053 -30.227  -5.419
  132    HE   ARG  84           HE       ARG  84   5.094 -30.522  -2.512
  133   HH11  ARG  84          HH11      ARG  84   7.272 -31.094  -5.240
  134   HH12  ARG  84          HH12      ARG  84   8.666 -30.729  -4.264
  135   HH21  ARG  84          HH21      ARG  84   6.854 -30.323  -1.360
  136   HH22  ARG  84          HH22      ARG  84   8.455 -30.325  -2.090
  137    H    GLU  85           H        GLU  85   2.538 -27.815  -1.712
  138    HA   GLU  85           HA       GLU  85   2.711 -29.882   0.140
  139    HB2  GLU  85           HB2      GLU  85   3.021 -26.892   0.396
  140    HB3  GLU  85           HB3      GLU  85   3.293 -27.966   1.766
  141    HG2  GLU  85           HG2      GLU  85   4.651 -28.217  -0.935
  142    HG3  GLU  85           HG3      GLU  85   5.399 -27.483   0.495
  143    H    TRP  86           H        TRP  86   0.219 -27.342  -0.125
  144    HA   TRP  86           HA       TRP  86  -1.311 -28.108   2.110
  145    HB2  TRP  86           HB2      TRP  86  -1.661 -25.992   1.015
  146    HB3  TRP  86           HB3      TRP  86  -2.048 -26.772  -0.510
  147    HD1  TRP  86           HD1      TRP  86  -3.539 -26.032   2.923
  148    HE1  TRP  86           HE1      TRP  86  -6.082 -26.389   2.866
  149    HE3  TRP  86           HE3      TRP  86  -3.999 -27.936  -1.819
  150    HZ2  TRP  86           HZ2      TRP  86  -8.023 -27.573   1.094
  151    HZ3  TRP  86           HZ3      TRP  86  -6.233 -28.580  -2.695
  152    HH2  TRP  86           HH2      TRP  86  -8.243 -28.436  -1.236
  153    H    ALA  87           H        ALA  87  -1.530 -29.133  -1.338
  154    HA   ALA  87           HA       ALA  87  -3.737 -30.894  -1.039
  155    HB1  ALA  87           HB1      ALA  87  -2.983 -30.020  -3.186
  156    HB2  ALA  87           HB2      ALA  87  -1.420 -30.839  -3.020
  157    HB3  ALA  87           HB3      ALA  87  -2.901 -31.796  -3.238
  158    H    ARG  88           H        ARG  88  -0.229 -31.596  -0.772
  159    HA   ARG  88           HA       ARG  88  -0.395 -34.407  -0.227
  160    HB2  ARG  88           HB2      ARG  88   1.601 -32.246   0.608
  161    HB3  ARG  88           HB3      ARG  88   1.810 -33.952   1.023
  162    HG2  ARG  88           HG2      ARG  88   1.818 -34.581  -1.359
  163    HG3  ARG  88           HG3      ARG  88   1.550 -32.906  -1.831
  164    HD2  ARG  88           HD2      ARG  88   3.899 -33.325  -2.072
  165    HD3  ARG  88           HD3      ARG  88   3.691 -32.286  -0.655
  166    HE   ARG  88           HE       ARG  88   3.878 -35.251  -0.311
  167   HH11  ARG  88          HH11      ARG  88   5.534 -32.152   0.239
  168   HH12  ARG  88          HH12      ARG  88   6.688 -32.916   1.292
  169   HH21  ARG  88          HH21      ARG  88   5.386 -36.080   1.051
  170   HH22  ARG  88          HH22      ARG  88   6.619 -35.058   1.725
  171    H    ARG  89           H        ARG  89  -0.662 -31.661   2.022
  172    HA   ARG  89           HA       ARG  89  -0.975 -33.338   4.409
  173    HB2  ARG  89           HB2      ARG  89  -1.362 -30.374   3.832
  174    HB3  ARG  89           HB3      ARG  89  -1.685 -31.081   5.423
  175    HG2  ARG  89           HG2      ARG  89   0.570 -31.826   5.698
  176    HG3  ARG  89           HG3      ARG  89   0.970 -31.497   4.014
  177    HD2  ARG  89           HD2      ARG  89   0.631 -29.048   4.427
  178    HD3  ARG  89           HD3      ARG  89   0.245 -29.406   6.112
  179    HE   ARG  89           HE       ARG  89   2.491 -29.572   6.574
  180   HH11  ARG  89          HH11      ARG  89   2.217 -30.019   3.092
  181   HH12  ARG  89          HH12      ARG  89   3.974 -30.058   2.896
  182   HH21  ARG  89          HH21      ARG  89   4.710 -29.620   6.186
  183   HH22  ARG  89          HH22      ARG  89   5.284 -29.835   4.555
  184    H    ASN  90           H        ASN  90  -3.227 -32.093   2.055
  185    HA   ASN  90           HA       ASN  90  -5.558 -32.953   3.690
  186    HB2  ASN  90           HB2      ASN  90  -5.279 -31.307   1.152
  187    HB3  ASN  90           HB3      ASN  90  -6.830 -31.885   1.767
  188   HD21  ASN  90          HD22      ASN  90  -4.075 -29.772   2.575
  189   HD22  ASN  90          HD21      ASN  90  -4.972 -28.864   3.784
  190    H    GLY  91           H        GLY  91  -3.480 -34.598   1.719
  191    HA2  GLY  91           HA2      GLY  91  -3.588 -36.736   0.901
  192    HA3  GLY  91           HA3      GLY  91  -5.241 -36.866   1.505
  193    H    HIS  92           H        HIS  92  -4.379 -34.323  -0.777
  194    HA   HIS  92           HA       HIS  92  -6.223 -35.526  -2.802
  195    HB2  HIS  92           HB2      HIS  92  -5.145 -32.692  -2.561
  196    HB3  HIS  92           HB3      HIS  92  -6.332 -33.251  -3.739
  197    HD1  HIS  92           HD1      HIS  92  -8.139 -34.908  -1.478
  198    HD2  HIS  92           HD2      HIS  92  -6.791 -30.901  -1.476
  199    HE1  HIS  92           HE1      HIS  92  -9.776 -33.594   0.004
  200    HE2  HIS  92           HE2      HIS  92  -8.962 -31.153  -0.009
  201    H    ASN  93           H        ASN  93  -5.721 -35.618  -5.014
  202    HA   ASN  93           HA       ASN  93  -3.095 -36.677  -5.506
  203    HB2  ASN  93           HB2      ASN  93  -5.215 -37.512  -6.510
  204    HB3  ASN  93           HB3      ASN  93  -5.356 -36.022  -7.444
  205   HD21  ASN  93          HD22      ASN  93  -5.463 -37.838  -9.157
  206   HD22  ASN  93          HD21      ASN  93  -3.917 -38.289  -9.862
  207    H    VAL  94           H        VAL  94  -1.286 -35.685  -6.070
  208    HA   VAL  94           HA       VAL  94  -1.174 -33.634  -8.107
  209    HB   VAL  94           HB       VAL  94  -1.585 -32.175  -6.189
  210   HG11  VAL  94          HG11      VAL  94   0.941 -33.351  -4.935
  211   HG12  VAL  94          HG12      VAL  94   0.045 -31.949  -4.345
  212   HG13  VAL  94          HG13      VAL  94  -0.719 -33.545  -4.327
  213   HG21  VAL  94          HG21      VAL  94   1.318 -31.891  -6.968
  214   HG22  VAL  94          HG22      VAL  94  -0.042 -31.480  -8.025
  215   HG23  VAL  94          HG23      VAL  94   0.174 -30.634  -6.477
  216    H    SER  95           H        SER  95   0.768 -33.609  -9.174
  217    HA   SER  95           HA       SER  95   2.612 -35.785  -8.829
  218    HB2  SER  95           HB2      SER  95   2.732 -33.246 -10.493
  219    HB3  SER  95           HB3      SER  95   3.869 -34.608 -10.647
  220    HG   SER  95           HG       SER  95   2.118 -34.752 -12.154
  221    H    THR  96           H        THR  96   4.890 -35.709  -8.291
  222    HA   THR  96           HA       THR  96   5.498 -34.100  -5.991
  223    HB   THR  96           HB       THR  96   7.800 -35.083  -6.231
  224    HG1  THR  96           HG1      THR  96   8.035 -36.693  -7.795
  225   HG21  THR  96          HG21      THR  96   5.521 -37.097  -6.469
  226   HG22  THR  96          HG22      THR  96   7.121 -37.381  -5.754
  227   HG23  THR  96          HG23      THR  96   5.998 -36.258  -4.974
  228    H    ARG  97           H        ARG  97   6.173 -33.636  -9.365
  229    HA   ARG  97           HA       ARG  97   7.139 -30.892  -8.930
  230    HB2  ARG  97           HB2      ARG  97   9.150 -31.072 -10.149
  231    HB3  ARG  97           HB3      ARG  97   9.208 -32.296  -8.900
  232    HG2  ARG  97           HG2      ARG  97   8.591 -32.785 -11.852
  233    HG3  ARG  97           HG3      ARG  97  10.148 -33.028 -11.058
  234    HD2  ARG  97           HD2      ARG  97   9.092 -34.735  -9.564
  235    HD3  ARG  97           HD3      ARG  97   7.586 -34.559 -10.497
  236    HE   ARG  97           HE       ARG  97   9.790 -35.150 -12.246
  237   HH11  ARG  97          HH11      ARG  97   7.672 -36.744  -9.936
  238   HH12  ARG  97          HH12      ARG  97   7.798 -38.280 -10.749
  239   HH21  ARG  97          HH21      ARG  97   9.910 -37.149 -13.225
  240   HH22  ARG  97          HH22      ARG  97   9.048 -38.504 -12.559
  241    H    GLY  98           H        GLY  98   7.338 -29.695 -11.038
  242    HA2  GLY  98           HA2      GLY  98   6.570 -29.076 -13.145
  243    HA3  GLY  98           HA3      GLY  98   5.985 -30.716 -13.397
  244    H    ARG  99           H        ARG  99   3.995 -30.240 -14.220
  245    HA   ARG  99           HA       ARG  99   2.289 -28.105 -13.297
  246    HB2  ARG  99           HB2      ARG  99   1.731 -30.489 -15.122
  247    HB3  ARG  99           HB3      ARG  99   0.603 -29.160 -14.841
  248    HG2  ARG  99           HG2      ARG  99   2.249 -27.533 -15.717
  249    HG3  ARG  99           HG3      ARG  99   3.394 -28.849 -16.036
  250    HD2  ARG  99           HD2      ARG  99   1.757 -29.900 -17.570
  251    HD3  ARG  99           HD3      ARG  99   0.619 -28.573 -17.265
  252    HE   ARG  99           HE       ARG  99   3.073 -27.431 -18.117
  253   HH11  ARG  99          HH11      ARG  99   0.527 -29.371 -19.548
  254   HH12  ARG  99          HH12      ARG  99   0.825 -28.752 -21.148
  255   HH21  ARG  99          HH21      ARG  99   3.402 -26.678 -20.184
  256   HH22  ARG  99          HH22      ARG  99   2.421 -27.269 -21.492
  257    H    ILE 100           H        ILE 100   0.202 -28.190 -12.458
  258    HA   ILE 100           HA       ILE 100  -0.410 -30.457 -10.611
  259    HB   ILE 100           HB       ILE 100  -0.686 -27.477 -10.113
  260   HG12  ILE 100          HG11      ILE 100   1.115 -29.629  -8.931
  261   HG13  ILE 100          HG12      ILE 100   1.594 -28.209  -9.851
  262   HG21  ILE 100          HG21      ILE 100  -1.507 -29.733  -8.209
  263   HG22  ILE 100          HG22      ILE 100  -1.627 -27.986  -7.932
  264   HG23  ILE 100          HG23      ILE 100  -2.632 -28.732  -9.153
  265   HD11  ILE 100          HD11      ILE 100   2.125 -27.814  -7.575
  266   HD12  ILE 100          HD12      ILE 100   0.758 -26.754  -7.996
  267   HD13  ILE 100          HD13      ILE 100   0.493 -28.227  -7.030
  268    HA   PRO 101           HA       PRO 101  -4.250 -30.493 -12.924
  269    HB2  PRO 101           HB2      PRO 101  -5.922 -31.801 -11.130
  270    HB3  PRO 101           HB3      PRO 101  -4.689 -32.611 -12.150
  271    HG2  PRO 101           HG2      PRO 101  -4.457 -31.720  -9.270
  272    HG3  PRO 101           HG3      PRO 101  -3.972 -33.291  -9.986
  273    HD2  PRO 101           HD2      PRO 101  -2.183 -31.339  -9.511
  274    HD3  PRO 101           HD3      PRO 101  -2.062 -32.328 -10.996
  275    H    ALA 102           H        ALA 102  -5.885 -29.042 -13.241
  276    HA   ALA 102           HA       ALA 102  -6.131 -26.808 -11.595
  277    HB1  ALA 102           HB1      ALA 102  -8.108 -27.802 -13.655
  278    HB2  ALA 102           HB2      ALA 102  -7.943 -26.139 -13.023
  279    HB3  ALA 102           HB3      ALA 102  -6.631 -26.854 -13.988
  280    H    ASP 103           H        ASP 103  -7.994 -29.807 -11.420
  281    HA   ASP 103           HA       ASP 103 -10.124 -28.962  -9.860
  282    HB2  ASP 103           HB2      ASP 103  -8.658 -31.625  -9.883
  283    HB3  ASP 103           HB3      ASP 103 -10.193 -31.349  -9.069
  284    H    VAL 104           H        VAL 104  -6.810 -29.913  -8.810
  285    HA   VAL 104           HA       VAL 104  -7.532 -29.555  -6.029
  286    HB   VAL 104           HB       VAL 104  -5.909 -31.310  -6.861
  287   HG11  VAL 104          HG11      VAL 104  -4.355 -29.826  -8.096
  288   HG12  VAL 104          HG12      VAL 104  -3.885 -29.047  -6.573
  289   HG13  VAL 104          HG13      VAL 104  -3.549 -30.772  -6.847
  290   HG21  VAL 104          HG21      VAL 104  -4.720 -31.321  -4.758
  291   HG22  VAL 104          HG22      VAL 104  -5.081 -29.602  -4.481
  292   HG23  VAL 104          HG23      VAL 104  -6.396 -30.802  -4.478
  293    H    ILE 105           H        ILE 105  -5.964 -27.587  -8.500
  294    HA   ILE 105           HA       ILE 105  -5.183 -25.408  -6.774
  295    HB   ILE 105           HB       ILE 105  -5.977 -25.618  -9.704
  296   HG12  ILE 105          HG11      ILE 105  -3.225 -24.873  -8.660
  297   HG13  ILE 105          HG12      ILE 105  -3.718 -26.562  -8.552
  298   HG21  ILE 105          HG21      ILE 105  -4.966 -23.161  -8.209
  299   HG22  ILE 105          HG22      ILE 105  -4.951 -23.331  -9.977
  300   HG23  ILE 105          HG23      ILE 105  -6.487 -23.334  -9.117
  301   HD11  ILE 105          HD11      ILE 105  -3.777 -24.983 -11.147
  302   HD12  ILE 105          HD12      ILE 105  -2.465 -26.056 -10.622
  303   HD13  ILE 105          HD13      ILE 105  -4.081 -26.726 -10.896
  304    H    ASP 106           H        ASP 106  -8.291 -26.036  -8.545
  305    HA   ASP 106           HA       ASP 106  -9.684 -23.873  -7.476
  306    HB2  ASP 106           HB2      ASP 106 -10.432 -25.203  -9.397
  307    HB3  ASP 106           HB3      ASP 106 -10.709 -26.594  -8.347
  308    H    ALA 107           H        ALA 107  -9.491 -27.262  -6.175
  309    HA   ALA 107           HA       ALA 107 -11.010 -26.865  -3.909
  310    HB1  ALA 107           HB1      ALA 107  -9.881 -28.838  -3.018
  311    HB2  ALA 107           HB2      ALA 107 -10.197 -29.052  -4.741
  312    HB3  ALA 107           HB3      ALA 107  -8.555 -28.649  -4.179
  313    H    TYR 108           H        TYR 108  -7.491 -26.187  -4.322
  314    HA   TYR 108           HA       TYR 108  -6.956 -25.285  -1.673
  315    HB2  TYR 108           HB2      TYR 108  -5.180 -25.800  -3.202
  316    HB3  TYR 108           HB3      TYR 108  -5.734 -24.628  -4.373
  317    HD1  TYR 108           HD1      TYR 108  -3.983 -25.069  -1.164
  318    HD2  TYR 108           HD2      TYR 108  -5.279 -22.235  -4.148
  319    HE1  TYR 108           HE1      TYR 108  -2.450 -23.363  -0.209
  320    HE2  TYR 108           HE2      TYR 108  -3.747 -20.528  -3.189
  321    HH   TYR 108           HH       TYR 108  -2.166 -20.057  -1.570
  322    H    HIS 109           H        HIS 109  -7.977 -23.377  -4.586
  323    HA   HIS 109           HA       HIS 109  -8.201 -20.897  -3.150
  324    HB2  HIS 109           HB2      HIS 109  -9.389 -21.861  -5.770
  325    HB3  HIS 109           HB3      HIS 109  -9.712 -20.253  -5.126
  326    HD1  HIS 109           HD1      HIS 109  -7.231 -18.855  -4.464
  327    HD2  HIS 109           HD2      HIS 109  -7.364 -21.887  -7.391
  328    HE1  HIS 109           HE1      HIS 109  -5.149 -18.522  -5.940
  329    HE2  HIS 109           HE2      HIS 109  -5.239 -20.361  -7.736
  330    H    ALA 110           H        ALA 110 -10.630 -23.497  -3.579
  331    HA   ALA 110           HA       ALA 110 -12.755 -22.085  -2.251
  332    HB1  ALA 110           HB1      ALA 110 -13.094 -24.133  -3.588
  333    HB2  ALA 110           HB2      ALA 110 -12.195 -25.081  -2.381
  334    HB3  ALA 110           HB3      ALA 110 -13.732 -24.310  -1.941
  335    H    ALA 111           H        ALA 111 -10.167 -24.263  -0.915
  336    HA   ALA 111           HA       ALA 111 -11.010 -24.135   1.722
  337    HB1  ALA 111           HB1      ALA 111  -8.204 -24.532   0.614
  338    HB2  ALA 111           HB2      ALA 111  -8.773 -25.024   2.221
  339    HB3  ALA 111           HB3      ALA 111  -9.460 -25.791   0.772
  340    H    THR 112           H        THR 112  -8.752 -21.948  -0.027
  341    HA   THR 112           HA       THR 112  -8.149 -20.381   2.356
  342    HB   THR 112           HB       THR 112  -7.096 -18.774   0.828
  343    HG1  THR 112           HG1      THR 112  -6.989 -19.287  -1.365
  344   HG21  THR 112          HG21      THR 112  -6.320 -21.659   0.220
  345   HG22  THR 112          HG22      THR 112  -5.293 -20.223   0.041
  346   HG23  THR 112          HG23      THR 112  -5.823 -20.742   1.650
  347    H    LEU 113           H        LEU 113 -10.412 -19.825  -0.393
  348    HA   LEU 113           HA       LEU 113 -11.209 -17.242   0.752
  349    HB2  LEU 113           HB2      LEU 113 -12.269 -18.721  -1.673
  350    HB3  LEU 113           HB3      LEU 113 -12.602 -17.047  -1.257
  351    HG   LEU 113           HG       LEU 113  -9.856 -18.166  -1.959
  352   HD11  LEU 113          HD11      LEU 113 -11.756 -16.395  -3.549
  353   HD12  LEU 113          HD12      LEU 113 -10.120 -16.888  -4.046
  354   HD13  LEU 113          HD13      LEU 113 -11.394 -18.105  -3.876
  355   HD21  LEU 113          HD21      LEU 113  -9.607 -16.233  -0.475
  356   HD22  LEU 113          HD22      LEU 113  -9.176 -15.780  -2.127
  357   HD23  LEU 113          HD23      LEU 113 -10.751 -15.297  -1.467
  358    H    GLU 114           H        GLU 114 -12.946 -20.289   0.113
  359    HA   GLU 114           HA       GLU 114 -15.442 -19.164   1.090
  360    HB2  GLU 114           HB2      GLU 114 -14.807 -22.063   0.437
  361    HB3  GLU 114           HB3      GLU 114 -16.401 -21.381   0.704
  362    HG2  GLU 114           HG2      GLU 114 -14.532 -20.573  -1.567
  363    HG3  GLU 114           HG3      GLU 114 -15.887 -21.685  -1.694
  364    H    HIS 115           H        HIS 115 -12.947 -21.091   2.692
  365    HA   HIS 115           HA       HIS 115 -14.493 -21.803   5.006
  366    HB2  HIS 115           HB2      HIS 115 -12.261 -22.745   4.330
  367    HB3  HIS 115           HB3      HIS 115 -11.499 -21.235   4.831
  368    HD1  HIS 115           HD1      HIS 115 -10.638 -21.317   7.304
  369    HD2  HIS 115           HD2      HIS 115 -13.805 -23.988   6.446
  370    HE1  HIS 115           HE1      HIS 115 -11.027 -22.700   9.443
  371    HE2  HIS 115           HE2      HIS 115 -12.960 -24.320   8.912
  372    H    HIS 116           H        HIS 116 -13.135 -18.746   4.058
  373    HA   HIS 116           HA       HIS 116 -13.661 -17.466   6.689
  374    HB2  HIS 116           HB2      HIS 116 -12.423 -16.394   4.119
  375    HB3  HIS 116           HB3      HIS 116 -12.612 -15.480   5.610
  376    HD1  HIS 116           HD1      HIS 116 -10.104 -17.698   3.978
  377    HD2  HIS 116           HD2      HIS 116 -11.350 -16.635   7.888
  378    HE1  HIS 116           HE1      HIS 116  -8.182 -18.339   5.566
  379    HE2  HIS 116           HE2      HIS 116  -8.938 -17.679   7.938
  380    H    HIS 117           H        HIS 117 -15.638 -18.237   4.123
  381    HA   HIS 117           HA       HIS 117 -17.225 -15.739   4.125
  382    HB2  HIS 117           HB2      HIS 117 -16.792 -17.032   2.028
  383    HB3  HIS 117           HB3      HIS 117 -17.694 -18.392   2.679
  384    HD1  HIS 117           HD1      HIS 117 -18.405 -14.619   1.895
  385    HD2  HIS 117           HD2      HIS 117 -20.162 -18.462   1.895
  386    HE1  HIS 117           HE1      HIS 117 -20.772 -14.336   0.933
  387    HE2  HIS 117           HE2      HIS 117 -21.837 -16.679   0.926
  388    H    HIS 118           H        HIS 118 -19.513 -15.722   4.708
  389    HA   HIS 118           HA       HIS 118 -19.830 -16.855   7.348
  390    HB2  HIS 118           HB2      HIS 118 -20.513 -14.561   6.646
  391    HB3  HIS 118           HB3      HIS 118 -21.820 -15.251   5.688
  392    HD1  HIS 118           HD1      HIS 118 -20.713 -14.956   9.400
  393    HD2  HIS 118           HD2      HIS 118 -24.074 -15.799   6.974
  394    HE1  HIS 118           HE1      HIS 118 -22.744 -15.083  10.981
  395    HE2  HIS 118           HE2      HIS 118 -24.783 -15.596   9.496
  396    H    HIS 119           H        HIS 119 -21.387 -17.635   4.276
  397    HA   HIS 119           HA       HIS 119 -22.848 -19.223   3.558
  398    HB2  HIS 119           HB2      HIS 119 -21.822 -20.885   5.893
  399    HB3  HIS 119           HB3      HIS 119 -22.700 -21.499   4.507
  400    HD1  HIS 119           HD1      HIS 119 -21.357 -21.460   2.095
  401    HD2  HIS 119           HD2      HIS 119 -19.208 -20.513   5.609
  402    HE1  HIS 119           HE1      HIS 119 -18.862 -21.556   1.462
  403    HE2  HIS 119           HE2      HIS 119 -17.548 -20.954   3.613
  404    H    HIS 120           H        HIS 120 -24.716 -20.819   4.320
  405    HA   HIS 120           HA       HIS 120 -26.748 -19.115   5.523
  406    HB2  HIS 120           HB2      HIS 120 -26.893 -22.019   4.623
  407    HB3  HIS 120           HB3      HIS 120 -28.259 -20.995   5.045
  408    HD1  HIS 120           HD1      HIS 120 -26.894 -22.252   2.030
  409    HD2  HIS 120           HD2      HIS 120 -27.959 -18.414   3.436
  410    HE1  HIS 120           HE1      HIS 120 -27.273 -20.794  -0.063
  411    HE2  HIS 120           HE2      HIS 120 -27.926 -18.453   0.802
  Start of MODEL    3
    1    H1   SER  66           H1       SER  66  23.390 -32.617  -3.229
    2    H2   SER  66           H2       SER  66  25.012 -32.511  -3.024
    3    H3   SER  66           H3       SER  66  24.007 -32.220  -1.761
    4    HA   SER  66           HA       SER  66  24.880 -30.154  -2.577
    5    HB2  SER  66           HB2      SER  66  23.609 -30.934  -5.238
    6    HB3  SER  66           HB3      SER  66  24.443 -29.409  -4.866
    7    HG   SER  66           HG       SER  66  25.841 -30.924  -5.893
    8    H    GLY  67           H        GLY  67  23.647 -28.188  -2.540
    9    HA2  GLY  67           HA2      GLY  67  21.314 -28.372  -1.003
   10    HA3  GLY  67           HA3      GLY  67  21.917 -26.913  -1.787
   11    H    SER  68           H        SER  68  21.497 -28.058  -4.537
   12    HA   SER  68           HA       SER  68  18.900 -27.194  -5.131
   13    HB2  SER  68           HB2      SER  68  20.550 -29.199  -6.715
   14    HB3  SER  68           HB3      SER  68  19.264 -28.144  -7.335
   15    HG   SER  68           HG       SER  68  21.336 -27.252  -7.749
   16    H    GLY  69           H        GLY  69  19.812 -30.327  -3.860
   17    HA2  GLY  69           HA2      GLY  69  17.410 -31.771  -4.656
   18    HA3  GLY  69           HA3      GLY  69  18.595 -32.237  -3.434
   19    H    ARG  70           H        ARG  70  17.924 -29.316  -2.307
   20    HA   ARG  70           HA       ARG  70  15.423 -30.061  -0.812
   21    HB2  ARG  70           HB2      ARG  70  17.526 -30.526   0.458
   22    HB3  ARG  70           HB3      ARG  70  17.958 -28.816   0.340
   23    HG2  ARG  70           HG2      ARG  70  15.915 -28.214   1.644
   24    HG3  ARG  70           HG3      ARG  70  15.425 -29.915   1.653
   25    HD2  ARG  70           HD2      ARG  70  16.395 -29.421   3.784
   26    HD3  ARG  70           HD3      ARG  70  17.505 -30.487   2.903
   27    HE   ARG  70           HE       ARG  70  18.162 -27.685   2.498
   28   HH11  ARG  70          HH21      ARG  70  18.505 -30.189   4.916
   29   HH12  ARG  70          HH22      ARG  70  19.907 -29.441   5.633
   30   HH21  ARG  70          HH11      ARG  70  19.953 -26.777   3.452
   31   HH22  ARG  70          HH12      ARG  70  20.706 -27.559   4.809
   32    H    GLY  71           H        GLY  71  17.471 -27.344  -1.924
   33    HA2  GLY  71           HA2      GLY  71  15.694 -25.270  -1.019
   34    HA3  GLY  71           HA3      GLY  71  16.991 -25.091  -2.193
   35    H    ARG  72           H        ARG  72  13.975 -24.322  -1.934
   36    HA   ARG  72           HA       ARG  72  12.625 -25.405  -4.247
   37    HB2  ARG  72           HB2      ARG  72  11.529 -24.400  -2.248
   38    HB3  ARG  72           HB3      ARG  72  12.147 -22.810  -2.718
   39    HG2  ARG  72           HG2      ARG  72  10.806 -22.887  -4.803
   40    HG3  ARG  72           HG3      ARG  72  10.263 -24.525  -4.398
   41    HD2  ARG  72           HD2      ARG  72   8.529 -22.911  -3.860
   42    HD3  ARG  72           HD3      ARG  72   9.131 -23.659  -2.380
   43    HE   ARG  72           HE       ARG  72   9.953 -20.912  -3.368
   44   HH11  ARG  72          HH11      ARG  72   9.150 -22.894  -0.552
   45   HH12  ARG  72          HH12      ARG  72   9.384 -21.536   0.514
   46   HH21  ARG  72          HH21      ARG  72  10.168 -19.370  -2.073
   47   HH22  ARG  72          HH22      ARG  72   9.971 -19.526  -0.323
   48    H    GLY  73           H        GLY  73  14.674 -22.576  -3.810
   49    HA2  GLY  73           HA2      GLY  73  15.777 -21.249  -5.394
   50    HA3  GLY  73           HA3      GLY  73  14.933 -22.058  -6.710
   51    H    ALA  74           H        ALA  74  15.297 -19.116  -5.520
   52    HA   ALA  74           HA       ALA  74  12.559 -18.204  -5.194
   53    HB1  ALA  74           HB1      ALA  74  13.585 -15.984  -5.064
   54    HB2  ALA  74           HB2      ALA  74  14.413 -17.146  -4.007
   55    HB3  ALA  74           HB3      ALA  74  15.150 -16.663  -5.554
   56    H    ILE  75           H        ILE  75  11.143 -17.847  -6.812
   57    HA   ILE  75           HA       ILE  75  11.973 -16.701  -9.281
   58    HB   ILE  75           HB       ILE  75  12.426 -19.142  -9.469
   59   HG12  ILE  75          HG12      ILE  75  10.524 -18.173 -11.611
   60   HG13  ILE  75          HG13      ILE  75  12.167 -17.544 -11.418
   61   HG21  ILE  75          HG21      ILE  75   9.406 -19.195  -9.559
   62   HG22  ILE  75          HG22      ILE  75  10.465 -20.590  -9.905
   63   HG23  ILE  75          HG23      ILE  75  10.476 -19.852  -8.297
   64   HD11  ILE  75          HD11      ILE  75  12.127 -19.280 -13.135
   65   HD12  ILE  75          HD12      ILE  75  13.071 -19.842 -11.738
   66   HD13  ILE  75          HD13      ILE  75  11.419 -20.444 -12.002
   67    H    ASP  76           H        ASP  76  10.109 -16.382  -7.131
   68    HA   ASP  76           HA       ASP  76   8.116 -15.423  -6.567
   69    HB2  ASP  76           HB2      ASP  76   8.938 -13.637  -8.043
   70    HB3  ASP  76           HB3      ASP  76   8.079 -14.359  -9.404
   71    H    ARG  77           H        ARG  77   7.891 -17.189  -9.575
   72    HA   ARG  77           HA       ARG  77   5.109 -18.070  -9.328
   73    HB2  ARG  77           HB2      ARG  77   7.423 -18.820 -11.162
   74    HB3  ARG  77           HB3      ARG  77   5.802 -19.501 -11.318
   75    HG2  ARG  77           HG2      ARG  77   4.867 -17.606 -12.160
   76    HG3  ARG  77           HG3      ARG  77   5.890 -16.506 -11.245
   77    HD2  ARG  77           HD2      ARG  77   6.910 -18.136 -13.600
   78    HD3  ARG  77           HD3      ARG  77   6.243 -16.499 -13.735
   79    HE   ARG  77           HE       ARG  77   8.293 -16.538 -11.714
   80   HH11  ARG  77          HH11      ARG  77   8.052 -16.539 -15.214
   81   HH12  ARG  77          HH12      ARG  77   9.591 -15.741 -15.397
   82   HH21  ARG  77          HH21      ARG  77  10.176 -15.552 -11.987
   83   HH22  ARG  77          HH22      ARG  77  10.788 -15.189 -13.587
   84    H    GLU  78           H        GLU  78   6.147 -18.478  -7.022
   85    HA   GLU  78           HA       GLU  78   7.190 -21.251  -6.690
   86    HB2  GLU  78           HB2      GLU  78   7.256 -18.678  -5.078
   87    HB3  GLU  78           HB3      GLU  78   7.728 -20.233  -4.367
   88    HG2  GLU  78           HG2      GLU  78   9.493 -20.483  -6.016
   89    HG3  GLU  78           HG3      GLU  78   8.943 -19.020  -6.859
   90    H    GLN  79           H        GLN  79   4.160 -19.755  -6.462
   91    HA   GLN  79           HA       GLN  79   3.158 -20.915  -4.023
   92    HB2  GLN  79           HB2      GLN  79   1.723 -19.901  -6.517
   93    HB3  GLN  79           HB3      GLN  79   0.916 -20.371  -5.012
   94    HG2  GLN  79           HG2      GLN  79   2.210 -18.647  -3.770
   95    HG3  GLN  79           HG3      GLN  79   2.972 -18.128  -5.276
   96   HE21  GLN  79          HE22      GLN  79   1.802 -16.089  -4.087
   97   HE22  GLN  79          HE21      GLN  79   0.230 -15.733  -4.786
   98    H    SER  80           H        SER  80   3.763 -22.419  -7.100
   99    HA   SER  80           HA       SER  80   1.876 -24.549  -7.051
  100    HB2  SER  80           HB2      SER  80   3.575 -25.717  -8.472
  101    HB3  SER  80           HB3      SER  80   3.234 -24.061  -8.999
  102    HG   SER  80           HG       SER  80   5.492 -24.437  -8.942
  103    H    ALA  81           H        ALA  81   5.085 -24.282  -5.457
  104    HA   ALA  81           HA       ALA  81   5.092 -26.826  -4.267
  105    HB1  ALA  81           HB1      ALA  81   7.069 -25.376  -4.482
  106    HB2  ALA  81           HB2      ALA  81   6.362 -24.218  -3.326
  107    HB3  ALA  81           HB3      ALA  81   6.823 -25.847  -2.791
  108    H    ALA  82           H        ALA  82   3.687 -23.742  -3.090
  109    HA   ALA  82           HA       ALA  82   2.855 -24.748  -0.522
  110    HB1  ALA  82           HB1      ALA  82   1.780 -22.409  -2.163
  111    HB2  ALA  82           HB2      ALA  82   1.509 -22.697  -0.435
  112    HB3  ALA  82           HB3      ALA  82   3.142 -22.343  -1.024
  113    H    ILE  83           H        ILE  83   1.178 -24.561  -3.701
  114    HA   ILE  83           HA       ILE  83  -1.313 -25.676  -2.772
  115    HB   ILE  83           HB       ILE  83  -0.074 -25.616  -5.546
  116   HG12  ILE  83          HG12      ILE  83  -2.351 -23.903  -4.473
  117   HG13  ILE  83          HG13      ILE  83  -0.684 -23.391  -4.321
  118   HG21  ILE  83          HG21      ILE  83  -1.777 -27.396  -5.492
  119   HG22  ILE  83          HG22      ILE  83  -2.926 -26.311  -4.677
  120   HG23  ILE  83          HG23      ILE  83  -2.444 -26.009  -6.351
  121   HD11  ILE  83          HD11      ILE  83  -0.413 -23.503  -6.799
  122   HD12  ILE  83          HD12      ILE  83  -2.146 -23.880  -6.942
  123   HD13  ILE  83          HD13      ILE  83  -1.629 -22.333  -6.260
  124    H    ARG  84           H        ARG  84   1.598 -27.250  -4.200
  125    HA   ARG  84           HA       ARG  84   0.602 -29.959  -4.013
  126    HB2  ARG  84           HB2      ARG  84   3.394 -28.733  -4.134
  127    HB3  ARG  84           HB3      ARG  84   3.159 -30.477  -3.942
  128    HG2  ARG  84           HG2      ARG  84   1.899 -30.638  -5.984
  129    HG3  ARG  84           HG3      ARG  84   1.917 -28.888  -6.220
  130    HD2  ARG  84           HD2      ARG  84   4.306 -28.885  -6.603
  131    HD3  ARG  84           HD3      ARG  84   4.445 -30.578  -6.112
  132    HE   ARG  84           HE       ARG  84   3.070 -31.224  -8.070
  133   HH11  ARG  84          HH11      ARG  84   4.848 -28.195  -8.415
  134   HH12  ARG  84          HH12      ARG  84   4.691 -28.242 -10.149
  135   HH21  ARG  84          HH21      ARG  84   2.958 -31.209 -10.193
  136   HH22  ARG  84          HH22      ARG  84   3.626 -29.889 -11.144
  137    H    GLU  85           H        GLU  85   2.603 -28.109  -1.627
  138    HA   GLU  85           HA       GLU  85   2.596 -30.128   0.288
  139    HB2  GLU  85           HB2      GLU  85   4.018 -28.051   0.273
  140    HB3  GLU  85           HB3      GLU  85   2.622 -27.158   0.908
  141    HG2  GLU  85           HG2      GLU  85   2.553 -28.833   2.823
  142    HG3  GLU  85           HG3      GLU  85   4.037 -29.546   2.190
  143    H    TRP  86           H        TRP  86   0.222 -27.390  -0.031
  144    HA   TRP  86           HA       TRP  86  -1.472 -28.087   2.041
  145    HB2  TRP  86           HB2      TRP  86  -1.700 -26.022   0.831
  146    HB3  TRP  86           HB3      TRP  86  -2.055 -26.870  -0.670
  147    HD1  TRP  86           HD1      TRP  86  -3.660 -25.746   2.577
  148    HE1  TRP  86           HE1      TRP  86  -6.193 -26.162   2.526
  149    HE3  TRP  86           HE3      TRP  86  -3.988 -28.264  -1.879
  150    HZ2  TRP  86           HZ2      TRP  86  -8.038 -27.766   0.968
  151    HZ3  TRP  86           HZ3      TRP  86  -6.137 -29.270  -2.596
  152    HH2  TRP  86           HH2      TRP  86  -8.156 -29.074  -1.141
  153    H    ALA  87           H        ALA  87  -1.557 -29.336  -1.347
  154    HA   ALA  87           HA       ALA  87  -3.811 -31.028  -0.965
  155    HB1  ALA  87           HB1      ALA  87  -3.018 -32.115  -3.056
  156    HB2  ALA  87           HB2      ALA  87  -2.947 -30.345  -3.167
  157    HB3  ALA  87           HB3      ALA  87  -1.458 -31.279  -2.901
  158    H    ARG  88           H        ARG  88  -0.308 -31.739  -0.555
  159    HA   ARG  88           HA       ARG  88  -0.590 -34.469   0.253
  160    HB2  ARG  88           HB2      ARG  88   1.519 -33.335  -0.452
  161    HB3  ARG  88           HB3      ARG  88   1.539 -32.436   1.068
  162    HG2  ARG  88           HG2      ARG  88   1.693 -34.572   2.333
  163    HG3  ARG  88           HG3      ARG  88   1.662 -35.482   0.818
  164    HD2  ARG  88           HD2      ARG  88   3.770 -33.415   1.577
  165    HD3  ARG  88           HD3      ARG  88   3.942 -35.166   1.811
  166    HE   ARG  88           HE       ARG  88   3.320 -34.872  -0.897
  167   HH11  ARG  88          HH11      ARG  88   5.973 -33.862   1.158
  168   HH12  ARG  88          HH12      ARG  88   7.117 -33.870  -0.154
  169   HH21  ARG  88          HH21      ARG  88   4.836 -34.866  -2.531
  170   HH22  ARG  88          HH22      ARG  88   6.485 -34.437  -2.185
  171    H    ARG  89           H        ARG  89  -0.554 -31.488   2.251
  172    HA   ARG  89           HA       ARG  89  -0.938 -32.746   4.809
  173    HB2  ARG  89           HB2      ARG  89  -1.668 -29.979   3.753
  174    HB3  ARG  89           HB3      ARG  89  -1.914 -30.460   5.432
  175    HG2  ARG  89           HG2      ARG  89   0.478 -30.876   5.736
  176    HG3  ARG  89           HG3      ARG  89   0.801 -30.503   4.043
  177    HD2  ARG  89           HD2      ARG  89  -0.070 -28.203   4.365
  178    HD3  ARG  89           HD3      ARG  89  -0.399 -28.543   6.061
  179    HE   ARG  89           HE       ARG  89   2.188 -27.943   4.803
  180   HH11  ARG  89          HH11      ARG  89   0.831 -29.353   7.742
  181   HH12  ARG  89          HH12      ARG  89   2.298 -29.035   8.626
  182   HH21  ARG  89          HH21      ARG  89   3.879 -27.584   5.897
  183   HH22  ARG  89          HH22      ARG  89   4.042 -28.041   7.598
  184    H    ASN  90           H        ASN  90  -3.301 -31.894   2.328
  185    HA   ASN  90           HA       ASN  90  -5.568 -32.747   4.037
  186    HB2  ASN  90           HB2      ASN  90  -5.366 -31.429   1.303
  187    HB3  ASN  90           HB3      ASN  90  -6.888 -32.021   1.964
  188   HD21  ASN  90          HD22      ASN  90  -4.335 -29.620   2.408
  189   HD22  ASN  90          HD21      ASN  90  -5.270 -28.624   3.522
  190    H    GLY  91           H        GLY  91  -3.397 -34.505   2.225
  191    HA2  GLY  91           HA2      GLY  91  -3.417 -36.668   1.459
  192    HA3  GLY  91           HA3      GLY  91  -5.020 -36.876   2.164
  193    H    HIS  92           H        HIS  92  -4.515 -34.351  -0.231
  194    HA   HIS  92           HA       HIS  92  -6.432 -35.699  -2.059
  195    HB2  HIS  92           HB2      HIS  92  -6.710 -33.303  -1.178
  196    HB3  HIS  92           HB3      HIS  92  -5.396 -32.843  -2.243
  197    HD1  HIS  92           HD1      HIS  92  -9.057 -33.995  -2.304
  198    HD2  HIS  92           HD2      HIS  92  -5.974 -32.769  -4.926
  199    HE1  HIS  92           HE1      HIS  92 -10.172 -33.544  -4.583
  200    HE2  HIS  92           HE2      HIS  92  -8.312 -32.792  -6.180
  201    H    ASN  93           H        ASN  93  -6.022 -36.033  -4.280
  202    HA   ASN  93           HA       ASN  93  -3.318 -36.839  -4.887
  203    HB2  ASN  93           HB2      ASN  93  -5.830 -36.648  -6.606
  204    HB3  ASN  93           HB3      ASN  93  -4.306 -37.327  -7.167
  205   HD21  ASN  93          HD22      ASN  93  -6.442 -38.948  -7.343
  206   HD22  ASN  93          HD21      ASN  93  -6.352 -40.192  -6.101
  207    H    VAL  94           H        VAL  94  -1.716 -35.897  -6.026
  208    HA   VAL  94           HA       VAL  94  -2.172 -33.687  -7.864
  209    HB   VAL  94           HB       VAL  94  -2.028 -32.523  -5.673
  210   HG11  VAL  94          HG11      VAL  94   0.076 -32.299  -4.478
  211   HG12  VAL  94          HG12      VAL  94  -0.421 -33.997  -4.499
  212   HG13  VAL  94          HG13      VAL  94   0.878 -33.430  -5.577
  213   HG21  VAL  94          HG21      VAL  94   0.324 -31.864  -7.485
  214   HG22  VAL  94          HG22      VAL  94  -1.375 -31.433  -7.806
  215   HG23  VAL  94          HG23      VAL  94  -0.554 -30.777  -6.384
  216    H    SER  95           H        SER  95  -0.514 -33.499  -9.420
  217    HA   SER  95           HA       SER  95   1.365 -35.757  -9.528
  218    HB2  SER  95           HB2      SER  95   0.158 -35.023 -11.544
  219    HB3  SER  95           HB3      SER  95   1.000 -33.457 -11.477
  220    HG   SER  95           HG       SER  95   2.042 -35.028 -12.862
  221    H    THR  96           H        THR  96   3.569 -35.694  -9.346
  222    HA   THR  96           HA       THR  96   4.747 -33.507  -7.810
  223    HB   THR  96           HB       THR  96   6.770 -35.000  -7.828
  224    HG1  THR  96           HG1      THR  96   6.476 -37.078  -8.702
  225   HG21  THR  96          HG21      THR  96   4.180 -36.408  -7.026
  226   HG22  THR  96          HG22      THR  96   5.817 -36.733  -6.406
  227   HG23  THR  96          HG23      THR  96   5.032 -35.186  -6.057
  228    H    ARG  97           H        ARG  97   4.516 -34.107 -11.154
  229    HA   ARG  97           HA       ARG  97   6.709 -32.161 -11.753
  230    HB2  ARG  97           HB2      ARG  97   7.376 -33.460 -13.690
  231    HB3  ARG  97           HB3      ARG  97   7.539 -34.406 -12.217
  232    HG2  ARG  97           HG2      ARG  97   5.391 -35.581 -12.733
  233    HG3  ARG  97           HG3      ARG  97   5.260 -34.666 -14.240
  234    HD2  ARG  97           HD2      ARG  97   7.561 -36.517 -13.500
  235    HD3  ARG  97           HD3      ARG  97   6.175 -36.984 -14.498
  236    HE   ARG  97           HE       ARG  97   7.184 -34.734 -15.773
  237   HH11  ARG  97          HH21      ARG  97   8.502 -37.895 -15.014
  238   HH12  ARG  97          HH22      ARG  97   9.604 -37.862 -16.363
  239   HH21  ARG  97          HH11      ARG  97   8.627 -34.746 -17.460
  240   HH22  ARG  97          HH12      ARG  97   9.662 -36.122 -17.715
  241    H    GLY  98           H        GLY  98   6.523 -31.055 -13.792
  242    HA2  GLY  98           HA2      GLY  98   5.401 -29.720 -15.306
  243    HA3  GLY  98           HA3      GLY  98   4.167 -30.972 -15.399
  244    H    ARG  99           H        ARG  99   2.678 -29.195 -15.678
  245    HA   ARG  99           HA       ARG  99   2.137 -27.261 -13.564
  246    HB2  ARG  99           HB2      ARG  99   0.502 -28.124 -15.994
  247    HB3  ARG  99           HB3      ARG  99   0.068 -26.797 -14.911
  248    HG2  ARG  99           HG2      ARG  99   2.206 -25.640 -15.457
  249    HG3  ARG  99           HG3      ARG  99   2.616 -26.948 -16.585
  250    HD2  ARG  99           HD2      ARG  99   0.575 -26.457 -17.899
  251    HD3  ARG  99           HD3      ARG  99   0.176 -25.139 -16.776
  252    HE   ARG  99           HE       ARG  99   2.811 -24.696 -17.743
  253   HH11  ARG  99          HH11      ARG  99  -0.443 -24.619 -19.045
  254   HH12  ARG  99          HH12      ARG  99  -0.023 -23.466 -20.280
  255   HH21  ARG  99          HH21      ARG  99   3.285 -23.234 -19.346
  256   HH22  ARG  99          HH22      ARG  99   2.040 -22.707 -20.443
  257    H    ILE 100           H        ILE 100   0.302 -27.100 -12.267
  258    HA   ILE 100           HA       ILE 100  -0.514 -29.624 -11.025
  259    HB   ILE 100           HB       ILE 100  -1.032 -26.730 -10.322
  260   HG12  ILE 100          HG12      ILE 100   0.738 -28.927  -9.132
  261   HG13  ILE 100          HG13      ILE 100   1.296 -27.526 -10.050
  262   HG21  ILE 100          HG21      ILE 100  -1.994 -27.473  -8.206
  263   HG22  ILE 100          HG22      ILE 100  -2.945 -28.138  -9.506
  264   HG23  ILE 100          HG23      ILE 100  -1.775 -29.177  -8.645
  265   HD11  ILE 100          HD11      ILE 100   0.087 -27.525  -7.277
  266   HD12  ILE 100          HD12      ILE 100   1.720 -27.071  -7.782
  267   HD13  ILE 100          HD13      ILE 100   0.342 -26.042  -8.236
  268    HA   PRO 101           HA       PRO 101  -4.388 -29.856 -13.293
  269    HB2  PRO 101           HB2      PRO 101  -5.600 -31.281 -10.971
  270    HB3  PRO 101           HB3      PRO 101  -5.397 -31.833 -12.653
  271    HG2  PRO 101           HG2      PRO 101  -3.874 -32.799 -10.582
  272    HG3  PRO 101           HG3      PRO 101  -3.222 -32.598 -12.244
  273    HD2  PRO 101           HD2      PRO 101  -2.888 -30.793  -9.845
  274    HD3  PRO 101           HD3      PRO 101  -1.681 -31.312 -11.068
  275    H    ALA 102           H        ALA 102  -6.230 -28.636 -13.466
  276    HA   ALA 102           HA       ALA 102  -6.637 -26.462 -11.771
  277    HB1  ALA 102           HB1      ALA 102  -7.297 -26.577 -14.126
  278    HB2  ALA 102           HB2      ALA 102  -8.611 -27.710 -13.703
  279    HB3  ALA 102           HB3      ALA 102  -8.622 -26.041 -13.071
  280    H    ASP 103           H        ASP 103  -8.100 -29.682 -11.542
  281    HA   ASP 103           HA       ASP 103 -10.128 -29.267  -9.719
  282    HB2  ASP 103           HB2      ASP 103  -9.685 -31.425 -10.734
  283    HB3  ASP 103           HB3      ASP 103  -8.091 -31.508  -9.983
  284    H    VAL 104           H        VAL 104  -6.612 -29.571  -9.087
  285    HA   VAL 104           HA       VAL 104  -6.930 -29.414  -6.228
  286    HB   VAL 104           HB       VAL 104  -4.311 -29.015  -7.609
  287   HG11  VAL 104          HG11      VAL 104  -4.335 -28.746  -5.168
  288   HG12  VAL 104          HG12      VAL 104  -5.073 -30.348  -4.979
  289   HG13  VAL 104          HG13      VAL 104  -3.423 -30.183  -5.623
  290   HG21  VAL 104          HG21      VAL 104  -5.143 -31.026  -8.712
  291   HG22  VAL 104          HG22      VAL 104  -3.953 -31.507  -7.504
  292   HG23  VAL 104          HG23      VAL 104  -5.683 -31.696  -7.159
  293    H    ILE 105           H        ILE 105  -6.022 -27.154  -8.833
  294    HA   ILE 105           HA       ILE 105  -5.373 -24.912  -7.138
  295    HB   ILE 105           HB       ILE 105  -6.390 -25.151  -9.994
  296   HG12  ILE 105          HG12      ILE 105  -3.648 -24.143  -9.162
  297   HG13  ILE 105          HG13      ILE 105  -3.947 -25.868  -9.030
  298   HG21  ILE 105          HG21      ILE 105  -5.458 -22.633  -8.546
  299   HG22  ILE 105          HG22      ILE 105  -5.681 -22.777 -10.300
  300   HG23  ILE 105          HG23      ILE 105  -7.072 -22.933  -9.230
  301   HD11  ILE 105          HD11      ILE 105  -2.933 -25.273 -11.193
  302   HD12  ILE 105          HD12      ILE 105  -4.515 -26.063 -11.346
  303   HD13  ILE 105          HD13      ILE 105  -4.370 -24.305 -11.596
  304    H    ASP 106           H        ASP 106  -8.523 -25.870  -8.662
  305    HA   ASP 106           HA       ASP 106 -10.088 -23.935  -7.430
  306    HB2  ASP 106           HB2      ASP 106 -10.839 -25.360  -9.278
  307    HB3  ASP 106           HB3      ASP 106 -10.816 -26.770  -8.215
  308    H    ALA 107           H        ALA 107  -9.299 -27.261  -6.231
  309    HA   ALA 107           HA       ALA 107 -10.624 -27.184  -3.833
  310    HB1  ALA 107           HB1      ALA 107  -9.054 -28.976  -3.173
  311    HB2  ALA 107           HB2      ALA 107  -9.543 -29.169  -4.854
  312    HB3  ALA 107           HB3      ALA 107  -7.938 -28.511  -4.473
  313    H    TYR 108           H        TYR 108  -7.255 -26.091  -4.425
  314    HA   TYR 108           HA       TYR 108  -6.663 -25.195  -1.796
  315    HB2  TYR 108           HB2      TYR 108  -5.029 -25.615  -3.590
  316    HB3  TYR 108           HB3      TYR 108  -5.638 -24.247  -4.503
  317    HD1  TYR 108           HD1      TYR 108  -3.661 -25.321  -1.600
  318    HD2  TYR 108           HD2      TYR 108  -5.100 -21.926  -3.827
  319    HE1  TYR 108           HE1      TYR 108  -1.963 -23.873  -0.485
  320    HE2  TYR 108           HE2      TYR 108  -3.414 -20.478  -2.714
  321    HH   TYR 108           HH       TYR 108  -1.669 -20.368  -1.213
  322    H    HIS 109           H        HIS 109  -8.000 -23.370  -4.618
  323    HA   HIS 109           HA       HIS 109  -8.297 -20.875  -3.193
  324    HB2  HIS 109           HB2      HIS 109  -9.405 -22.005  -5.771
  325    HB3  HIS 109           HB3      HIS 109 -10.112 -20.544  -5.089
  326    HD1  HIS 109           HD1      HIS 109  -8.910 -18.317  -5.619
  327    HD2  HIS 109           HD2      HIS 109  -6.529 -21.761  -6.170
  328    HE1  HIS 109           HE1      HIS 109  -6.687 -17.515  -6.648
  329    HE2  HIS 109           HE2      HIS 109  -5.246 -19.617  -6.984
  330    H    ALA 110           H        ALA 110 -10.597 -23.649  -3.511
  331    HA   ALA 110           HA       ALA 110 -12.734 -22.351  -2.161
  332    HB1  ALA 110           HB1      ALA 110 -12.991 -24.440  -3.449
  333    HB2  ALA 110           HB2      ALA 110 -11.998 -25.311  -2.257
  334    HB3  ALA 110           HB3      ALA 110 -13.572 -24.636  -1.788
  335    H    ALA 111           H        ALA 111 -10.006 -24.334  -0.840
  336    HA   ALA 111           HA       ALA 111 -10.777 -24.259   1.820
  337    HB1  ALA 111           HB1      ALA 111  -8.473 -24.929   2.264
  338    HB2  ALA 111           HB2      ALA 111  -9.104 -25.756   0.819
  339    HB3  ALA 111           HB3      ALA 111  -7.981 -24.380   0.648
  340    H    THR 112           H        THR 112  -8.825 -21.877  -0.017
  341    HA   THR 112           HA       THR 112  -8.299 -20.240   2.357
  342    HB   THR 112           HB       THR 112  -7.295 -18.630   0.801
  343    HG1  THR 112           HG1      THR 112  -7.146 -19.152  -1.363
  344   HG21  THR 112          HG21      THR 112  -5.935 -20.491   1.715
  345   HG22  THR 112          HG22      THR 112  -6.362 -21.496   0.312
  346   HG23  THR 112          HG23      THR 112  -5.408 -20.012   0.094
  347    H    LEU 113           H        LEU 113 -10.676 -20.005  -0.335
  348    HA   LEU 113           HA       LEU 113 -11.509 -17.368   0.545
  349    HB2  LEU 113           HB2      LEU 113 -11.179 -17.972  -1.824
  350    HB3  LEU 113           HB3      LEU 113 -12.432 -19.216  -1.675
  351    HG   LEU 113           HG       LEU 113 -14.118 -17.532  -1.240
  352   HD11  LEU 113          HD11      LEU 113 -13.633 -15.113  -1.676
  353   HD12  LEU 113          HD12      LEU 113 -12.816 -15.704  -0.231
  354   HD13  LEU 113          HD13      LEU 113 -11.900 -15.494  -1.741
  355   HD21  LEU 113          HD21      LEU 113 -12.482 -16.964  -3.746
  356   HD22  LEU 113          HD22      LEU 113 -13.677 -18.264  -3.546
  357   HD23  LEU 113          HD23      LEU 113 -14.204 -16.571  -3.515
  358    H    GLU 114           H        GLU 114 -12.955 -20.632   0.604
  359    HA   GLU 114           HA       GLU 114 -15.516 -19.540   1.581
  360    HB2  GLU 114           HB2      GLU 114 -14.747 -22.428   1.037
  361    HB3  GLU 114           HB3      GLU 114 -16.345 -21.841   1.431
  362    HG2  GLU 114           HG2      GLU 114 -14.750 -21.185  -1.077
  363    HG3  GLU 114           HG3      GLU 114 -16.145 -22.248  -0.959
  364    H    HIS 115           H        HIS 115 -16.598 -20.167   3.458
  365    HA   HIS 115           HA       HIS 115 -15.048 -21.427   5.673
  366    HB2  HIS 115           HB2      HIS 115 -14.621 -18.997   5.769
  367    HB3  HIS 115           HB3      HIS 115 -16.349 -18.671   5.806
  368    HD1  HIS 115           HD1      HIS 115 -17.278 -18.372   8.222
  369    HD2  HIS 115           HD2      HIS 115 -13.688 -20.589   7.963
  370    HE1  HIS 115           HE1      HIS 115 -16.497 -18.783  10.647
  371    HE2  HIS 115           HE2      HIS 115 -14.313 -20.146  10.477
  372    H    HIS 116           H        HIS 116 -16.262 -23.082   6.256
  373    HA   HIS 116           HA       HIS 116 -18.041 -24.485   6.630
  374    HB2  HIS 116           HB2      HIS 116 -19.068 -22.059   8.138
  375    HB3  HIS 116           HB3      HIS 116 -19.529 -23.730   8.422
  376    HD1  HIS 116           HD1      HIS 116 -18.043 -21.731  10.560
  377    HD2  HIS 116           HD2      HIS 116 -16.457 -24.975   8.370
  378    HE1  HIS 116           HE1      HIS 116 -15.994 -22.579  11.884
  379    HE2  HIS 116           HE2      HIS 116 -15.037 -24.551  10.534
  380    H    HIS 117           H        HIS 117 -18.330 -23.760   4.101
  381    HA   HIS 117           HA       HIS 117 -20.828 -22.511   3.416
  382    HB2  HIS 117           HB2      HIS 117 -18.742 -22.745   1.972
  383    HB3  HIS 117           HB3      HIS 117 -19.197 -24.416   1.677
  384    HD1  HIS 117           HD1      HIS 117 -21.461 -24.741   0.073
  385    HD2  HIS 117           HD2      HIS 117 -20.052 -20.802   0.738
  386    HE1  HIS 117           HE1      HIS 117 -22.600 -23.247  -1.682
  387    HE2  HIS 117           HE2      HIS 117 -21.746 -20.853  -1.269
  388    H    HIS 118           H        HIS 118 -22.776 -23.375   2.646
  389    HA   HIS 118           HA       HIS 118 -23.766 -25.837   3.776
  390    HB2  HIS 118           HB2      HIS 118 -25.190 -23.874   3.338
  391    HB3  HIS 118           HB3      HIS 118 -24.905 -24.013   1.602
  392    HD1  HIS 118           HD1      HIS 118 -26.830 -25.788   4.438
  393    HD2  HIS 118           HD2      HIS 118 -26.287 -25.870   0.246
  394    HE1  HIS 118           HE1      HIS 118 -28.556 -27.464   3.509
  395    HE2  HIS 118           HE2      HIS 118 -28.182 -27.549   0.958
  396    H    HIS 119           H        HIS 119 -24.391 -27.775   2.773
  397    HA   HIS 119           HA       HIS 119 -23.609 -28.312  -0.047
  398    HB2  HIS 119           HB2      HIS 119 -22.835 -30.078   2.319
  399    HB3  HIS 119           HB3      HIS 119 -22.676 -30.536   0.625
  400    HD1  HIS 119           HD1      HIS 119 -20.803 -28.695   3.313
  401    HD2  HIS 119           HD2      HIS 119 -20.880 -29.029  -0.900
  402    HE1  HIS 119           HE1      HIS 119 -18.566 -27.740   2.468
  403    HE2  HIS 119           HE2      HIS 119 -18.619 -27.958  -0.104
  404    H    HIS 120           H        HIS 120 -24.944 -29.711  -1.099
  405    HA   HIS 120           HA       HIS 120 -27.024 -30.439  -1.680
  406    HB2  HIS 120           HB2      HIS 120 -27.454 -32.694  -0.851
  407    HB3  HIS 120           HB3      HIS 120 -25.780 -32.429  -1.302
  408    HD1  HIS 120           HD1      HIS 120 -27.679 -32.052   2.035
  409    HD2  HIS 120           HD2      HIS 120 -24.183 -33.679   0.342
  410    HE1  HIS 120           HE1      HIS 120 -26.403 -33.236   3.986
  411    HE2  HIS 120           HE2      HIS 120 -24.258 -34.205   2.921
  Start of MODEL    4
    1    H1   SER  66           H1       SER  66  31.401 -35.115  -8.399
    2    H2   SER  66           H2       SER  66  31.082 -36.635  -7.867
    3    H3   SER  66           H3       SER  66  29.923 -35.781  -8.650
    4    HA   SER  66           HA       SER  66  31.084 -35.137  -6.014
    5    HB2  SER  66           HB2      SER  66  28.861 -33.668  -7.495
    6    HB3  SER  66           HB3      SER  66  29.493 -33.293  -5.879
    7    HG   SER  66           HG       SER  66  30.473 -31.985  -7.508
    8    H    GLY  67           H        GLY  67  29.684 -35.406  -4.196
    9    HA2  GLY  67           HA2      GLY  67  27.934 -37.725  -4.310
   10    HA3  GLY  67           HA3      GLY  67  28.282 -36.720  -2.906
   11    H    SER  68           H        SER  68  25.783 -37.732  -3.262
   12    HA   SER  68           HA       SER  68  23.974 -36.010  -4.685
   13    HB2  SER  68           HB2      SER  68  23.373 -38.044  -2.508
   14    HB3  SER  68           HB3      SER  68  22.225 -37.377  -3.685
   15    HG   SER  68           HG       SER  68  23.029 -39.433  -4.345
   16    H    GLY  69           H        GLY  69  25.359 -35.599  -1.547
   17    HA2  GLY  69           HA2      GLY  69  25.043 -33.951   0.063
   18    HA3  GLY  69           HA3      GLY  69  23.909 -33.160  -1.018
   19    H    ARG  70           H        ARG  70  22.667 -32.654   0.878
   20    HA   ARG  70           HA       ARG  70  21.470 -34.753   2.530
   21    HB2  ARG  70           HB2      ARG  70  20.919 -31.760   2.330
   22    HB3  ARG  70           HB3      ARG  70  20.198 -32.847   3.528
   23    HG2  ARG  70           HG2      ARG  70  22.421 -33.430   4.406
   24    HG3  ARG  70           HG3      ARG  70  23.192 -32.347   3.231
   25    HD2  ARG  70           HD2      ARG  70  21.985 -30.419   4.197
   26    HD3  ARG  70           HD3      ARG  70  21.204 -31.493   5.379
   27    HE   ARG  70           HE       ARG  70  23.970 -31.913   5.648
   28   HH11  ARG  70          HH21      ARG  70  21.832 -29.177   6.137
   29   HH12  ARG  70          HH22      ARG  70  22.852 -28.483   7.371
   30   HH21  ARG  70          HH11      ARG  70  25.224 -30.977   7.218
   31   HH22  ARG  70          HH12      ARG  70  24.736 -29.482   7.957
   32    H    GLY  71           H        GLY  71  20.525 -33.328  -0.474
   33    HA2  GLY  71           HA2      GLY  71  18.787 -33.822  -1.892
   34    HA3  GLY  71           HA3      GLY  71  18.345 -35.147  -0.821
   35    H    ARG  72           H        ARG  72  18.354 -31.914   0.516
   36    HA   ARG  72           HA       ARG  72  15.457 -32.078   1.043
   37    HB2  ARG  72           HB2      ARG  72  17.577 -30.096   1.972
   38    HB3  ARG  72           HB3      ARG  72  15.880 -30.081   2.475
   39    HG2  ARG  72           HG2      ARG  72  16.114 -32.338   3.453
   40    HG3  ARG  72           HG3      ARG  72  17.813 -32.392   2.957
   41    HD2  ARG  72           HD2      ARG  72  18.278 -30.392   4.356
   42    HD3  ARG  72           HD3      ARG  72  16.582 -30.398   4.893
   43    HE   ARG  72           HE       ARG  72  17.689 -32.979   5.367
   44   HH11  ARG  72          HH11      ARG  72  17.963 -29.742   6.700
   45   HH12  ARG  72          HH12      ARG  72  18.454 -30.329   8.265
   46   HH21  ARG  72          HH21      ARG  72  18.317 -33.660   7.388
   47   HH22  ARG  72          HH22      ARG  72  18.643 -32.497   8.639
   48    H    GLY  73           H        GLY  73  13.948 -30.447   0.612
   49    HA2  GLY  73           HA2      GLY  73  14.114 -29.188  -1.994
   50    HA3  GLY  73           HA3      GLY  73  12.798 -29.039  -0.836
   51    H    ALA  74           H        ALA  74  13.917 -26.964  -2.483
   52    HA   ALA  74           HA       ALA  74  14.721 -24.980  -0.414
   53    HB1  ALA  74           HB1      ALA  74  16.531 -24.166  -1.868
   54    HB2  ALA  74           HB2      ALA  74  16.770 -25.880  -1.515
   55    HB3  ALA  74           HB3      ALA  74  16.122 -25.386  -3.094
   56    H    ILE  75           H        ILE  75  12.169 -25.414  -1.591
   57    HA   ILE  75           HA       ILE  75  11.706 -22.735  -2.795
   58    HB   ILE  75           HB       ILE  75  10.366 -25.296  -3.752
   59   HG12  ILE  75          HG12      ILE  75  12.364 -23.486  -5.187
   60   HG13  ILE  75          HG13      ILE  75  12.681 -25.121  -4.604
   61   HG21  ILE  75          HG21      ILE  75   9.227 -23.855  -5.403
   62   HG22  ILE  75          HG22      ILE  75   8.839 -23.322  -3.784
   63   HG23  ILE  75          HG23      ILE  75  10.041 -22.418  -4.736
   64   HD11  ILE  75          HD11      ILE  75  12.352 -25.272  -6.945
   65   HD12  ILE  75          HD12      ILE  75  10.926 -25.990  -6.180
   66   HD13  ILE  75          HD13      ILE  75  10.840 -24.358  -6.890
   67    H    ASP  76           H        ASP  76  10.090 -21.629  -1.881
   68    HA   ASP  76           HA       ASP  76   8.069 -22.999  -0.156
   69    HB2  ASP  76           HB2      ASP  76   9.993 -22.399   1.268
   70    HB3  ASP  76           HB3      ASP  76   9.866 -20.722   0.747
   71    H    ARG  77           H        ARG  77   9.077 -19.853  -1.589
   72    HA   ARG  77           HA       ARG  77   6.463 -18.634  -1.265
   73    HB2  ARG  77           HB2      ARG  77   8.904 -17.829  -2.900
   74    HB3  ARG  77           HB3      ARG  77   7.460 -16.825  -2.688
   75    HG2  ARG  77           HG2      ARG  77   7.796 -16.823  -0.229
   76    HG3  ARG  77           HG3      ARG  77   9.282 -17.773  -0.431
   77    HD2  ARG  77           HD2      ARG  77  10.245 -15.967  -1.829
   78    HD3  ARG  77           HD3      ARG  77   8.762 -15.006  -1.598
   79    HE   ARG  77           HE       ARG  77   9.774 -15.731   0.963
   80   HH11  ARG  77          HH11      ARG  77  10.705 -13.616  -1.670
   81   HH12  ARG  77          HH12      ARG  77  11.574 -12.526  -0.621
   82   HH21  ARG  77          HH21      ARG  77  10.887 -14.302   2.251
   83   HH22  ARG  77          HH22      ARG  77  11.660 -12.907   1.553
   84    H    GLU  78           H        GLU  78   7.767 -20.628  -3.790
   85    HA   GLU  78           HA       GLU  78   6.153 -19.695  -5.968
   86    HB2  GLU  78           HB2      GLU  78   8.215 -21.163  -6.111
   87    HB3  GLU  78           HB3      GLU  78   7.183 -22.505  -5.596
   88    HG2  GLU  78           HG2      GLU  78   7.256 -22.593  -7.971
   89    HG3  GLU  78           HG3      GLU  78   5.662 -21.970  -7.536
   90    H    GLN  79           H        GLN  79   4.059 -19.953  -6.471
   91    HA   GLN  79           HA       GLN  79   2.292 -20.978  -4.455
   92    HB2  GLN  79           HB2      GLN  79   1.702 -20.168  -7.327
   93    HB3  GLN  79           HB3      GLN  79   0.500 -20.410  -6.060
   94    HG2  GLN  79           HG2      GLN  79   2.689 -18.274  -6.066
   95    HG3  GLN  79           HG3      GLN  79   0.987 -18.022  -6.396
   96   HE21  GLN  79          HE22      GLN  79   3.393 -18.424  -3.794
   97   HE22  GLN  79          HE21      GLN  79   2.223 -18.179  -2.511
   98    H    SER  80           H        SER  80   3.516 -22.478  -7.445
   99    HA   SER  80           HA       SER  80   1.936 -24.833  -7.445
  100    HB2  SER  80           HB2      SER  80   4.910 -24.613  -8.079
  101    HB3  SER  80           HB3      SER  80   3.788 -25.849  -8.676
  102    HG   SER  80           HG       SER  80   2.701 -24.227  -9.862
  103    H    ALA  81           H        ALA  81   5.012 -24.186  -5.631
  104    HA   ALA  81           HA       ALA  81   5.056 -26.699  -4.331
  105    HB1  ALA  81           HB1      ALA  81   6.330 -24.060  -3.507
  106    HB2  ALA  81           HB2      ALA  81   6.780 -25.668  -2.916
  107    HB3  ALA  81           HB3      ALA  81   7.031 -25.250  -4.625
  108    H    ALA  82           H        ALA  82   3.680 -23.536  -3.328
  109    HA   ALA  82           HA       ALA  82   2.805 -24.333  -0.744
  110    HB1  ALA  82           HB1      ALA  82   1.353 -22.370  -0.874
  111    HB2  ALA  82           HB2      ALA  82   2.942 -21.989  -1.564
  112    HB3  ALA  82           HB3      ALA  82   1.550 -22.296  -2.633
  113    H    ILE  83           H        ILE  83   1.030 -24.520  -3.892
  114    HA   ILE  83           HA       ILE  83  -1.322 -25.727  -2.717
  115    HB   ILE  83           HB       ILE  83  -0.378 -25.567  -5.600
  116   HG12  ILE  83          HG12      ILE  83  -2.512 -24.037  -4.042
  117   HG13  ILE  83          HG13      ILE  83  -0.929 -23.400  -4.411
  118   HG21  ILE  83          HG21      ILE  83  -3.115 -26.423  -4.510
  119   HG22  ILE  83          HG22      ILE  83  -2.703 -26.197  -6.222
  120   HG23  ILE  83          HG23      ILE  83  -1.956 -27.499  -5.313
  121   HD11  ILE  83          HD11      ILE  83  -2.433 -22.439  -5.969
  122   HD12  ILE  83          HD12      ILE  83  -1.457 -23.616  -6.872
  123   HD13  ILE  83          HD13      ILE  83  -3.135 -23.997  -6.400
  124    H    ARG  84           H        ARG  84   1.584 -27.160  -4.300
  125    HA   ARG  84           HA       ARG  84   0.748 -29.897  -4.091
  126    HB2  ARG  84           HB2      ARG  84   2.674 -29.173  -5.442
  127    HB3  ARG  84           HB3      ARG  84   3.540 -28.650  -3.994
  128    HG2  ARG  84           HG2      ARG  84   3.671 -30.965  -3.183
  129    HG3  ARG  84           HG3      ARG  84   2.693 -31.535  -4.545
  130    HD2  ARG  84           HD2      ARG  84   5.386 -30.137  -4.838
  131    HD3  ARG  84           HD3      ARG  84   5.200 -31.880  -4.735
  132    HE   ARG  84           HE       ARG  84   3.796 -31.820  -6.789
  133   HH11  ARG  84          HH11      ARG  84   6.060 -29.154  -6.403
  134   HH12  ARG  84          HH12      ARG  84   6.129 -28.879  -8.120
  135   HH21  ARG  84          HH21      ARG  84   3.958 -31.451  -8.886
  136   HH22  ARG  84          HH22      ARG  84   4.921 -30.139  -9.509
  137    H    GLU  85           H        GLU  85   2.658 -27.948  -1.713
  138    HA   GLU  85           HA       GLU  85   2.678 -29.903   0.294
  139    HB2  GLU  85           HB2      GLU  85   4.136 -27.891   0.182
  140    HB3  GLU  85           HB3      GLU  85   2.740 -26.925   0.687
  141    HG2  GLU  85           HG2      GLU  85   3.934 -27.393   2.673
  142    HG3  GLU  85           HG3      GLU  85   2.523 -28.455   2.671
  143    H    TRP  86           H        TRP  86   0.229 -27.256  -0.136
  144    HA   TRP  86           HA       TRP  86  -1.410 -27.978   1.978
  145    HB2  TRP  86           HB2      TRP  86  -1.761 -25.947   0.740
  146    HB3  TRP  86           HB3      TRP  86  -2.082 -26.832  -0.750
  147    HD1  TRP  86           HD1      TRP  86  -3.695 -25.943   2.602
  148    HE1  TRP  86           HE1      TRP  86  -6.224 -26.380   2.495
  149    HE3  TRP  86           HE3      TRP  86  -3.961 -28.094  -2.046
  150    HZ2  TRP  86           HZ2      TRP  86  -8.087 -27.683   0.714
  151    HZ3  TRP  86           HZ3      TRP  86  -6.140 -28.877  -2.936
  152    HH2  TRP  86           HH2      TRP  86  -8.198 -28.712  -1.551
  153    H    ALA  87           H        ALA  87  -1.542 -29.257  -1.390
  154    HA   ALA  87           HA       ALA  87  -3.670 -31.094  -0.966
  155    HB1  ALA  87           HB1      ALA  87  -2.785 -32.140  -3.073
  156    HB2  ALA  87           HB2      ALA  87  -2.935 -30.370  -3.179
  157    HB3  ALA  87           HB3      ALA  87  -1.342 -31.116  -2.943
  158    H    ARG  88           H        ARG  88  -0.125 -31.582  -0.664
  159    HA   ARG  88           HA       ARG  88  -0.134 -34.331   0.057
  160    HB2  ARG  88           HB2      ARG  88   1.836 -32.870  -0.620
  161    HB3  ARG  88           HB3      ARG  88   1.823 -32.187   1.011
  162    HG2  ARG  88           HG2      ARG  88   2.195 -34.527   1.921
  163    HG3  ARG  88           HG3      ARG  88   2.248 -35.108   0.250
  164    HD2  ARG  88           HD2      ARG  88   4.515 -34.855   0.841
  165    HD3  ARG  88           HD3      ARG  88   4.159 -33.452  -0.151
  166    HE   ARG  88           HE       ARG  88   4.481 -32.037   1.684
  167   HH11  ARG  88          HH11      ARG  88   4.548 -35.352   2.878
  168   HH12  ARG  88          HH12      ARG  88   5.129 -34.861   4.445
  169   HH21  ARG  88          HH21      ARG  88   5.092 -31.482   3.699
  170   HH22  ARG  88          HH22      ARG  88   5.474 -32.712   4.885
  171    H    ARG  89           H        ARG  89  -0.269 -31.456   2.197
  172    HA   ARG  89           HA       ARG  89  -0.463 -32.987   4.658
  173    HB2  ARG  89           HB2      ARG  89  -1.085 -30.073   4.009
  174    HB3  ARG  89           HB3      ARG  89  -1.145 -30.762   5.638
  175    HG2  ARG  89           HG2      ARG  89   1.237 -31.448   5.460
  176    HG3  ARG  89           HG3      ARG  89   1.323 -30.719   3.853
  177    HD2  ARG  89           HD2      ARG  89   0.670 -28.508   4.901
  178    HD3  ARG  89           HD3      ARG  89   0.784 -29.297   6.489
  179    HE   ARG  89           HE       ARG  89   3.171 -29.591   4.784
  180   HH11  ARG  89          HH11      ARG  89   1.808 -27.492   7.261
  181   HH12  ARG  89          HH12      ARG  89   3.367 -26.792   7.596
  182   HH21  ARG  89          HH21      ARG  89   4.970 -28.689   5.174
  183   HH22  ARG  89          HH22      ARG  89   5.186 -27.480   6.440
  184    H    ASN  90           H        ASN  90  -2.929 -31.923   2.395
  185    HA   ASN  90           HA       ASN  90  -5.098 -32.831   4.206
  186    HB2  ASN  90           HB2      ASN  90  -5.076 -31.412   1.522
  187    HB3  ASN  90           HB3      ASN  90  -6.545 -32.050   2.261
  188   HD21  ASN  90          HD22      ASN  90  -4.003 -29.614   2.646
  189   HD22  ASN  90          HD21      ASN  90  -4.895 -28.681   3.847
  190    H    GLY  91           H        GLY  91  -2.996 -34.527   2.313
  191    HA2  GLY  91           HA2      GLY  91  -3.004 -36.724   1.658
  192    HA3  GLY  91           HA3      GLY  91  -4.616 -36.903   2.355
  193    H    HIS  92           H        HIS  92  -4.139 -34.482  -0.136
  194    HA   HIS  92           HA       HIS  92  -5.969 -35.943  -1.972
  195    HB2  HIS  92           HB2      HIS  92  -4.827 -33.121  -2.146
  196    HB3  HIS  92           HB3      HIS  92  -6.080 -33.796  -3.179
  197    HD1  HIS  92           HD1      HIS  92  -7.694 -35.073  -0.467
  198    HD2  HIS  92           HD2      HIS  92  -6.487 -31.136  -1.409
  199    HE1  HIS  92           HE1      HIS  92  -9.259 -33.504   0.834
  200    HE2  HIS  92           HE2      HIS  92  -8.526 -31.102   0.248
  201    H    ASN  93           H        ASN  93  -5.485 -36.342  -4.172
  202    HA   ASN  93           HA       ASN  93  -2.784 -37.287  -4.610
  203    HB2  ASN  93           HB2      ASN  93  -5.229 -37.131  -6.419
  204    HB3  ASN  93           HB3      ASN  93  -3.706 -37.873  -6.898
  205   HD21  ASN  93          HD22      ASN  93  -5.896 -39.440  -7.041
  206   HD22  ASN  93          HD21      ASN  93  -5.854 -40.628  -5.747
  207    H    VAL  94           H        VAL  94  -1.090 -36.319  -5.508
  208    HA   VAL  94           HA       VAL  94  -1.323 -34.284  -7.583
  209    HB   VAL  94           HB       VAL  94  -1.569 -32.930  -5.528
  210   HG11  VAL  94          HG11      VAL  94   1.243 -33.807  -4.764
  211   HG12  VAL  94          HG12      VAL  94   0.269 -32.566  -3.966
  212   HG13  VAL  94          HG13      VAL  94  -0.255 -34.251  -3.915
  213   HG21  VAL  94          HG21      VAL  94   0.035 -31.222  -6.049
  214   HG22  VAL  94          HG22      VAL  94   1.111 -32.381  -6.853
  215   HG23  VAL  94          HG23      VAL  94  -0.477 -31.997  -7.557
  216    H    SER  95           H        SER  95   0.549 -34.125  -8.860
  217    HA   SER  95           HA       SER  95   2.511 -36.293  -8.520
  218    HB2  SER  95           HB2      SER  95   1.624 -35.763 -10.763
  219    HB3  SER  95           HB3      SER  95   2.349 -34.147 -10.656
  220    HG   SER  95           HG       SER  95   3.581 -36.664 -10.958
  221    H    THR  96           H        THR  96   4.677 -36.087  -8.055
  222    HA   THR  96           HA       THR  96   5.647 -33.603  -6.800
  223    HB   THR  96           HB       THR  96   7.700 -34.976  -6.399
  224    HG1  THR  96           HG1      THR  96   7.519 -37.212  -6.861
  225   HG21  THR  96          HG21      THR  96   5.862 -34.910  -4.730
  226   HG22  THR  96          HG22      THR  96   5.104 -36.316  -5.510
  227   HG23  THR  96          HG23      THR  96   6.698 -36.470  -4.740
  228    H    ARG  97           H        ARG  97   5.804 -35.044  -9.941
  229    HA   ARG  97           HA       ARG  97   8.026 -33.188 -10.782
  230    HB2  ARG  97           HB2      ARG  97   7.260 -35.910 -11.910
  231    HB3  ARG  97           HB3      ARG  97   8.534 -34.872 -12.536
  232    HG2  ARG  97           HG2      ARG  97   8.493 -36.195  -9.788
  233    HG3  ARG  97           HG3      ARG  97   9.439 -36.706 -11.174
  234    HD2  ARG  97           HD2      ARG  97   9.759 -34.072  -9.674
  235    HD3  ARG  97           HD3      ARG  97  10.799 -35.470  -9.514
  236    HE   ARG  97           HE       ARG  97  10.756 -33.512 -11.696
  237   HH11  ARG  97          HH11      ARG  97  11.957 -36.696 -10.815
  238   HH12  ARG  97          HH12      ARG  97  13.169 -36.674 -12.061
  239   HH21  ARG  97          HH21      ARG  97  12.315 -33.573 -13.277
  240   HH22  ARG  97          HH22      ARG  97  13.372 -34.947 -13.403
  241    H    GLY  98           H        GLY  98   4.876 -34.486 -11.714
  242    HA2  GLY  98           HA2      GLY  98   4.695 -32.909 -14.186
  243    HA3  GLY  98           HA3      GLY  98   3.449 -33.924 -13.467
  244    H    ARG  99           H        ARG  99   2.499 -31.759 -14.470
  245    HA   ARG  99           HA       ARG  99   2.367 -29.444 -12.682
  246    HB2  ARG  99           HB2      ARG  99   0.649 -30.278 -15.065
  247    HB3  ARG  99           HB3      ARG  99   0.504 -28.740 -14.207
  248    HG2  ARG  99           HG2      ARG  99   2.868 -28.191 -14.790
  249    HG3  ARG  99           HG3      ARG  99   2.993 -29.709 -15.685
  250    HD2  ARG  99           HD2      ARG  99   1.150 -28.989 -17.178
  251    HD3  ARG  99           HD3      ARG  99   1.026 -27.459 -16.315
  252    HE   ARG  99           HE       ARG  99   3.134 -28.327 -18.203
  253   HH11  ARG  99          HH11      ARG  99   2.256 -25.818 -15.907
  254   HH12  ARG  99          HH12      ARG  99   3.407 -24.690 -16.574
  255   HH21  ARG  99          HH21      ARG  99   4.563 -26.850 -18.992
  256   HH22  ARG  99          HH22      ARG  99   4.679 -25.267 -18.282
  257    H    ILE 100           H        ILE 100   0.491 -28.700 -11.577
  258    HA   ILE 100           HA       ILE 100  -0.878 -30.812 -10.069
  259    HB   ILE 100           HB       ILE 100  -1.057 -27.802  -9.800
  260   HG12  ILE 100          HG12      ILE 100   0.637 -29.931  -8.419
  261   HG13  ILE 100          HG13      ILE 100   1.200 -28.558  -9.359
  262   HG21  ILE 100          HG21      ILE 100  -3.070 -28.983  -8.884
  263   HG22  ILE 100          HG22      ILE 100  -2.003 -30.009  -7.893
  264   HG23  ILE 100          HG23      ILE 100  -2.109 -28.257  -7.622
  265   HD11  ILE 100          HD11      ILE 100  -0.046 -28.494  -6.608
  266   HD12  ILE 100          HD12      ILE 100   1.593 -28.042  -7.107
  267   HD13  ILE 100          HD13      ILE 100   0.216 -27.033  -7.604
  268    HA   PRO 101           HA       PRO 101  -4.507 -30.636 -12.756
  269    HB2  PRO 101           HB2      PRO 101  -6.098 -31.645 -10.437
  270    HB3  PRO 101           HB3      PRO 101  -5.920 -32.341 -12.071
  271    HG2  PRO 101           HG2      PRO 101  -4.690 -33.446  -9.893
  272    HG3  PRO 101           HG3      PRO 101  -3.889 -33.396 -11.505
  273    HD2  PRO 101           HD2      PRO 101  -3.479 -31.553  -9.140
  274    HD3  PRO 101           HD3      PRO 101  -2.271 -32.326 -10.214
  275    H    ALA 102           H        ALA 102  -6.035 -29.065 -13.204
  276    HA   ALA 102           HA       ALA 102  -6.223 -26.766 -11.635
  277    HB1  ALA 102           HB1      ALA 102  -7.933 -26.063 -13.173
  278    HB2  ALA 102           HB2      ALA 102  -6.615 -26.873 -14.046
  279    HB3  ALA 102           HB3      ALA 102  -8.153 -27.735 -13.754
  280    H    ASP 103           H        ASP 103  -8.327 -29.633 -11.582
  281    HA   ASP 103           HA       ASP 103 -10.370 -28.688  -9.972
  282    HB2  ASP 103           HB2      ASP 103 -10.322 -30.869 -11.117
  283    HB3  ASP 103           HB3      ASP 103  -9.071 -31.434 -10.007
  284    H    VAL 104           H        VAL 104  -7.099 -29.772  -9.016
  285    HA   VAL 104           HA       VAL 104  -7.624 -29.614  -6.184
  286    HB   VAL 104           HB       VAL 104  -4.988 -29.904  -7.588
  287   HG11  VAL 104          HG11      VAL 104  -5.746 -30.515  -4.709
  288   HG12  VAL 104          HG12      VAL 104  -4.185 -30.891  -5.468
  289   HG13  VAL 104          HG13      VAL 104  -4.671 -29.208  -5.256
  290   HG21  VAL 104          HG21      VAL 104  -6.472 -31.823  -8.151
  291   HG22  VAL 104          HG22      VAL 104  -5.158 -32.329  -7.092
  292   HG23  VAL 104          HG23      VAL 104  -6.788 -32.072  -6.423
  293    H    ILE 105           H        ILE 105  -6.049 -27.554  -8.653
  294    HA   ILE 105           HA       ILE 105  -5.217 -25.450  -6.870
  295    HB   ILE 105           HB       ILE 105  -6.009 -25.544  -9.807
  296   HG12  ILE 105          HG12      ILE 105  -3.236 -24.926  -8.729
  297   HG13  ILE 105          HG13      ILE 105  -3.788 -26.589  -8.646
  298   HG21  ILE 105          HG21      ILE 105  -6.436 -23.253  -9.168
  299   HG22  ILE 105          HG22      ILE 105  -4.915 -23.171  -8.237
  300   HG23  ILE 105          HG23      ILE 105  -4.893 -23.292 -10.013
  301   HD11  ILE 105          HD11      ILE 105  -3.778 -24.991 -11.227
  302   HD12  ILE 105          HD12      ILE 105  -2.501 -26.112 -10.702
  303   HD13  ILE 105          HD13      ILE 105  -4.141 -26.723 -10.994
  304    H    ASP 106           H        ASP 106  -8.342 -25.908  -8.641
  305    HA   ASP 106           HA       ASP 106  -9.685 -23.765  -7.474
  306    HB2  ASP 106           HB2      ASP 106 -10.487 -25.013  -9.424
  307    HB3  ASP 106           HB3      ASP 106 -10.786 -26.429  -8.411
  308    H    ALA 107           H        ALA 107  -9.504 -27.195  -6.306
  309    HA   ALA 107           HA       ALA 107 -10.982 -26.959  -4.010
  310    HB1  ALA 107           HB1      ALA 107  -9.739 -28.928  -3.237
  311    HB2  ALA 107           HB2      ALA 107 -10.079 -29.068  -4.965
  312    HB3  ALA 107           HB3      ALA 107  -8.449 -28.624  -4.420
  313    H    TYR 108           H        TYR 108  -7.483 -26.204  -4.375
  314    HA   TYR 108           HA       TYR 108  -6.978 -25.349  -1.708
  315    HB2  TYR 108           HB2      TYR 108  -5.146 -25.784  -3.153
  316    HB3  TYR 108           HB3      TYR 108  -5.733 -24.695  -4.388
  317    HD1  TYR 108           HD2      TYR 108  -4.248 -24.814  -0.974
  318    HD2  TYR 108           HD1      TYR 108  -5.220 -22.353  -4.380
  319    HE1  TYR 108           HE2      TYR 108  -2.832 -22.994  -0.053
  320    HE2  TYR 108           HE1      TYR 108  -3.815 -20.516  -3.444
  321    HH   TYR 108           HH       TYR 108  -2.029 -20.848  -0.347
  322    H    HIS 109           H        HIS 109  -7.940 -23.369  -4.603
  323    HA   HIS 109           HA       HIS 109  -8.141 -20.938  -3.103
  324    HB2  HIS 109           HB2      HIS 109  -9.321 -21.781  -5.768
  325    HB3  HIS 109           HB3      HIS 109  -9.585 -20.180  -5.082
  326    HD1  HIS 109           HD1      HIS 109  -7.049 -18.920  -4.326
  327    HD2  HIS 109           HD2      HIS 109  -7.290 -21.820  -7.375
  328    HE1  HIS 109           HE1      HIS 109  -4.955 -18.598  -5.791
  329    HE2  HIS 109           HE2      HIS 109  -5.105 -20.368  -7.660
  330    H    ALA 110           H        ALA 110 -10.633 -23.477  -3.607
  331    HA   ALA 110           HA       ALA 110 -12.726 -22.029  -2.292
  332    HB1  ALA 110           HB1      ALA 110 -13.743 -24.241  -1.995
  333    HB2  ALA 110           HB2      ALA 110 -13.113 -24.051  -3.639
  334    HB3  ALA 110           HB3      ALA 110 -12.222 -25.030  -2.455
  335    H    ALA 111           H        ALA 111 -10.242 -24.315  -0.958
  336    HA   ALA 111           HA       ALA 111 -11.090 -24.207   1.673
  337    HB1  ALA 111           HB1      ALA 111  -8.290 -24.633   0.563
  338    HB2  ALA 111           HB2      ALA 111  -8.862 -25.161   2.160
  339    HB3  ALA 111           HB3      ALA 111  -9.558 -25.882   0.691
  340    H    THR 112           H        THR 112  -8.859 -22.005  -0.022
  341    HA   THR 112           HA       THR 112  -8.248 -20.488   2.418
  342    HB   THR 112           HB       THR 112  -7.021 -18.956   0.948
  343    HG1  THR 112           HG1      THR 112  -6.819 -19.505  -1.236
  344   HG21  THR 112          HG21      THR 112  -5.911 -20.999   1.839
  345   HG22  THR 112          HG22      THR 112  -6.369 -21.880   0.368
  346   HG23  THR 112          HG23      THR 112  -5.257 -20.503   0.270
  347    H    LEU 113           H        LEU 113 -10.227 -19.746  -0.512
  348    HA   LEU 113           HA       LEU 113 -10.910 -17.123   0.565
  349    HB2  LEU 113           HB2      LEU 113 -12.022 -18.571  -1.863
  350    HB3  LEU 113           HB3      LEU 113 -12.203 -16.861  -1.508
  351    HG   LEU 113           HG       LEU 113  -9.570 -18.277  -2.073
  352   HD11  LEU 113          HD11      LEU 113  -9.628 -17.052  -4.214
  353   HD12  LEU 113          HD12      LEU 113 -11.023 -18.128  -4.052
  354   HD13  LEU 113          HD13      LEU 113 -11.222 -16.381  -3.794
  355   HD21  LEU 113          HD21      LEU 113  -9.181 -16.316  -0.646
  356   HD22  LEU 113          HD22      LEU 113  -8.633 -15.984  -2.287
  357   HD23  LEU 113          HD23      LEU 113 -10.178 -15.306  -1.721
  358    H    GLU 114           H        GLU 114 -12.674 -20.165   0.236
  359    HA   GLU 114           HA       GLU 114 -15.120 -18.954   1.392
  360    HB2  GLU 114           HB2      GLU 114 -14.708 -21.786   0.394
  361    HB3  GLU 114           HB3      GLU 114 -16.225 -21.070   0.899
  362    HG2  GLU 114           HG2      GLU 114 -14.554 -20.220  -1.502
  363    HG3  GLU 114           HG3      GLU 114 -16.069 -21.106  -1.533
  364    H    HIS 115           H        HIS 115 -12.469 -19.659   2.899
  365    HA   HIS 115           HA       HIS 115 -13.016 -21.596   4.871
  366    HB2  HIS 115           HB2      HIS 115 -10.857 -20.192   4.217
  367    HB3  HIS 115           HB3      HIS 115 -11.375 -19.128   5.516
  368    HD1  HIS 115           HD1      HIS 115  -9.874 -22.522   4.799
  369    HD2  HIS 115           HD2      HIS 115 -11.300 -20.254   8.067
  370    HE1  HIS 115           HE1      HIS 115  -9.023 -23.712   6.947
  371    HE2  HIS 115           HE2      HIS 115  -9.894 -22.308   8.927
  372    H    HIS 116           H        HIS 116 -14.335 -18.406   4.659
  373    HA   HIS 116           HA       HIS 116 -15.682 -18.665   7.322
  374    HB2  HIS 116           HB2      HIS 116 -15.612 -16.219   7.476
  375    HB3  HIS 116           HB3      HIS 116 -14.006 -16.903   7.338
  376    HD1  HIS 116           HD1      HIS 116 -16.535 -14.911   5.203
  377    HD2  HIS 116           HD2      HIS 116 -12.496 -16.155   5.285
  378    HE1  HIS 116           HE1      HIS 116 -15.345 -13.671   3.272
  379    HE2  HIS 116           HE2      HIS 116 -12.887 -14.438   3.329
  380    H    HIS 117           H        HIS 117 -16.674 -19.750   4.755
  381    HA   HIS 117           HA       HIS 117 -18.672 -18.090   3.581
  382    HB2  HIS 117           HB2      HIS 117 -17.677 -20.178   2.619
  383    HB3  HIS 117           HB3      HIS 117 -18.614 -21.134   3.759
  384    HD1  HIS 117           HD1      HIS 117 -18.866 -19.269   0.466
  385    HD2  HIS 117           HD2      HIS 117 -21.307 -21.328   3.241
  386    HE1  HIS 117           HE1      HIS 117 -21.132 -19.662  -0.698
  387    HE2  HIS 117           HE2      HIS 117 -22.607 -20.936   1.000
  388    H    HIS 118           H        HIS 118 -20.937 -17.995   3.806
  389    HA   HIS 118           HA       HIS 118 -21.837 -17.845   6.518
  390    HB2  HIS 118           HB2      HIS 118 -24.018 -17.136   5.483
  391    HB3  HIS 118           HB3      HIS 118 -22.609 -16.224   4.988
  392    HD1  HIS 118           HD1      HIS 118 -25.163 -18.733   3.505
  393    HD2  HIS 118           HD2      HIS 118 -21.999 -16.125   2.435
  394    HE1  HIS 118           HE1      HIS 118 -25.194 -18.553   0.946
  395    HE2  HIS 118           HE2      HIS 118 -23.268 -16.965   0.293
  396    H    HIS 119           H        HIS 119 -23.274 -18.996   7.733
  397    HA   HIS 119           HA       HIS 119 -23.588 -21.832   7.031
  398    HB2  HIS 119           HB2      HIS 119 -24.278 -22.148   9.307
  399    HB3  HIS 119           HB3      HIS 119 -22.845 -21.140   9.270
  400    HD1  HIS 119           HD1      HIS 119 -26.587 -20.958  10.161
  401    HD2  HIS 119           HD2      HIS 119 -23.043 -18.653  10.266
  402    HE1  HIS 119           HE1      HIS 119 -27.112 -18.882  11.586
  403    HE2  HIS 119           HE2      HIS 119 -24.945 -17.485  11.651
  404    H    HIS 120           H        HIS 120 -25.729 -19.063   7.098
  405    HA   HIS 120           HA       HIS 120 -28.184 -20.647   6.727
  406    HB2  HIS 120           HB2      HIS 120 -28.052 -18.421   7.957
  407    HB3  HIS 120           HB3      HIS 120 -27.771 -17.655   6.390
  408    HD1  HIS 120           HD1      HIS 120 -30.060 -19.625   4.944
  409    HD2  HIS 120           HD2      HIS 120 -30.362 -17.104   8.312
  410    HE1  HIS 120           HE1      HIS 120 -32.578 -19.027   5.189
  411    HE2  HIS 120           HE2      HIS 120 -32.742 -17.485   7.253
  Start of MODEL    5
    1    H1   SER  66           H1       SER  66  -2.431  -1.250 -15.158
    2    H2   SER  66           H2       SER  66  -3.943  -1.418 -14.549
    3    H3   SER  66           H3       SER  66  -2.665  -1.264 -13.533
    4    HA   SER  66           HA       SER  66  -3.178  -3.531 -15.348
    5    HB2  SER  66           HB2      SER  66  -0.883  -3.183 -13.367
    6    HB3  SER  66           HB3      SER  66  -1.199  -4.607 -14.382
    7    HG   SER  66           HG       SER  66   0.340  -3.205 -15.353
    8    H    GLY  67           H        GLY  67  -3.764  -5.527 -14.336
    9    HA2  GLY  67           HA2      GLY  67  -5.524  -5.280 -12.043
   10    HA3  GLY  67           HA3      GLY  67  -5.133  -6.745 -12.932
   11    H    SER  68           H        SER  68  -5.479  -6.820 -10.222
   12    HA   SER  68           HA       SER  68  -2.928  -6.750  -8.794
   13    HB2  SER  68           HB2      SER  68  -4.267  -7.615  -6.903
   14    HB3  SER  68           HB3      SER  68  -4.933  -6.133  -7.614
   15    HG   SER  68           HG       SER  68  -6.563  -7.727  -7.228
   16    H    GLY  69           H        GLY  69  -2.078  -8.600  -7.613
   17    HA2  GLY  69           HA2      GLY  69  -2.701 -11.321  -8.171
   18    HA3  GLY  69           HA3      GLY  69  -1.399 -10.809  -9.250
   19    H    ARG  70           H        ARG  70  -0.667 -12.771  -7.745
   20    HA   ARG  70           HA       ARG  70   0.341 -12.099  -5.098
   21    HB2  ARG  70           HB2      ARG  70  -0.368 -14.385  -5.846
   22    HB3  ARG  70           HB3      ARG  70   1.032 -14.451  -6.915
   23    HG2  ARG  70           HG2      ARG  70   2.531 -14.241  -4.902
   24    HG3  ARG  70           HG3      ARG  70   1.099 -14.210  -3.862
   25    HD2  ARG  70           HD2      ARG  70   0.467 -16.450  -4.609
   26    HD3  ARG  70           HD3      ARG  70   1.796 -16.477  -5.775
   27    HE   ARG  70           HE       ARG  70   3.394 -16.376  -3.866
   28   HH11  ARG  70          HH11      ARG  70   0.211 -17.698  -3.120
   29   HH12  ARG  70          HH12      ARG  70   0.737 -18.234  -1.544
   30   HH21  ARG  70          HH21      ARG  70   4.031 -17.281  -2.053
   31   HH22  ARG  70          HH22      ARG  70   2.894 -18.085  -0.976
   32    H    GLY  71           H        GLY  71   2.387 -11.537  -4.445
   33    HA2  GLY  71           HA2      GLY  71   4.517 -10.649  -4.535
   34    HA3  GLY  71           HA3      GLY  71   4.799 -11.732  -5.897
   35    H    ARG  72           H        ARG  72   5.627 -10.643  -7.542
   36    HA   ARG  72           HA       ARG  72   4.910  -7.813  -8.119
   37    HB2  ARG  72           HB2      ARG  72   7.092  -9.598  -9.266
   38    HB3  ARG  72           HB3      ARG  72   6.843  -7.894  -9.670
   39    HG2  ARG  72           HG2      ARG  72   7.181  -7.263  -7.293
   40    HG3  ARG  72           HG3      ARG  72   7.550  -8.948  -6.896
   41    HD2  ARG  72           HD2      ARG  72   9.085  -7.218  -8.885
   42    HD3  ARG  72           HD3      ARG  72   9.583  -7.531  -7.231
   43    HE   ARG  72           HE       ARG  72   9.747  -9.357  -9.528
   44   HH11  ARG  72          HH21      ARG  72   9.969  -9.220  -6.025
   45   HH12  ARG  72          HH22      ARG  72  10.850 -10.721  -5.938
   46   HH21  ARG  72          HH11      ARG  72  10.864 -11.259  -9.333
   47   HH22  ARG  72          HH12      ARG  72  11.348 -11.836  -7.767
   48    H    GLY  73           H        GLY  73   3.220 -10.361  -8.781
   49    HA2  GLY  73           HA2      GLY  73   1.531 -10.644 -10.361
   50    HA3  GLY  73           HA3      GLY  73   2.276  -9.447 -11.424
   51    H    ALA  74           H        ALA  74   4.645 -11.642 -10.474
   52    HA   ALA  74           HA       ALA  74   4.016 -13.778 -12.403
   53    HB1  ALA  74           HB1      ALA  74   5.329 -12.151 -13.727
   54    HB2  ALA  74           HB2      ALA  74   6.601 -12.155 -12.490
   55    HB3  ALA  74           HB3      ALA  74   6.267 -13.626 -13.426
   56    H    ILE  75           H        ILE  75   4.929 -15.743 -11.900
   57    HA   ILE  75           HA       ILE  75   6.255 -15.975  -9.235
   58    HB   ILE  75           HB       ILE  75   3.774 -17.390 -10.255
   59   HG12  ILE  75          HG12      ILE  75   3.306 -15.190  -9.264
   60   HG13  ILE  75          HG13      ILE  75   2.623 -16.498  -8.328
   61   HG21  ILE  75          HG21      ILE  75   5.403 -18.090  -7.782
   62   HG22  ILE  75          HG22      ILE  75   3.725 -18.614  -8.074
   63   HG23  ILE  75          HG23      ILE  75   4.993 -19.145  -9.158
   64   HD11  ILE  75          HD11      ILE  75   3.595 -14.699  -6.931
   65   HD12  ILE  75          HD12      ILE  75   4.352 -16.262  -6.606
   66   HD13  ILE  75          HD13      ILE  75   5.197 -15.032  -7.575
   67    H    ASP  76           H        ASP  76   7.817 -17.402  -9.054
   68    HA   ASP  76           HA       ASP  76   8.237 -19.453 -11.191
   69    HB2  ASP  76           HB2      ASP  76  10.115 -17.944 -11.023
   70    HB3  ASP  76           HB3      ASP  76  10.232 -18.215  -9.277
   71    H    ARG  77           H        ARG  77   6.597 -20.707 -10.314
   72    HA   ARG  77           HA       ARG  77   5.703 -22.479  -9.222
   73    HB2  ARG  77           HB2      ARG  77   8.636 -22.984  -8.585
   74    HB3  ARG  77           HB3      ARG  77   7.371 -24.208  -8.488
   75    HG2  ARG  77           HG2      ARG  77   7.049 -24.292 -10.820
   76    HG3  ARG  77           HG3      ARG  77   7.894 -22.767 -11.122
   77    HD2  ARG  77           HD2      ARG  77   9.254 -25.240  -9.999
   78    HD3  ARG  77           HD3      ARG  77   9.197 -24.835 -11.726
   79    HE   ARG  77           HE       ARG  77  10.212 -22.533 -10.832
   80   HH11  ARG  77          HH11      ARG  77  11.334 -25.769 -10.046
   81   HH12  ARG  77          HH12      ARG  77  12.925 -25.188  -9.635
   82   HH21  ARG  77          HH21      ARG  77  12.118 -21.859 -10.212
   83   HH22  ARG  77          HH22      ARG  77  13.376 -22.992  -9.748
   84    H    GLU  78           H        GLU  78   7.140 -20.276  -7.042
   85    HA   GLU  78           HA       GLU  78   6.901 -21.471  -4.578
   86    HB2  GLU  78           HB2      GLU  78   7.634 -19.129  -5.056
   87    HB3  GLU  78           HB3      GLU  78   5.945 -18.657  -5.251
   88    HG2  GLU  78           HG2      GLU  78   5.561 -19.458  -2.851
   89    HG3  GLU  78           HG3      GLU  78   7.309 -19.671  -2.717
   90    H    GLN  79           H        GLN  79   4.147 -19.968  -6.318
   91    HA   GLN  79           HA       GLN  79   2.157 -20.633  -4.345
   92    HB2  GLN  79           HB2      GLN  79   1.878 -18.845  -6.005
   93    HB3  GLN  79           HB3      GLN  79   1.954 -20.012  -7.328
   94    HG2  GLN  79           HG2      GLN  79  -0.332 -19.319  -6.955
   95    HG3  GLN  79           HG3      GLN  79  -0.155 -21.034  -6.615
   96   HE21  GLN  79          HE22      GLN  79  -0.283 -21.724  -4.295
   97   HE22  GLN  79          HE21      GLN  79  -1.072 -20.636  -3.149
   98    H    SER  80           H        SER  80   3.280 -22.359  -7.276
   99    HA   SER  80           HA       SER  80   1.394 -24.519  -7.162
  100    HB2  SER  80           HB2      SER  80   4.171 -24.261  -8.378
  101    HB3  SER  80           HB3      SER  80   3.082 -25.653  -8.645
  102    HG   SER  80           HG       SER  80   2.856 -24.040 -10.293
  103    H    ALA  81           H        ALA  81   4.734 -24.214  -5.805
  104    HA   ALA  81           HA       ALA  81   4.816 -26.721  -4.557
  105    HB1  ALA  81           HB1      ALA  81   6.605 -25.701  -3.194
  106    HB2  ALA  81           HB2      ALA  81   6.767 -25.263  -4.905
  107    HB3  ALA  81           HB3      ALA  81   6.111 -24.084  -3.748
  108    H    ALA  82           H        ALA  82   3.589 -23.564  -3.267
  109    HA   ALA  82           HA       ALA  82   2.772 -24.544  -0.739
  110    HB1  ALA  82           HB1      ALA  82   1.551 -22.309  -2.413
  111    HB2  ALA  82           HB2      ALA  82   1.346 -22.547  -0.669
  112    HB3  ALA  82           HB3      ALA  82   2.949 -22.156  -1.323
  113    H    ILE  83           H        ILE  83   0.999 -24.628  -3.869
  114    HA   ILE  83           HA       ILE  83  -1.418 -25.787  -2.760
  115    HB   ILE  83           HB       ILE  83  -0.320 -25.713  -5.594
  116   HG12  ILE  83          HG12      ILE  83  -2.695 -24.273  -4.383
  117   HG13  ILE  83          HG13      ILE  83  -1.098 -23.566  -4.341
  118   HG21  ILE  83          HG21      ILE  83  -1.815 -27.670  -5.428
  119   HG22  ILE  83          HG22      ILE  83  -3.044 -26.696  -4.599
  120   HG23  ILE  83          HG23      ILE  83  -2.649 -26.383  -6.295
  121   HD11  ILE  83          HD11      ILE  83  -2.274 -22.612  -6.188
  122   HD12  ILE  83          HD12      ILE  83  -1.025 -23.687  -6.860
  123   HD13  ILE  83          HD13      ILE  83  -2.733 -24.198  -6.811
  124    H    ARG  84           H        ARG  84   1.527 -27.265  -4.197
  125    HA   ARG  84           HA       ARG  84   0.652 -29.992  -3.920
  126    HB2  ARG  84           HB2      ARG  84   2.569 -29.214  -5.330
  127    HB3  ARG  84           HB3      ARG  84   3.498 -28.864  -3.869
  128    HG2  ARG  84           HG2      ARG  84   3.382 -31.277  -3.232
  129    HG3  ARG  84           HG3      ARG  84   2.449 -31.610  -4.706
  130    HD2  ARG  84           HD2      ARG  84   4.344 -30.901  -6.097
  131    HD3  ARG  84           HD3      ARG  84   5.257 -30.440  -4.643
  132    HE   ARG  84           HE       ARG  84   4.443 -33.188  -4.444
  133   HH11  ARG  84          HH11      ARG  84   6.813 -31.255  -6.159
  134   HH12  ARG  84          HH12      ARG  84   7.945 -32.573  -6.270
  135   HH21  ARG  84          HH21      ARG  84   5.949 -34.823  -4.590
  136   HH22  ARG  84          HH22      ARG  84   7.456 -34.541  -5.403
  137    H    GLU  85           H        GLU  85   2.616 -28.004  -1.650
  138    HA   GLU  85           HA       GLU  85   2.735 -29.887   0.415
  139    HB2  GLU  85           HB2      GLU  85   2.780 -26.852   0.452
  140    HB3  GLU  85           HB3      GLU  85   2.986 -27.825   1.910
  141    HG2  GLU  85           HG2      GLU  85   4.917 -28.978   0.923
  142    HG3  GLU  85           HG3      GLU  85   4.771 -28.018  -0.550
  143    H    TRP  86           H        TRP  86   0.238 -27.288  -0.049
  144    HA   TRP  86           HA       TRP  86  -1.401 -27.947   2.083
  145    HB2  TRP  86           HB2      TRP  86  -1.741 -25.939   0.818
  146    HB3  TRP  86           HB3      TRP  86  -2.028 -26.839  -0.664
  147    HD1  TRP  86           HD1      TRP  86  -3.751 -25.860   2.600
  148    HE1  TRP  86           HE1      TRP  86  -6.276 -26.309   2.414
  149    HE3  TRP  86           HE3      TRP  86  -3.844 -28.147  -1.992
  150    HZ2  TRP  86           HZ2      TRP  86  -8.066 -27.666   0.601
  151    HZ3  TRP  86           HZ3      TRP  86  -5.981 -28.979  -2.933
  152    HH2  TRP  86           HH2      TRP  86  -8.091 -28.770  -1.627
  153    H    ALA  87           H        ALA  87  -1.545 -29.301  -1.254
  154    HA   ALA  87           HA       ALA  87  -3.737 -31.048  -0.794
  155    HB1  ALA  87           HB1      ALA  87  -2.938 -30.411  -3.033
  156    HB2  ALA  87           HB2      ALA  87  -1.400 -31.247  -2.752
  157    HB3  ALA  87           HB3      ALA  87  -2.908 -32.178  -2.862
  158    H    ARG  88           H        ARG  88  -0.204 -31.679  -0.503
  159    HA   ARG  88           HA       ARG  88  -0.376 -34.390   0.373
  160    HB2  ARG  88           HB2      ARG  88   1.662 -33.229  -0.458
  161    HB3  ARG  88           HB3      ARG  88   1.736 -32.287   1.038
  162    HG2  ARG  88           HG2      ARG  88   2.002 -34.394   2.344
  163    HG3  ARG  88           HG3      ARG  88   1.912 -35.334   0.839
  164    HD2  ARG  88           HD2      ARG  88   3.940 -34.178   0.005
  165    HD3  ARG  88           HD3      ARG  88   4.014 -33.230   1.512
  166    HE   ARG  88           HE       ARG  88   3.949 -36.010   2.169
  167   HH11  ARG  88          HH11      ARG  88   6.217 -33.716   0.798
  168   HH12  ARG  88          HH12      ARG  88   7.606 -34.614   1.356
  169   HH21  ARG  88          HH21      ARG  88   5.762 -37.112   2.842
  170   HH22  ARG  88          HH22      ARG  88   7.343 -36.491   2.478
  171    H    ARG  89           H        ARG  89  -0.288 -31.394   2.342
  172    HA   ARG  89           HA       ARG  89  -0.489 -32.686   4.908
  173    HB2  ARG  89           HB2      ARG  89  -1.142 -29.876   3.935
  174    HB3  ARG  89           HB3      ARG  89  -1.303 -30.362   5.625
  175    HG2  ARG  89           HG2      ARG  89   1.070 -30.914   5.780
  176    HG3  ARG  89           HG3      ARG  89   1.302 -30.644   4.057
  177    HD2  ARG  89           HD2      ARG  89   2.136 -28.726   5.218
  178    HD3  ARG  89           HD3      ARG  89   0.664 -28.257   4.347
  179    HE   ARG  89           HE       ARG  89   0.060 -29.054   7.062
  180   HH11  ARG  89          HH21      ARG  89   1.469 -26.330   5.360
  181   HH12  ARG  89          HH22      ARG  89   1.028 -25.201   6.608
  182   HH21  ARG  89          HH11      ARG  89  -0.504 -27.552   8.606
  183   HH22  ARG  89          HH12      ARG  89  -0.065 -25.880   8.396
  184    H    ASN  90           H        ASN  90  -3.007 -31.811   2.606
  185    HA   ASN  90           HA       ASN  90  -5.143 -32.640   4.502
  186    HB2  ASN  90           HB2      ASN  90  -5.171 -31.363   1.744
  187    HB3  ASN  90           HB3      ASN  90  -6.619 -31.956   2.546
  188   HD21  ASN  90          HD22      ASN  90  -4.087 -29.492   2.729
  189   HD22  ASN  90          HD21      ASN  90  -4.952 -28.500   3.897
  190    H    GLY  91           H        GLY  91  -3.061 -34.423   2.667
  191    HA2  GLY  91           HA2      GLY  91  -3.081 -36.630   2.053
  192    HA3  GLY  91           HA3      GLY  91  -4.679 -36.800   2.778
  193    H    HIS  92           H        HIS  92  -4.259 -34.420   0.240
  194    HA   HIS  92           HA       HIS  92  -6.116 -35.923  -1.537
  195    HB2  HIS  92           HB2      HIS  92  -5.012 -33.090  -1.759
  196    HB3  HIS  92           HB3      HIS  92  -6.267 -33.789  -2.768
  197    HD1  HIS  92           HD1      HIS  92  -7.794 -35.054   0.031
  198    HD2  HIS  92           HD2      HIS  92  -6.729 -31.122  -1.088
  199    HE1  HIS  92           HE1      HIS  92  -9.395 -33.484   1.286
  200    HE2  HIS  92           HE2      HIS  92  -8.746 -31.086   0.605
  201    H    ASN  93           H        ASN  93  -5.694 -36.332  -3.732
  202    HA   ASN  93           HA       ASN  93  -2.977 -37.100  -4.381
  203    HB2  ASN  93           HB2      ASN  93  -4.984 -38.331  -5.178
  204    HB3  ASN  93           HB3      ASN  93  -5.475 -36.925  -6.124
  205   HD21  ASN  93          HD22      ASN  93  -2.992 -39.482  -5.830
  206   HD22  ASN  93          HD21      ASN  93  -2.413 -39.296  -7.476
  207    H    VAL  94           H        VAL  94  -1.445 -36.101  -5.603
  208    HA   VAL  94           HA       VAL  94  -2.052 -33.811  -7.320
  209    HB   VAL  94           HB       VAL  94  -1.792 -32.699  -5.171
  210   HG11  VAL  94          HG11      VAL  94   0.317 -32.625  -3.945
  211   HG12  VAL  94          HG12      VAL  94  -0.300 -34.274  -3.986
  212   HG13  VAL  94          HG13      VAL  94   1.043 -33.805  -5.056
  213   HG21  VAL  94          HG21      VAL  94  -0.215 -31.019  -5.816
  214   HG22  VAL  94          HG22      VAL  94   0.644 -32.126  -6.898
  215   HG23  VAL  94          HG23      VAL  94  -1.019 -31.609  -7.277
  216    H    SER  95           H        SER  95  -0.682 -33.576  -8.978
  217    HA   SER  95           HA       SER  95   0.829 -35.793  -9.797
  218    HB2  SER  95           HB2      SER  95   0.852 -32.934 -10.822
  219    HB3  SER  95           HB3      SER  95   1.426 -34.366 -11.713
  220    HG   SER  95           HG       SER  95  -0.697 -33.948 -12.337
  221    H    THR  96           H        THR  96   2.938 -36.367  -9.720
  222    HA   THR  96           HA       THR  96   4.863 -34.786  -8.148
  223    HB   THR  96           HB       THR  96   6.315 -36.790  -8.477
  224    HG1  THR  96           HG1      THR  96   5.341 -38.607  -9.453
  225   HG21  THR  96          HG21      THR  96   4.758 -36.654  -6.544
  226   HG22  THR  96          HG22      THR  96   3.502 -37.474  -7.503
  227   HG23  THR  96          HG23      THR  96   5.011 -38.318  -7.085
  228    H    ARG  97           H        ARG  97   4.206 -35.285 -11.499
  229    HA   ARG  97           HA       ARG  97   6.561 -33.615 -12.310
  230    HB2  ARG  97           HB2      ARG  97   5.419 -36.038 -13.774
  231    HB3  ARG  97           HB3      ARG  97   6.616 -34.950 -14.445
  232    HG2  ARG  97           HG2      ARG  97   7.096 -36.690 -11.976
  233    HG3  ARG  97           HG3      ARG  97   7.485 -37.138 -13.633
  234    HD2  ARG  97           HD2      ARG  97   9.512 -36.397 -12.737
  235    HD3  ARG  97           HD3      ARG  97   8.954 -35.088 -13.795
  236    HE   ARG  97           HE       ARG  97   8.117 -34.739 -11.020
  237   HH11  ARG  97          HH11      ARG  97  10.962 -34.292 -13.030
  238   HH12  ARG  97          HH12      ARG  97  11.591 -33.035 -12.000
  239   HH21  ARG  97          HH21      ARG  97   8.929 -33.136  -9.801
  240   HH22  ARG  97          HH22      ARG  97  10.459 -32.394 -10.199
  241    H    GLY  98           H        GLY  98   6.211 -32.312 -14.164
  242    HA2  GLY  98           HA2      GLY  98   5.003 -30.915 -15.565
  243    HA3  GLY  98           HA3      GLY  98   3.687 -32.081 -15.519
  244    H    ARG  99           H        ARG  99   2.328 -30.193 -15.613
  245    HA   ARG  99           HA       ARG  99   2.222 -28.254 -13.442
  246    HB2  ARG  99           HB2      ARG  99   1.664 -27.847 -15.877
  247    HB3  ARG  99           HB3      ARG  99   0.187 -28.787 -15.649
  248    HG2  ARG  99           HG2      ARG  99  -0.584 -27.125 -13.950
  249    HG3  ARG  99           HG3      ARG  99   0.929 -26.221 -14.168
  250    HD2  ARG  99           HD2      ARG  99   0.361 -25.874 -16.557
  251    HD3  ARG  99           HD3      ARG  99  -1.152 -26.773 -16.325
  252    HE   ARG  99           HE       ARG  99  -1.030 -24.637 -14.424
  253   HH11  ARG  99          HH11      ARG  99  -1.510 -25.050 -17.870
  254   HH12  ARG  99          HH12      ARG  99  -2.431 -23.576 -18.014
  255   HH21  ARG  99          HH21      ARG  99  -2.212 -22.758 -14.679
  256   HH22  ARG  99          HH22      ARG  99  -2.805 -22.313 -16.249
  257    H    ILE 100           H        ILE 100   0.670 -28.004 -11.847
  258    HA   ILE 100           HA       ILE 100  -0.564 -30.370 -10.722
  259    HB   ILE 100           HB       ILE 100  -0.729 -27.426 -10.016
  260   HG12  ILE 100          HG12      ILE 100   0.679 -29.846  -8.783
  261   HG13  ILE 100          HG13      ILE 100   1.447 -28.531  -9.670
  262   HG21  ILE 100          HG21      ILE 100  -2.857 -28.536  -9.277
  263   HG22  ILE 100          HG22      ILE 100  -1.888 -29.720  -8.370
  264   HG23  ILE 100          HG23      ILE 100  -1.866 -28.000  -7.947
  265   HD11  ILE 100          HD11      ILE 100   0.164 -28.390  -6.925
  266   HD12  ILE 100          HD12      ILE 100   1.856 -28.152  -7.374
  267   HD13  ILE 100          HD13      ILE 100   0.646 -26.948  -7.865
  268    HA   PRO 101           HA       PRO 101  -4.343 -30.236 -13.096
  269    HB2  PRO 101           HB2      PRO 101  -5.817 -31.415 -10.784
  270    HB3  PRO 101           HB3      PRO 101  -5.629 -32.046 -12.440
  271    HG2  PRO 101           HG2      PRO 101  -4.292 -33.134 -10.316
  272    HG3  PRO 101           HG3      PRO 101  -3.530 -33.008 -11.940
  273    HD2  PRO 101           HD2      PRO 101  -3.182 -31.202  -9.544
  274    HD3  PRO 101           HD3      PRO 101  -1.947 -31.880 -10.653
  275    H    ALA 102           H        ALA 102  -5.943 -28.739 -13.443
  276    HA   ALA 102           HA       ALA 102  -6.186 -26.500 -11.809
  277    HB1  ALA 102           HB1      ALA 102  -6.668 -26.565 -14.208
  278    HB2  ALA 102           HB2      ALA 102  -8.161 -27.497 -13.877
  279    HB3  ALA 102           HB3      ALA 102  -7.978 -25.827 -13.263
  280    H    ASP 103           H        ASP 103  -8.167 -29.456 -11.744
  281    HA   ASP 103           HA       ASP 103 -10.194 -28.607 -10.059
  282    HB2  ASP 103           HB2      ASP 103  -8.817 -31.311 -10.263
  283    HB3  ASP 103           HB3      ASP 103 -10.313 -31.033  -9.377
  284    H    VAL 104           H        VAL 104  -6.865 -29.591  -9.215
  285    HA   VAL 104           HA       VAL 104  -7.337 -29.515  -6.359
  286    HB   VAL 104           HB       VAL 104  -4.691 -29.612  -7.770
  287   HG11  VAL 104          HG11      VAL 104  -5.475 -30.459  -4.958
  288   HG12  VAL 104          HG12      VAL 104  -3.875 -30.683  -5.695
  289   HG13  VAL 104          HG13      VAL 104  -4.478 -29.054  -5.392
  290   HG21  VAL 104          HG21      VAL 104  -6.394 -31.953  -6.810
  291   HG22  VAL 104          HG22      VAL 104  -6.022 -31.574  -8.502
  292   HG23  VAL 104          HG23      VAL 104  -4.725 -32.072  -7.417
  293    H    ILE 105           H        ILE 105  -5.904 -27.350  -8.815
  294    HA   ILE 105           HA       ILE 105  -5.105 -25.234  -7.034
  295    HB   ILE 105           HB       ILE 105  -5.984 -25.329  -9.949
  296   HG12  ILE 105          HG12      ILE 105  -3.206 -24.583  -8.990
  297   HG13  ILE 105          HG13      ILE 105  -3.666 -26.272  -8.844
  298   HG21  ILE 105          HG21      ILE 105  -4.968 -23.031 -10.164
  299   HG22  ILE 105          HG22      ILE 105  -6.482 -23.063  -9.265
  300   HG23  ILE 105          HG23      ILE 105  -4.932 -22.926  -8.391
  301   HD11  ILE 105          HD11      ILE 105  -4.112 -26.452 -11.193
  302   HD12  ILE 105          HD12      ILE 105  -3.814 -24.713 -11.448
  303   HD13  ILE 105          HD13      ILE 105  -2.487 -25.785 -10.953
  304    H    ASP 106           H        ASP 106  -8.259 -25.782  -8.731
  305    HA   ASP 106           HA       ASP 106  -9.650 -23.714  -7.501
  306    HB2  ASP 106           HB2      ASP 106 -10.436 -24.943  -9.463
  307    HB3  ASP 106           HB3      ASP 106 -10.639 -26.404  -8.488
  308    H    ALA 107           H        ALA 107  -9.337 -27.157  -6.417
  309    HA   ALA 107           HA       ALA 107 -10.812 -27.014  -4.112
  310    HB1  ALA 107           HB1      ALA 107  -9.498 -28.980  -3.396
  311    HB2  ALA 107           HB2      ALA 107  -9.858 -29.083  -5.120
  312    HB3  ALA 107           HB3      ALA 107  -8.233 -28.602  -4.589
  313    H    TYR 108           H        TYR 108  -7.333 -26.201  -4.462
  314    HA   TYR 108           HA       TYR 108  -6.816 -25.401  -1.777
  315    HB2  TYR 108           HB2      TYR 108  -5.012 -25.786  -3.280
  316    HB3  TYR 108           HB3      TYR 108  -5.632 -24.661  -4.467
  317    HD1  TYR 108           HD2      TYR 108  -3.980 -24.917  -1.152
  318    HD2  TYR 108           HD1      TYR 108  -5.170 -22.308  -4.376
  319    HE1  TYR 108           HE2      TYR 108  -2.456 -23.156  -0.281
  320    HE2  TYR 108           HE1      TYR 108  -3.656 -20.537  -3.496
  321    HH   TYR 108           HH       TYR 108  -1.643 -21.007  -0.567
  322    H    HIS 109           H        HIS 109  -7.831 -23.372  -4.613
  323    HA   HIS 109           HA       HIS 109  -8.065 -20.971  -3.068
  324    HB2  HIS 109           HB2      HIS 109  -9.304 -21.806  -5.704
  325    HB3  HIS 109           HB3      HIS 109  -9.633 -20.241  -4.957
  326    HD1  HIS 109           HD1      HIS 109  -7.171 -18.840  -4.276
  327    HD2  HIS 109           HD2      HIS 109  -7.306 -21.692  -7.378
  328    HE1  HIS 109           HE1      HIS 109  -5.138 -18.360  -5.781
  329    HE2  HIS 109           HE2      HIS 109  -5.234 -20.085  -7.688
  330    H    ALA 110           H        ALA 110 -10.541 -23.517  -3.650
  331    HA   ALA 110           HA       ALA 110 -12.665 -22.158  -2.377
  332    HB1  ALA 110           HB1      ALA 110 -12.941 -24.204  -3.723
  333    HB2  ALA 110           HB2      ALA 110 -12.081 -25.151  -2.492
  334    HB3  ALA 110           HB3      ALA 110 -13.641 -24.403  -2.105
  335    H    ALA 111           H        ALA 111 -10.167 -24.359  -0.940
  336    HA   ALA 111           HA       ALA 111 -11.099 -24.195   1.676
  337    HB1  ALA 111           HB1      ALA 111  -8.289 -24.730   0.636
  338    HB2  ALA 111           HB2      ALA 111  -8.900 -25.147   2.250
  339    HB3  ALA 111           HB3      ALA 111  -9.599 -25.929   0.815
  340    H    THR 112           H        THR 112  -8.676 -22.125  -0.009
  341    HA   THR 112           HA       THR 112  -8.072 -20.598   2.398
  342    HB   THR 112           HB       THR 112  -6.811 -19.098   0.944
  343    HG1  THR 112           HG1      THR 112  -6.659 -19.550  -1.245
  344   HG21  THR 112          HG21      THR 112  -5.741 -21.173   1.778
  345   HG22  THR 112          HG22      THR 112  -6.256 -22.030   0.311
  346   HG23  THR 112          HG23      THR 112  -5.111 -20.686   0.198
  347    H    LEU 113           H        LEU 113 -10.382 -20.055  -0.289
  348    HA   LEU 113           HA       LEU 113 -11.027 -17.381   0.621
  349    HB2  LEU 113           HB2      LEU 113 -11.096 -17.992  -1.742
  350    HB3  LEU 113           HB3      LEU 113 -12.270 -19.270  -1.409
  351    HG   LEU 113           HG       LEU 113 -13.937 -17.644  -0.734
  352   HD11  LEU 113          HD11      LEU 113 -13.610 -15.216  -1.236
  353   HD12  LEU 113          HD12      LEU 113 -12.573 -15.772   0.076
  354   HD13  LEU 113          HD13      LEU 113 -11.888 -15.535  -1.550
  355   HD21  LEU 113          HD21      LEU 113 -13.815 -18.383  -3.079
  356   HD22  LEU 113          HD22      LEU 113 -14.396 -16.710  -2.969
  357   HD23  LEU 113          HD23      LEU 113 -12.715 -17.039  -3.454
  358    H    GLU 114           H        GLU 114 -12.825 -20.485   0.619
  359    HA   GLU 114           HA       GLU 114 -15.044 -19.252   2.066
  360    HB2  GLU 114           HB2      GLU 114 -14.641 -22.142   1.206
  361    HB3  GLU 114           HB3      GLU 114 -16.084 -21.471   1.948
  362    HG2  GLU 114           HG2      GLU 114 -16.200 -19.783   0.052
  363    HG3  GLU 114           HG3      GLU 114 -14.908 -20.676  -0.743
  364    H    HIS 115           H        HIS 115 -14.503 -18.632   4.102
  365    HA   HIS 115           HA       HIS 115 -12.916 -20.294   5.886
  366    HB2  HIS 115           HB2      HIS 115 -14.346 -17.630   6.176
  367    HB3  HIS 115           HB3      HIS 115 -13.563 -18.415   7.533
  368    HD1  HIS 115           HD1      HIS 115 -12.387 -17.356   3.929
  369    HD2  HIS 115           HD2      HIS 115 -11.110 -17.851   7.935
  370    HE1  HIS 115           HE1      HIS 115  -9.949 -16.548   4.027
  371    HE2  HIS 115           HE2      HIS 115  -9.175 -16.852   6.466
  372    H    HIS 116           H        HIS 116 -16.173 -20.592   5.133
  373    HA   HIS 116           HA       HIS 116 -17.062 -21.567   7.754
  374    HB2  HIS 116           HB2      HIS 116 -19.191 -21.857   6.767
  375    HB3  HIS 116           HB3      HIS 116 -18.551 -20.350   6.147
  376    HD1  HIS 116           HD1      HIS 116 -19.416 -23.921   5.005
  377    HD2  HIS 116           HD2      HIS 116 -18.139 -20.196   3.466
  378    HE1  HIS 116           HE1      HIS 116 -19.536 -24.110   2.438
  379    HE2  HIS 116           HE2      HIS 116 -18.684 -21.869   1.498
  380    H    HIS 117           H        HIS 117 -15.072 -23.073   5.508
  381    HA   HIS 117           HA       HIS 117 -16.269 -25.649   5.294
  382    HB2  HIS 117           HB2      HIS 117 -14.208 -26.407   4.364
  383    HB3  HIS 117           HB3      HIS 117 -14.519 -24.789   3.775
  384    HD1  HIS 117           HD1      HIS 117 -12.642 -22.962   4.332
  385    HD2  HIS 117           HD2      HIS 117 -12.131 -26.757   6.128
  386    HE1  HIS 117           HE1      HIS 117 -10.269 -22.982   5.351
  387    HE2  HIS 117           HE2      HIS 117  -9.970 -25.296   6.440
  388    H    HIS 118           H        HIS 118 -15.769 -27.648   6.226
  389    HA   HIS 118           HA       HIS 118 -15.795 -29.059   7.995
  390    HB2  HIS 118           HB2      HIS 118 -13.359 -28.776   7.296
  391    HB3  HIS 118           HB3      HIS 118 -13.133 -27.806   8.743
  392    HD1  HIS 118           HD1      HIS 118 -13.229 -29.206  11.099
  393    HD2  HIS 118           HD2      HIS 118 -13.690 -31.424   7.532
  394    HE1  HIS 118           HE1      HIS 118 -12.938 -31.695  11.743
  395    HE2  HIS 118           HE2      HIS 118 -13.236 -33.035   9.564
  396    H    HIS 119           H        HIS 119 -17.477 -27.029   8.578
  397    HA   HIS 119           HA       HIS 119 -17.106 -25.971  11.267
  398    HB2  HIS 119           HB2      HIS 119 -18.495 -24.843   9.557
  399    HB3  HIS 119           HB3      HIS 119 -19.605 -26.212   9.525
  400    HD1  HIS 119           HD1      HIS 119 -18.535 -23.327  11.877
  401    HD2  HIS 119           HD2      HIS 119 -21.467 -26.339  11.409
  402    HE1  HIS 119           HE1      HIS 119 -20.331 -22.883  13.673
  403    HE2  HIS 119           HE2      HIS 119 -22.120 -24.718  13.370
  404    H    HIS 120           H        HIS 120 -18.222 -26.537  13.171
  405    HA   HIS 120           HA       HIS 120 -19.671 -29.113  13.331
  406    HB2  HIS 120           HB2      HIS 120 -17.324 -29.674  13.799
  407    HB3  HIS 120           HB3      HIS 120 -17.245 -28.426  15.040
  408    HD1  HIS 120           HD1      HIS 120 -18.586 -28.948  17.353
  409    HD2  HIS 120           HD2      HIS 120 -18.553 -31.984  14.418
  410    HE1  HIS 120           HE1      HIS 120 -19.381 -31.106  18.529
  411    HE2  HIS 120           HE2      HIS 120 -19.356 -32.952  16.733
  Start of MODEL    6
    1    H1   SER  66           H1       SER  66  30.703 -22.543 -13.247
    2    H2   SER  66           H2       SER  66  31.080 -21.246 -14.174
    3    H3   SER  66           H3       SER  66  31.746 -21.410 -12.682
    4    HA   SER  66           HA       SER  66  30.050 -19.741 -12.606
    5    HB2  SER  66           HB2      SER  66  28.170 -21.932 -13.574
    6    HB3  SER  66           HB3      SER  66  27.724 -20.268 -13.143
    7    HG   SER  66           HG       SER  66  28.030 -20.511 -15.409
    8    H    GLY  67           H        GLY  67  28.670 -19.427 -10.746
    9    HA2  GLY  67           HA2      GLY  67  27.760 -21.491  -9.006
   10    HA3  GLY  67           HA3      GLY  67  29.336 -20.943  -8.437
   11    H    SER  68           H        SER  68  27.404 -20.645  -6.725
   12    HA   SER  68           HA       SER  68  26.235 -19.296  -5.362
   13    HB2  SER  68           HB2      SER  68  28.106 -17.144  -6.380
   14    HB3  SER  68           HB3      SER  68  27.202 -17.127  -4.854
   15    HG   SER  68           HG       SER  68  29.378 -17.857  -4.583
   16    H    GLY  69           H        GLY  69  25.077 -19.455  -8.108
   17    HA2  GLY  69           HA2      GLY  69  23.680 -16.923  -8.563
   18    HA3  GLY  69           HA3      GLY  69  23.399 -18.449  -9.392
   19    H    ARG  70           H        ARG  70  21.388 -16.746  -8.621
   20    HA   ARG  70           HA       ARG  70  19.329 -16.570  -7.682
   21    HB2  ARG  70           HB2      ARG  70  19.647 -19.554  -7.157
   22    HB3  ARG  70           HB3      ARG  70  18.146 -18.656  -7.021
   23    HG2  ARG  70           HG2      ARG  70  18.235 -18.073  -9.420
   24    HG3  ARG  70           HG3      ARG  70  19.763 -18.945  -9.585
   25    HD2  ARG  70           HD2      ARG  70  17.926 -20.344 -10.382
   26    HD3  ARG  70           HD3      ARG  70  18.685 -21.055  -8.963
   27    HE   ARG  70           HE       ARG  70  16.730 -20.794  -7.746
   28   HH11  ARG  70          HH11      ARG  70  16.240 -18.944 -10.742
   29   HH12  ARG  70          HH12      ARG  70  14.544 -18.703 -10.312
   30   HH21  ARG  70          HH21      ARG  70  14.552 -20.294  -7.385
   31   HH22  ARG  70          HH22      ARG  70  13.712 -19.378  -8.655
   32    H    GLY  71           H        GLY  71  17.910 -16.586  -5.930
   33    HA2  GLY  71           HA2      GLY  71  19.122 -15.826  -3.407
   34    HA3  GLY  71           HA3      GLY  71  17.403 -16.036  -3.730
   35    H    ARG  72           H        ARG  72  19.197 -16.945  -1.549
   36    HA   ARG  72           HA       ARG  72  19.841 -19.639  -1.451
   37    HB2  ARG  72           HB2      ARG  72  20.341 -17.873   0.253
   38    HB3  ARG  72           HB3      ARG  72  18.675 -17.993   0.833
   39    HG2  ARG  72           HG2      ARG  72  19.079 -20.385   1.450
   40    HG3  ARG  72           HG3      ARG  72  20.711 -20.275   0.782
   41    HD2  ARG  72           HD2      ARG  72  20.855 -20.083   3.174
   42    HD3  ARG  72           HD3      ARG  72  21.260 -18.512   2.454
   43    HE   ARG  72           HE       ARG  72  18.445 -18.661   3.118
   44   HH11  ARG  72          HH11      ARG  72  21.539 -18.207   4.702
   45   HH12  ARG  72          HH12      ARG  72  20.839 -17.334   6.036
   46   HH21  ARG  72          HH21      ARG  72  17.607 -17.535   4.839
   47   HH22  ARG  72          HH22      ARG  72  18.655 -16.979   6.111
   48    H    GLY  73           H        GLY  73  18.589 -21.246  -2.192
   49    HA2  GLY  73           HA2      GLY  73  16.918 -22.818  -2.317
   50    HA3  GLY  73           HA3      GLY  73  16.390 -22.304  -0.714
   51    H    ALA  74           H        ALA  74  16.377 -19.888  -3.277
   52    HA   ALA  74           HA       ALA  74  13.594 -19.403  -2.753
   53    HB1  ALA  74           HB1      ALA  74  15.477 -18.105  -4.762
   54    HB2  ALA  74           HB2      ALA  74  13.904 -17.472  -4.243
   55    HB3  ALA  74           HB3      ALA  74  15.231 -17.596  -3.073
   56    H    ILE  75           H        ILE  75  11.805 -19.514  -4.049
   57    HA   ILE  75           HA       ILE  75  11.998 -21.063  -6.589
   58    HB   ILE  75           HB       ILE  75   9.778 -21.231  -4.525
   59   HG12  ILE  75          HG11      ILE  75  11.949 -23.261  -5.225
   60   HG13  ILE  75          HG12      ILE  75  11.839 -22.339  -3.725
   61   HG21  ILE  75          HG21      ILE  75   8.976 -21.591  -6.868
   62   HG22  ILE  75          HG22      ILE  75  10.215 -22.849  -7.090
   63   HG23  ILE  75          HG23      ILE  75   8.881 -23.065  -5.941
   64   HD11  ILE  75          HD11      ILE  75   9.945 -24.529  -4.621
   65   HD12  ILE  75          HD12      ILE  75  11.048 -24.514  -3.241
   66   HD13  ILE  75          HD13      ILE  75   9.631 -23.443  -3.242
   67    H    ASP  76           H        ASP  76  10.732 -20.383  -8.297
   68    HA   ASP  76           HA       ASP  76   9.691 -17.589  -8.156
   69    HB2  ASP  76           HB2      ASP  76  10.442 -19.370 -10.496
   70    HB3  ASP  76           HB3      ASP  76   9.713 -17.775 -10.655
   71    H    ARG  77           H        ARG  77   8.681 -20.794  -9.416
   72    HA   ARG  77           HA       ARG  77   5.821 -20.024  -9.455
   73    HB2  ARG  77           HB2      ARG  77   7.218 -22.637 -10.171
   74    HB3  ARG  77           HB3      ARG  77   5.484 -22.322 -10.331
   75    HG2  ARG  77           HG2      ARG  77   5.945 -20.458 -11.898
   76    HG3  ARG  77           HG3      ARG  77   7.685 -20.785 -11.780
   77    HD2  ARG  77           HD2      ARG  77   7.317 -23.069 -12.664
   78    HD3  ARG  77           HD3      ARG  77   5.577 -22.729 -12.807
   79    HE   ARG  77           HE       ARG  77   6.953 -20.687 -14.201
   80   HH11  ARG  77          HH11      ARG  77   6.454 -24.135 -14.601
   81   HH12  ARG  77          HH12      ARG  77   6.642 -24.057 -16.332
   82   HH21  ARG  77          HH21      ARG  77   7.183 -20.656 -16.410
   83   HH22  ARG  77          HH22      ARG  77   7.042 -22.126 -17.327
   84    H    GLU  78           H        GLU  78   6.784 -19.631  -7.013
   85    HA   GLU  78           HA       GLU  78   6.827 -21.891  -5.255
   86    HB2  GLU  78           HB2      GLU  78   7.995 -19.708  -5.007
   87    HB3  GLU  78           HB3      GLU  78   6.452 -18.953  -4.587
   88    HG2  GLU  78           HG2      GLU  78   6.263 -20.401  -2.594
   89    HG3  GLU  78           HG3      GLU  78   7.724 -21.278  -3.064
   90    H    GLN  79           H        GLN  79   4.110 -19.934  -6.335
   91    HA   GLN  79           HA       GLN  79   2.184 -20.780  -4.373
   92    HB2  GLN  79           HB2      GLN  79   1.858 -20.078  -7.324
   93    HB3  GLN  79           HB3      GLN  79   0.519 -20.369  -6.210
   94    HG2  GLN  79           HG2      GLN  79   1.324 -18.513  -4.748
   95    HG3  GLN  79           HG3      GLN  79   2.596 -18.155  -5.920
   96   HE21  GLN  79          HE22      GLN  79   1.905 -17.382  -8.127
   97   HE22  GLN  79          HE21      GLN  79   0.332 -16.617  -8.271
   98    H    SER  80           H        SER  80   3.469 -22.457  -7.295
   99    HA   SER  80           HA       SER  80   1.640 -24.689  -7.160
  100    HB2  SER  80           HB2      SER  80   4.471 -24.591  -8.277
  101    HB3  SER  80           HB3      SER  80   3.268 -25.862  -8.563
  102    HG   SER  80           HG       SER  80   3.289 -24.309 -10.268
  103    H    ALA  81           H        ALA  81   4.936 -24.196  -5.741
  104    HA   ALA  81           HA       ALA  81   5.068 -26.672  -4.428
  105    HB1  ALA  81           HB1      ALA  81   6.308 -24.008  -3.613
  106    HB2  ALA  81           HB2      ALA  81   6.829 -25.613  -3.075
  107    HB3  ALA  81           HB3      ALA  81   6.991 -25.165  -4.784
  108    H    ALA  82           H        ALA  82   3.657 -23.570  -3.291
  109    HA   ALA  82           HA       ALA  82   2.896 -24.485  -0.691
  110    HB1  ALA  82           HB1      ALA  82   3.048 -22.110  -1.361
  111    HB2  ALA  82           HB2      ALA  82   1.647 -22.321  -2.440
  112    HB3  ALA  82           HB3      ALA  82   1.454 -22.500  -0.686
  113    H    ILE  83           H        ILE  83   1.044 -24.521  -3.795
  114    HA   ILE  83           HA       ILE  83  -1.310 -25.744  -2.653
  115    HB   ILE  83           HB       ILE  83  -0.327 -25.549  -5.519
  116   HG12  ILE  83          HG12      ILE  83  -2.545 -24.100  -4.006
  117   HG13  ILE  83          HG13      ILE  83  -0.963 -23.415  -4.258
  118   HG21  ILE  83          HG21      ILE  83  -1.867 -27.511  -5.309
  119   HG22  ILE  83          HG22      ILE  83  -3.058 -26.477  -4.499
  120   HG23  ILE  83          HG23      ILE  83  -2.627 -26.207  -6.199
  121   HD11  ILE  83          HD11      ILE  83  -1.352 -23.577  -6.759
  122   HD12  ILE  83          HD12      ILE  83  -3.045 -23.995  -6.381
  123   HD13  ILE  83          HD13      ILE  83  -2.388 -22.436  -5.879
  124    H    ARG  84           H        ARG  84   1.604 -27.165  -4.196
  125    HA   ARG  84           HA       ARG  84   0.841 -29.919  -3.985
  126    HB2  ARG  84           HB2      ARG  84   2.826 -29.070  -5.251
  127    HB3  ARG  84           HB3      ARG  84   3.592 -28.618  -3.734
  128    HG2  ARG  84           HG2      ARG  84   3.506 -31.108  -3.079
  129    HG3  ARG  84           HG3      ARG  84   2.921 -31.425  -4.712
  130    HD2  ARG  84           HD2      ARG  84   5.300 -31.825  -4.638
  131    HD3  ARG  84           HD3      ARG  84   5.017 -30.377  -5.617
  132    HE   ARG  84           HE       ARG  84   5.505 -29.713  -2.827
  133   HH11  ARG  84          HH11      ARG  84   7.370 -30.826  -5.590
  134   HH12  ARG  84          HH12      ARG  84   8.766 -29.897  -5.117
  135   HH21  ARG  84          HH21      ARG  84   7.361 -28.639  -2.247
  136   HH22  ARG  84          HH22      ARG  84   8.773 -28.749  -3.245
  137    H    GLU  85           H        GLU  85   2.643 -27.901  -1.582
  138    HA   GLU  85           HA       GLU  85   2.715 -29.877   0.378
  139    HB2  GLU  85           HB2      GLU  85   4.018 -27.710   0.318
  140    HB3  GLU  85           HB3      GLU  85   2.570 -26.902   0.953
  141    HG2  GLU  85           HG2      GLU  85   2.615 -28.562   2.882
  142    HG3  GLU  85           HG3      GLU  85   4.144 -29.175   2.254
  143    H    TRP  86           H        TRP  86   0.221 -27.273  -0.021
  144    HA   TRP  86           HA       TRP  86  -1.468 -28.012   2.049
  145    HB2  TRP  86           HB2      TRP  86  -1.770 -25.960   0.830
  146    HB3  TRP  86           HB3      TRP  86  -2.056 -26.824  -0.675
  147    HD1  TRP  86           HD1      TRP  86  -3.776 -25.879   2.592
  148    HE1  TRP  86           HE1      TRP  86  -6.308 -26.286   2.392
  149    HE3  TRP  86           HE3      TRP  86  -3.878 -28.158  -1.997
  150    HZ2  TRP  86           HZ2      TRP  86  -8.108 -27.635   0.581
  151    HZ3  TRP  86           HZ3      TRP  86  -6.026 -28.962  -2.952
  152    HH2  TRP  86           HH2      TRP  86  -8.137 -28.736  -1.651
  153    H    ALA  87           H        ALA  87  -1.499 -29.267  -1.328
  154    HA   ALA  87           HA       ALA  87  -3.683 -31.055  -0.980
  155    HB1  ALA  87           HB1      ALA  87  -2.752 -32.106  -3.063
  156    HB2  ALA  87           HB2      ALA  87  -2.890 -30.340  -3.165
  157    HB3  ALA  87           HB3      ALA  87  -1.307 -31.082  -2.896
  158    H    ARG  88           H        ARG  88  -0.162 -31.596  -0.520
  159    HA   ARG  88           HA       ARG  88  -0.336 -34.348   0.263
  160    HB2  ARG  88           HB2      ARG  88   1.685 -33.051  -0.491
  161    HB3  ARG  88           HB3      ARG  88   1.769 -32.286   1.090
  162    HG2  ARG  88           HG2      ARG  88   1.858 -35.313   0.694
  163    HG3  ARG  88           HG3      ARG  88   3.287 -34.287   0.571
  164    HD2  ARG  88           HD2      ARG  88   2.949 -33.500   2.894
  165    HD3  ARG  88           HD3      ARG  88   1.580 -34.624   3.062
  166    HE   ARG  88           HE       ARG  88   3.808 -36.106   2.138
  167   HH11  ARG  88          HH11      ARG  88   2.884 -34.463   5.098
  168   HH12  ARG  88          HH12      ARG  88   3.850 -35.519   6.091
  169   HH21  ARG  88          HH21      ARG  88   5.009 -37.420   3.468
  170   HH22  ARG  88          HH22      ARG  88   5.014 -37.150   5.185
  171    H    ARG  89           H        ARG  89  -0.354 -31.382   2.287
  172    HA   ARG  89           HA       ARG  89  -0.691 -32.637   4.847
  173    HB2  ARG  89           HB2      ARG  89  -1.551 -29.920   3.762
  174    HB3  ARG  89           HB3      ARG  89  -1.783 -30.397   5.444
  175    HG2  ARG  89           HG2      ARG  89   0.612 -30.678   5.790
  176    HG3  ARG  89           HG3      ARG  89   0.945 -30.321   4.091
  177    HD2  ARG  89           HD2      ARG  89  -0.060 -28.064   4.359
  178    HD3  ARG  89           HD3      ARG  89  -0.390 -28.396   6.058
  179    HE   ARG  89           HE       ARG  89   2.175 -27.665   4.828
  180   HH11  ARG  89          HH11      ARG  89   0.855 -29.097   7.774
  181   HH12  ARG  89          HH12      ARG  89   2.288 -28.672   8.668
  182   HH21  ARG  89          HH21      ARG  89   3.820 -27.187   5.939
  183   HH22  ARG  89          HH22      ARG  89   3.980 -27.594   7.653
  184    H    ASN  90           H        ASN  90  -3.104 -31.860   2.382
  185    HA   ASN  90           HA       ASN  90  -5.313 -32.839   4.097
  186    HB2  ASN  90           HB2      ASN  90  -5.211 -31.494   1.369
  187    HB3  ASN  90           HB3      ASN  90  -6.685 -32.156   2.063
  188   HD21  ASN  90          HD22      ASN  90  -4.241 -29.625   2.479
  189   HD22  ASN  90          HD21      ASN  90  -5.218 -28.682   3.598
  190    H    GLY  91           H        GLY  91  -3.068 -34.522   2.348
  191    HA2  GLY  91           HA2      GLY  91  -2.983 -36.703   1.666
  192    HA3  GLY  91           HA3      GLY  91  -4.599 -36.944   2.330
  193    H    HIS  92           H        HIS  92  -4.143 -34.517  -0.164
  194    HA   HIS  92           HA       HIS  92  -5.910 -36.025  -2.021
  195    HB2  HIS  92           HB2      HIS  92  -4.817 -33.184  -2.181
  196    HB3  HIS  92           HB3      HIS  92  -6.025 -33.885  -3.249
  197    HD1  HIS  92           HD1      HIS  92  -7.632 -35.195  -0.507
  198    HD2  HIS  92           HD2      HIS  92  -6.640 -31.237  -1.616
  199    HE1  HIS  92           HE1      HIS  92  -9.325 -33.666   0.673
  200    HE2  HIS  92           HE2      HIS  92  -8.723 -31.254  -0.012
  201    H    ASN  93           H        ASN  93  -5.409 -36.397  -4.215
  202    HA   ASN  93           HA       ASN  93  -2.721 -37.328  -4.702
  203    HB2  ASN  93           HB2      ASN  93  -4.787 -38.397  -5.582
  204    HB3  ASN  93           HB3      ASN  93  -5.087 -36.984  -6.595
  205   HD21  ASN  93          HD22      ASN  93  -5.096 -38.878  -8.214
  206   HD22  ASN  93          HD21      ASN  93  -3.538 -39.261  -8.934
  207    H    VAL  94           H        VAL  94  -1.005 -36.228  -5.417
  208    HA   VAL  94           HA       VAL  94  -1.203 -34.121  -7.420
  209    HB   VAL  94           HB       VAL  94  -1.566 -32.923  -5.241
  210   HG11  VAL  94          HG11      VAL  94   0.297 -32.509  -3.727
  211   HG12  VAL  94          HG12      VAL  94  -0.078 -34.235  -3.769
  212   HG13  VAL  94          HG13      VAL  94   1.340 -33.607  -4.641
  213   HG21  VAL  94          HG21      VAL  94  -0.170 -31.064  -5.734
  214   HG22  VAL  94          HG22      VAL  94   1.002 -32.065  -6.612
  215   HG23  VAL  94          HG23      VAL  94  -0.640 -31.816  -7.263
  216    H    SER  95           H        SER  95   0.789 -33.751  -8.528
  217    HA   SER  95           HA       SER  95   2.733 -35.906  -8.379
  218    HB2  SER  95           HB2      SER  95   2.135 -34.735 -10.505
  219    HB3  SER  95           HB3      SER  95   2.929 -33.274  -9.884
  220    HG   SER  95           HG       SER  95   4.064 -35.765 -10.630
  221    H    THR  96           H        THR  96   4.934 -35.797  -7.788
  222    HA   THR  96           HA       THR  96   5.631 -34.010  -5.577
  223    HB   THR  96           HB       THR  96   7.862 -35.170  -5.749
  224    HG1  THR  96           HG1      THR  96   7.958 -36.962  -7.150
  225   HG21  THR  96          HG21      THR  96   5.453 -37.044  -5.630
  226   HG22  THR  96          HG22      THR  96   7.066 -37.348  -4.952
  227   HG23  THR  96          HG23      THR  96   6.060 -36.053  -4.286
  228    H    ARG  97           H        ARG  97   6.484 -34.257  -9.007
  229    HA   ARG  97           HA       ARG  97   7.945 -31.628  -8.868
  230    HB2  ARG  97           HB2      ARG  97   9.400 -33.680  -8.828
  231    HB3  ARG  97           HB3      ARG  97   8.766 -34.118 -10.418
  232    HG2  ARG  97           HG2      ARG  97   9.755 -32.090 -11.405
  233    HG3  ARG  97           HG3      ARG  97  10.225 -31.509  -9.799
  234    HD2  ARG  97           HD2      ARG  97  12.178 -32.431 -10.892
  235    HD3  ARG  97           HD3      ARG  97  11.738 -33.450  -9.533
  236    HE   ARG  97           HE       ARG  97  11.209 -35.206 -10.958
  237   HH11  ARG  97          HH11      ARG  97  11.756 -32.386 -12.978
  238   HH12  ARG  97          HH12      ARG  97  11.780 -33.333 -14.440
  239   HH21  ARG  97          HH21      ARG  97  11.240 -36.342 -12.856
  240   HH22  ARG  97          HH22      ARG  97  11.496 -35.517 -14.367
  241    H    GLY  98           H        GLY  98   5.673 -33.566 -10.685
  242    HA2  GLY  98           HA2      GLY  98   5.805 -32.017 -13.164
  243    HA3  GLY  98           HA3      GLY  98   4.641 -33.264 -12.726
  244    H    ARG  99           H        ARG  99   3.296 -31.635 -13.910
  245    HA   ARG  99           HA       ARG  99   2.506 -29.147 -12.637
  246    HB2  ARG  99           HB2      ARG  99   1.205 -30.818 -14.835
  247    HB3  ARG  99           HB3      ARG  99   0.631 -29.226 -14.323
  248    HG2  ARG  99           HG2      ARG  99   2.813 -28.213 -14.957
  249    HG3  ARG  99           HG3      ARG  99   3.406 -29.805 -15.449
  250    HD2  ARG  99           HD2      ARG  99   2.737 -28.644 -17.430
  251    HD3  ARG  99           HD3      ARG  99   1.578 -29.953 -17.135
  252    HE   ARG  99           HE       ARG  99   0.705 -27.431 -15.974
  253   HH11  ARG  99          HH11      ARG  99   0.841 -29.070 -19.068
  254   HH12  ARG  99          HH12      ARG  99  -0.507 -28.175 -19.712
  255   HH21  ARG  99          HH21      ARG  99  -1.020 -26.328 -16.846
  256   HH22  ARG  99          HH22      ARG  99  -1.524 -26.652 -18.476
  257    H    ILE 100           H        ILE 100   0.471 -28.606 -11.775
  258    HA   ILE 100           HA       ILE 100  -0.780 -30.740 -10.123
  259    HB   ILE 100           HB       ILE 100  -0.868 -27.737  -9.789
  260   HG12  ILE 100          HG12      ILE 100   0.682 -29.969  -8.392
  261   HG13  ILE 100          HG13      ILE 100   1.346 -28.618  -9.310
  262   HG21  ILE 100          HG21      ILE 100  -1.967 -29.934  -7.966
  263   HG22  ILE 100          HG22      ILE 100  -1.997 -28.186  -7.658
  264   HG23  ILE 100          HG23      ILE 100  -2.954 -28.844  -8.964
  265   HD11  ILE 100          HD11      ILE 100   0.402 -27.055  -7.570
  266   HD12  ILE 100          HD12      ILE 100   0.034 -28.507  -6.593
  267   HD13  ILE 100          HD13      ILE 100   1.704 -28.138  -7.039
  268    HA   PRO 101           HA       PRO 101  -4.347 -30.437 -12.866
  269    HB2  PRO 101           HB2      PRO 101  -5.989 -31.490 -10.604
  270    HB3  PRO 101           HB3      PRO 101  -5.793 -32.139 -12.256
  271    HG2  PRO 101           HG2      PRO 101  -4.617 -33.331 -10.099
  272    HG3  PRO 101           HG3      PRO 101  -3.786 -33.236 -11.687
  273    HD2  PRO 101           HD2      PRO 101  -3.396 -31.468  -9.260
  274    HD3  PRO 101           HD3      PRO 101  -2.177 -32.229 -10.327
  275    H    ALA 102           H        ALA 102  -5.846 -28.835 -13.287
  276    HA   ALA 102           HA       ALA 102  -6.037 -26.582 -11.661
  277    HB1  ALA 102           HB1      ALA 102  -7.967 -27.470 -13.814
  278    HB2  ALA 102           HB2      ALA 102  -7.724 -25.818 -13.189
  279    HB3  ALA 102           HB3      ALA 102  -6.413 -26.623 -14.079
  280    H    ASP 103           H        ASP 103  -8.161 -29.435 -11.696
  281    HA   ASP 103           HA       ASP 103 -10.211 -28.498 -10.085
  282    HB2  ASP 103           HB2      ASP 103 -10.199 -30.650 -11.285
  283    HB3  ASP 103           HB3      ASP 103  -8.953 -31.264 -10.198
  284    H    VAL 104           H        VAL 104  -6.969 -29.633  -9.124
  285    HA   VAL 104           HA       VAL 104  -7.533 -29.557  -6.288
  286    HB   VAL 104           HB       VAL 104  -4.871 -29.811  -7.657
  287   HG11  VAL 104          HG11      VAL 104  -4.123 -30.873  -5.545
  288   HG12  VAL 104          HG12      VAL 104  -4.610 -29.196  -5.298
  289   HG13  VAL 104          HG13      VAL 104  -5.705 -30.514  -4.818
  290   HG21  VAL 104          HG21      VAL 104  -5.060 -32.254  -7.224
  291   HG22  VAL 104          HG22      VAL 104  -6.711 -32.015  -6.613
  292   HG23  VAL 104          HG23      VAL 104  -6.327 -31.713  -8.321
  293    H    ILE 105           H        ILE 105  -5.925 -27.442  -8.680
  294    HA   ILE 105           HA       ILE 105  -5.115 -25.383  -6.838
  295    HB   ILE 105           HB       ILE 105  -5.859 -25.408  -9.784
  296   HG12  ILE 105          HG11      ILE 105  -3.099 -24.814  -8.656
  297   HG13  ILE 105          HG12      ILE 105  -3.656 -26.480  -8.602
  298   HG21  ILE 105          HG21      ILE 105  -6.293 -23.130  -9.087
  299   HG22  ILE 105          HG22      ILE 105  -4.779 -23.069  -8.148
  300   HG23  ILE 105          HG23      ILE 105  -4.741 -23.154  -9.923
  301   HD11  ILE 105          HD11      ILE 105  -3.972 -26.579 -10.960
  302   HD12  ILE 105          HD12      ILE 105  -3.601 -24.848 -11.159
  303   HD13  ILE 105          HD13      ILE 105  -2.336 -25.977 -10.630
  304    H    ASP 106           H        ASP 106  -8.213 -25.787  -8.668
  305    HA   ASP 106           HA       ASP 106  -9.571 -23.676  -7.461
  306    HB2  ASP 106           HB2      ASP 106 -10.342 -24.862  -9.462
  307    HB3  ASP 106           HB3      ASP 106 -10.652 -26.315  -8.503
  308    H    ALA 107           H        ALA 107  -9.399 -27.143  -6.389
  309    HA   ALA 107           HA       ALA 107 -10.923 -26.963  -4.115
  310    HB1  ALA 107           HB1      ALA 107  -9.690 -28.951  -3.363
  311    HB2  ALA 107           HB2      ALA 107 -10.000 -29.051  -5.098
  312    HB3  ALA 107           HB3      ALA 107  -8.383 -28.617  -4.518
  313    H    TYR 108           H        TYR 108  -7.422 -26.209  -4.396
  314    HA   TYR 108           HA       TYR 108  -6.951 -25.428  -1.699
  315    HB2  TYR 108           HB2      TYR 108  -5.092 -25.801  -3.119
  316    HB3  TYR 108           HB3      TYR 108  -5.688 -24.732  -4.364
  317    HD1  TYR 108           HD2      TYR 108  -4.191 -24.815  -0.959
  318    HD2  TYR 108           HD1      TYR 108  -5.227 -22.376  -4.361
  319    HE1  TYR 108           HE2      TYR 108  -2.776 -22.977  -0.063
  320    HE2  TYR 108           HE1      TYR 108  -3.831 -20.523  -3.449
  321    HH   TYR 108           HH       TYR 108  -2.001 -20.829  -0.376
  322    H    HIS 109           H        HIS 109  -7.874 -23.358  -4.540
  323    HA   HIS 109           HA       HIS 109  -8.124 -20.979  -2.970
  324    HB2  HIS 109           HB2      HIS 109  -9.287 -21.765  -5.663
  325    HB3  HIS 109           HB3      HIS 109  -9.565 -20.182  -4.934
  326    HD1  HIS 109           HD1      HIS 109  -7.024 -18.945  -4.128
  327    HD2  HIS 109           HD2      HIS 109  -7.269 -21.731  -7.281
  328    HE1  HIS 109           HE1      HIS 109  -4.941 -18.560  -5.595
  329    HE2  HIS 109           HE2      HIS 109  -5.101 -20.252  -7.530
  330    H    ALA 110           H        ALA 110 -10.595 -23.488  -3.645
  331    HA   ALA 110           HA       ALA 110 -12.741 -22.101  -2.379
  332    HB1  ALA 110           HB1      ALA 110 -13.035 -24.068  -3.842
  333    HB2  ALA 110           HB2      ALA 110 -12.218 -25.099  -2.649
  334    HB3  ALA 110           HB3      ALA 110 -13.774 -24.345  -2.253
  335    H    ALA 111           H        ALA 111 -10.251 -24.331  -0.969
  336    HA   ALA 111           HA       ALA 111 -11.252 -24.234   1.635
  337    HB1  ALA 111           HB1      ALA 111  -8.437 -24.784   0.635
  338    HB2  ALA 111           HB2      ALA 111  -9.076 -25.204   2.237
  339    HB3  ALA 111           HB3      ALA 111  -9.758 -25.968   0.785
  340    H    THR 112           H        THR 112  -8.772 -22.153   0.033
  341    HA   THR 112           HA       THR 112  -8.186 -20.705   2.499
  342    HB   THR 112           HB       THR 112  -6.781 -19.259   1.098
  343    HG1  THR 112           HG1      THR 112  -6.562 -19.796  -1.097
  344   HG21  THR 112          HG21      THR 112  -5.880 -21.408   1.962
  345   HG22  THR 112          HG22      THR 112  -6.353 -22.206   0.445
  346   HG23  THR 112          HG23      THR 112  -5.143 -20.913   0.429
  347    H    LEU 113           H        LEU 113 -10.371 -20.050  -0.213
  348    HA   LEU 113           HA       LEU 113 -10.946 -17.346   0.876
  349    HB2  LEU 113           HB2      LEU 113 -11.958 -18.686  -1.658
  350    HB3  LEU 113           HB3      LEU 113 -12.163 -16.995  -1.210
  351    HG   LEU 113           HG       LEU 113  -9.494 -18.351  -1.801
  352   HD11  LEU 113          HD11      LEU 113 -10.907 -18.083  -3.795
  353   HD12  LEU 113          HD12      LEU 113 -11.133 -16.358  -3.425
  354   HD13  LEU 113          HD13      LEU 113  -9.522 -16.984  -3.851
  355   HD21  LEU 113          HD21      LEU 113  -9.163 -16.500  -0.231
  356   HD22  LEU 113          HD22      LEU 113  -8.586 -16.035  -1.831
  357   HD23  LEU 113          HD23      LEU 113 -10.146 -15.421  -1.246
  358    H    GLU 114           H        GLU 114 -12.667 -20.373   0.234
  359    HA   GLU 114           HA       GLU 114 -14.827 -21.047   0.633
  360    HB2  GLU 114           HB2      GLU 114 -13.344 -21.230   2.719
  361    HB3  GLU 114           HB3      GLU 114 -14.301 -19.914   3.395
  362    HG2  GLU 114           HG2      GLU 114 -16.368 -21.336   3.085
  363    HG3  GLU 114           HG3      GLU 114 -15.360 -22.605   2.397
  364    H    HIS 115           H        HIS 115 -14.954 -18.591  -0.641
  365    HA   HIS 115           HA       HIS 115 -16.139 -16.763  -1.186
  366    HB2  HIS 115           HB2      HIS 115 -17.937 -18.463  -1.244
  367    HB3  HIS 115           HB3      HIS 115 -18.407 -18.031   0.391
  368    HD1  HIS 115           HD1      HIS 115 -18.426 -16.574  -3.188
  369    HD2  HIS 115           HD2      HIS 115 -19.901 -15.831   0.707
  370    HE1  HIS 115           HE1      HIS 115 -20.140 -14.665  -3.408
  371    HE2  HIS 115           HE2      HIS 115 -21.042 -14.224  -1.034
  372    H    HIS 116           H        HIS 116 -15.903 -17.249   2.251
  373    HA   HIS 116           HA       HIS 116 -16.783 -14.476   2.871
  374    HB2  HIS 116           HB2      HIS 116 -16.258 -16.881   4.668
  375    HB3  HIS 116           HB3      HIS 116 -16.948 -15.343   5.171
  376    HD1  HIS 116           HD1      HIS 116 -17.918 -18.515   3.213
  377    HD2  HIS 116           HD2      HIS 116 -19.515 -14.836   4.566
  378    HE1  HIS 116           HE1      HIS 116 -20.481 -18.694   2.966
  379    HE2  HIS 116           HE2      HIS 116 -21.445 -16.446   3.783
  380    H    HIS 117           H        HIS 117 -13.748 -16.195   2.705
  381    HA   HIS 117           HA       HIS 117 -12.396 -14.237   4.520
  382    HB2  HIS 117           HB2      HIS 117 -12.187 -16.614   5.085
  383    HB3  HIS 117           HB3      HIS 117 -11.552 -16.975   3.489
  384    HD1  HIS 117           HD1      HIS 117  -8.978 -17.085   3.419
  385    HD2  HIS 117           HD2      HIS 117 -10.545 -14.709   6.547
  386    HE1  HIS 117           HE1      HIS 117  -6.955 -16.269   4.810
  387    HE2  HIS 117           HE2      HIS 117  -7.922 -14.856   6.725
  388    H    HIS 118           H        HIS 118 -11.315 -12.617   3.669
  389    HA   HIS 118           HA       HIS 118 -10.069 -12.794   0.947
  390    HB2  HIS 118           HB2      HIS 118 -11.923 -10.590   1.947
  391    HB3  HIS 118           HB3      HIS 118 -11.034 -10.564   0.425
  392    HD1  HIS 118           HD1      HIS 118 -11.779 -12.497  -1.428
  393    HD2  HIS 118           HD2      HIS 118 -14.267 -11.828   1.922
  394    HE1  HIS 118           HE1      HIS 118 -14.047 -13.586  -1.986
  395    HE2  HIS 118           HE2      HIS 118 -15.554 -13.211   0.070
  396    H    HIS 119           H        HIS 119  -8.766 -12.965   3.515
  397    HA   HIS 119           HA       HIS 119  -6.984 -10.559   3.419
  398    HB2  HIS 119           HB2      HIS 119  -7.997 -11.884   5.973
  399    HB3  HIS 119           HB3      HIS 119  -6.921 -10.498   5.874
  400    HD1  HIS 119           HD1      HIS 119  -8.330  -8.398   4.203
  401    HD2  HIS 119           HD2      HIS 119 -10.363 -11.149   6.684
  402    HE1  HIS 119           HE1      HIS 119 -10.639  -7.362   4.703
  403    HE2  HIS 119           HE2      HIS 119 -11.867  -9.043   6.214
  404    H    HIS 120           H        HIS 120  -4.878 -10.886   4.409
  405    HA   HIS 120           HA       HIS 120  -3.869 -13.695   4.484
  406    HB2  HIS 120           HB2      HIS 120  -2.550 -11.374   3.019
  407    HB3  HIS 120           HB3      HIS 120  -1.874 -12.983   3.232
  408    HD1  HIS 120           HD1      HIS 120  -3.617 -11.111   0.667
  409    HD2  HIS 120           HD2      HIS 120  -3.727 -15.046   2.200
  410    HE1  HIS 120           HE1      HIS 120  -4.718 -12.568  -1.154
  411    HE2  HIS 120           HE2      HIS 120  -4.762 -14.972  -0.222
  Start of MODEL    7
    1    H1   SER  66           H1       SER  66  25.479 -23.522  15.583
    2    H2   SER  66           H2       SER  66  26.308 -24.928  15.414
    3    H3   SER  66           H3       SER  66  24.990 -24.631  14.487
    4    HA   SER  66           HA       SER  66  25.003 -25.013  17.408
    5    HB2  SER  66           HB2      SER  66  22.607 -24.559  15.584
    6    HB3  SER  66           HB3      SER  66  22.569 -24.845  17.336
    7    HG   SER  66           HG       SER  66  22.483 -22.594  16.828
    8    H    GLY  67           H        GLY  67  24.102 -26.995  18.194
    9    HA2  GLY  67           HA2      GLY  67  24.753 -29.304  16.589
   10    HA3  GLY  67           HA3      GLY  67  24.080 -29.286  18.217
   11    H    SER  68           H        SER  68  21.721 -27.628  17.062
   12    HA   SER  68           HA       SER  68  20.331 -29.562  15.319
   13    HB2  SER  68           HB2      SER  68  19.873 -30.223  17.709
   14    HB3  SER  68           HB3      SER  68  19.104 -28.644  17.945
   15    HG   SER  68           HG       SER  68  17.618 -30.347  17.365
   16    H    GLY  69           H        GLY  69  18.294 -28.672  14.463
   17    HA2  GLY  69           HA2      GLY  69  17.429 -25.997  14.673
   18    HA3  GLY  69           HA3      GLY  69  18.623 -26.046  13.374
   19    H    ARG  70           H        ARG  70  16.299 -25.236  12.578
   20    HA   ARG  70           HA       ARG  70  15.052 -27.483  11.025
   21    HB2  ARG  70           HB2      ARG  70  13.575 -25.212  12.439
   22    HB3  ARG  70           HB3      ARG  70  12.854 -26.334  11.277
   23    HG2  ARG  70           HG2      ARG  70  13.412 -28.250  12.770
   24    HG3  ARG  70           HG3      ARG  70  14.058 -27.113  13.971
   25    HD2  ARG  70           HD2      ARG  70  11.851 -26.019  14.130
   26    HD3  ARG  70           HD3      ARG  70  11.197 -27.158  12.931
   27    HE   ARG  70           HE       ARG  70  12.375 -28.657  15.051
   28   HH11  ARG  70          HH11      ARG  70   9.568 -26.604  14.606
   29   HH12  ARG  70          HH12      ARG  70   8.666 -27.405  15.863
   30   HH21  ARG  70          HH21      ARG  70  11.166 -29.657  16.619
   31   HH22  ARG  70          HH22      ARG  70   9.559 -29.096  16.976
   32    H    GLY  71           H        GLY  71  14.393 -27.143   9.087
   33    HA2  GLY  71           HA2      GLY  71  14.070 -24.994   7.450
   34    HA3  GLY  71           HA3      GLY  71  15.829 -25.110   7.552
   35    H    ARG  72           H        ARG  72  14.413 -25.423   5.238
   36    HA   ARG  72           HA       ARG  72  15.216 -28.142   4.360
   37    HB2  ARG  72           HB2      ARG  72  13.144 -28.558   3.144
   38    HB3  ARG  72           HB3      ARG  72  12.856 -28.394   4.870
   39    HG2  ARG  72           HG2      ARG  72  12.046 -26.048   4.496
   40    HG3  ARG  72           HG3      ARG  72  12.263 -26.276   2.747
   41    HD2  ARG  72           HD2      ARG  72  10.664 -28.167   2.803
   42    HD3  ARG  72           HD3      ARG  72  10.472 -27.953   4.555
   43    HE   ARG  72           HE       ARG  72   9.873 -25.487   3.197
   44   HH11  ARG  72          HH11      ARG  72   8.382 -28.638   3.755
   45   HH12  ARG  72          HH12      ARG  72   6.768 -27.946   3.627
   46   HH21  ARG  72          HH21      ARG  72   7.805 -24.771   2.961
   47   HH22  ARG  72          HH22      ARG  72   6.464 -25.927   3.022
   48    H    GLY  73           H        GLY  73  15.790 -28.400   2.247
   49    HA2  GLY  73           HA2      GLY  73  16.721 -25.993   0.838
   50    HA3  GLY  73           HA3      GLY  73  17.070 -27.672   0.443
   51    H    ALA  74           H        ALA  74  13.849 -27.852   0.637
   52    HA   ALA  74           HA       ALA  74  13.424 -27.827  -2.214
   53    HB1  ALA  74           HB1      ALA  74  11.153 -28.554  -1.590
   54    HB2  ALA  74           HB2      ALA  74  12.374 -29.440  -0.660
   55    HB3  ALA  74           HB3      ALA  74  11.458 -28.117   0.104
   56    H    ILE  75           H        ILE  75  11.532 -26.768  -3.244
   57    HA   ILE  75           HA       ILE  75  11.602 -23.899  -3.029
   58    HB   ILE  75           HB       ILE  75   9.561 -25.656  -4.438
   59   HG12  ILE  75          HG12      ILE  75  11.712 -26.289  -5.317
   60   HG13  ILE  75          HG13      ILE  75  10.869 -25.316  -6.499
   61   HG21  ILE  75          HG21      ILE  75  10.302 -22.727  -4.883
   62   HG22  ILE  75          HG22      ILE  75   9.218 -23.692  -5.912
   63   HG23  ILE  75          HG23      ILE  75   8.771 -23.352  -4.242
   64   HD11  ILE  75          HD11      ILE  75  13.245 -24.747  -6.429
   65   HD12  ILE  75          HD12      ILE  75  12.284 -23.350  -5.918
   66   HD13  ILE  75          HD13      ILE  75  13.143 -24.340  -4.709
   67    H    ASP  76           H        ASP  76  10.204 -22.472  -2.063
   68    HA   ASP  76           HA       ASP  76   8.140 -23.598  -0.182
   69    HB2  ASP  76           HB2      ASP  76  10.386 -23.297   0.852
   70    HB3  ASP  76           HB3      ASP  76  10.312 -21.577   0.478
   71    H    ARG  77           H        ARG  77   9.343 -20.469  -1.540
   72    HA   ARG  77           HA       ARG  77   6.906 -19.076  -0.799
   73    HB2  ARG  77           HB2      ARG  77   9.238 -18.131  -0.843
   74    HB3  ARG  77           HB3      ARG  77   9.184 -18.162  -2.611
   75    HG2  ARG  77           HG2      ARG  77   7.315 -16.543  -2.598
   76    HG3  ARG  77           HG3      ARG  77   7.222 -16.645  -0.832
   77    HD2  ARG  77           HD2      ARG  77   8.360 -14.617  -1.402
   78    HD3  ARG  77           HD3      ARG  77   9.521 -15.730  -0.664
   79    HE   ARG  77           HE       ARG  77   9.518 -15.951  -3.557
   80   HH11  ARG  77          HH11      ARG  77  10.720 -13.828  -1.039
   81   HH12  ARG  77          HH12      ARG  77  12.034 -13.249  -2.025
   82   HH21  ARG  77          HH21      ARG  77  11.230 -15.179  -4.761
   83   HH22  ARG  77          HH22      ARG  77  12.303 -13.992  -4.083
   84    H    GLU  78           H        GLU  78   7.801 -20.825  -3.643
   85    HA   GLU  78           HA       GLU  78   6.153 -19.434  -5.541
   86    HB2  GLU  78           HB2      GLU  78   8.108 -20.901  -6.067
   87    HB3  GLU  78           HB3      GLU  78   7.137 -22.309  -5.618
   88    HG2  GLU  78           HG2      GLU  78   5.549 -21.836  -7.432
   89    HG3  GLU  78           HG3      GLU  78   6.388 -20.331  -7.813
   90    H    GLN  79           H        GLN  79   4.020 -19.701  -6.158
   91    HA   GLN  79           HA       GLN  79   2.192 -20.803  -4.283
   92    HB2  GLN  79           HB2      GLN  79   1.782 -19.982  -7.187
   93    HB3  GLN  79           HB3      GLN  79   0.482 -20.377  -6.057
   94    HG2  GLN  79           HG2      GLN  79   1.196 -18.544  -4.553
   95    HG3  GLN  79           HG3      GLN  79   2.492 -18.117  -5.665
   96   HE21  GLN  79          HE22      GLN  79  -1.069 -18.145  -5.258
   97   HE22  GLN  79          HE21      GLN  79  -1.359 -17.007  -6.567
   98    H    SER  80           H        SER  80   3.451 -22.255  -7.322
   99    HA   SER  80           HA       SER  80   1.856 -24.591  -7.338
  100    HB2  SER  80           HB2      SER  80   4.777 -24.321  -8.155
  101    HB3  SER  80           HB3      SER  80   3.646 -25.587  -8.685
  102    HG   SER  80           HG       SER  80   3.824 -23.859 -10.221
  103    H    ALA  81           H        ALA  81   4.953 -24.011  -5.567
  104    HA   ALA  81           HA       ALA  81   5.071 -26.605  -4.416
  105    HB1  ALA  81           HB1      ALA  81   7.019 -25.141  -4.675
  106    HB2  ALA  81           HB2      ALA  81   6.331 -23.985  -3.506
  107    HB3  ALA  81           HB3      ALA  81   6.793 -25.612  -2.981
  108    H    ALA  82           H        ALA  82   3.684 -23.503  -3.218
  109    HA   ALA  82           HA       ALA  82   2.831 -24.459  -0.680
  110    HB1  ALA  82           HB1      ALA  82   1.348 -22.507  -0.700
  111    HB2  ALA  82           HB2      ALA  82   2.948 -22.074  -1.341
  112    HB3  ALA  82           HB3      ALA  82   1.578 -22.314  -2.450
  113    H    ILE  83           H        ILE  83   1.100 -24.512  -3.838
  114    HA   ILE  83           HA       ILE  83  -1.270 -25.787  -2.791
  115    HB   ILE  83           HB       ILE  83  -0.187 -25.503  -5.616
  116   HG12  ILE  83          HG12      ILE  83  -2.517 -24.171  -4.163
  117   HG13  ILE  83          HG13      ILE  83  -0.938 -23.435  -4.317
  118   HG21  ILE  83          HG21      ILE  83  -2.460 -26.195  -6.392
  119   HG22  ILE  83          HG22      ILE  83  -1.665 -27.514  -5.550
  120   HG23  ILE  83          HG23      ILE  83  -2.922 -26.566  -4.723
  121   HD11  ILE  83          HD11      ILE  83  -2.897 -23.993  -6.559
  122   HD12  ILE  83          HD12      ILE  83  -2.308 -22.436  -5.968
  123   HD13  ILE  83          HD13      ILE  83  -1.197 -23.515  -6.834
  124    H    ARG  84           H        ARG  84   1.678 -27.167  -4.364
  125    HA   ARG  84           HA       ARG  84   0.875 -29.923  -4.166
  126    HB2  ARG  84           HB2      ARG  84   3.542 -28.471  -4.320
  127    HB3  ARG  84           HB3      ARG  84   3.524 -30.191  -3.928
  128    HG2  ARG  84           HG2      ARG  84   2.348 -30.763  -5.922
  129    HG3  ARG  84           HG3      ARG  84   2.096 -29.067  -6.359
  130    HD2  ARG  84           HD2      ARG  84   4.466 -28.762  -6.777
  131    HD3  ARG  84           HD3      ARG  84   4.840 -30.362  -6.123
  132    HE   ARG  84           HE       ARG  84   3.492 -31.358  -7.988
  133   HH11  ARG  84          HH11      ARG  84   5.034 -28.256  -8.654
  134   HH12  ARG  84          HH12      ARG  84   4.909 -28.511 -10.373
  135   HH21  ARG  84          HH21      ARG  84   3.419 -31.596 -10.095
  136   HH22  ARG  84          HH22      ARG  84   3.988 -30.340 -11.183
  137    H    GLU  85           H        GLU  85   2.716 -27.964  -1.753
  138    HA   GLU  85           HA       GLU  85   2.780 -29.969   0.182
  139    HB2  GLU  85           HB2      GLU  85   4.204 -28.048   0.304
  140    HB3  GLU  85           HB3      GLU  85   2.823 -26.952   0.507
  141    HG2  GLU  85           HG2      GLU  85   2.326 -27.816   2.686
  142    HG3  GLU  85           HG3      GLU  85   3.335 -29.240   2.430
  143    H    TRP  86           H        TRP  86   0.285 -27.333  -0.136
  144    HA   TRP  86           HA       TRP  86  -1.327 -28.125   1.973
  145    HB2  TRP  86           HB2      TRP  86  -1.641 -26.030   0.789
  146    HB3  TRP  86           HB3      TRP  86  -2.074 -26.882  -0.692
  147    HD1  TRP  86           HD1      TRP  86  -3.444 -26.042   2.775
  148    HE1  TRP  86           HE1      TRP  86  -5.993 -26.340   2.803
  149    HE3  TRP  86           HE3      TRP  86  -4.087 -28.016  -1.913
  150    HZ2  TRP  86           HZ2      TRP  86  -8.033 -27.403   1.065
  151    HZ3  TRP  86           HZ3      TRP  86  -6.365 -28.595  -2.724
  152    HH2  TRP  86           HH2      TRP  86  -8.336 -28.318  -1.233
  153    H    ALA  87           H        ALA  87  -1.484 -29.253  -1.436
  154    HA   ALA  87           HA       ALA  87  -3.657 -31.053  -1.116
  155    HB1  ALA  87           HB1      ALA  87  -1.287 -31.039  -3.035
  156    HB2  ALA  87           HB2      ALA  87  -2.747 -32.033  -3.248
  157    HB3  ALA  87           HB3      ALA  87  -2.856 -30.259  -3.287
  158    H    ARG  88           H        ARG  88  -0.110 -31.681  -0.850
  159    HA   ARG  88           HA       ARG  88  -0.316 -34.452  -0.203
  160    HB2  ARG  88           HB2      ARG  88   1.731 -33.271  -0.971
  161    HB3  ARG  88           HB3      ARG  88   1.849 -32.439   0.584
  162    HG2  ARG  88           HG2      ARG  88   2.156 -34.613   1.736
  163    HG3  ARG  88           HG3      ARG  88   1.936 -35.471   0.195
  164    HD2  ARG  88           HD2      ARG  88   3.955 -34.366  -0.709
  165    HD3  ARG  88           HD3      ARG  88   4.168 -33.494   0.830
  166    HE   ARG  88           HE       ARG  88   4.017 -36.276   1.404
  167   HH11  ARG  88          HH11      ARG  88   6.279 -34.115  -0.181
  168   HH12  ARG  88          HH12      ARG  88   7.648 -35.120   0.199
  169   HH21  ARG  88          HH21      ARG  88   5.816 -37.513   1.860
  170   HH22  ARG  88          HH22      ARG  88   7.383 -37.001   1.315
  171    H    ARG  89           H        ARG  89  -0.214 -31.621   1.993
  172    HA   ARG  89           HA       ARG  89  -0.390 -33.175   4.441
  173    HB2  ARG  89           HB2      ARG  89  -0.944 -30.242   3.805
  174    HB3  ARG  89           HB3      ARG  89  -1.046 -30.927   5.433
  175    HG2  ARG  89           HG2      ARG  89   1.314 -31.651   5.322
  176    HG3  ARG  89           HG3      ARG  89   1.464 -30.973   3.696
  177    HD2  ARG  89           HD2      ARG  89   0.895 -28.721   4.599
  178    HD3  ARG  89           HD3      ARG  89   0.790 -29.396   6.227
  179    HE   ARG  89           HE       ARG  89   3.237 -28.856   4.646
  180   HH11  ARG  89          HH11      ARG  89   2.116 -30.456   7.576
  181   HH12  ARG  89          HH12      ARG  89   3.721 -30.431   8.257
  182   HH21  ARG  89          HH21      ARG  89   5.109 -28.847   5.504
  183   HH22  ARG  89          HH22      ARG  89   5.424 -29.532   7.099
  184    H    ASN  90           H        ASN  90  -2.890 -32.073   2.240
  185    HA   ASN  90           HA       ASN  90  -5.005 -33.020   4.120
  186    HB2  ASN  90           HB2      ASN  90  -5.118 -31.344   1.585
  187    HB3  ASN  90           HB3      ASN  90  -6.539 -31.968   2.422
  188   HD21  ASN  90          HD22      ASN  90  -3.880 -29.668   2.665
  189   HD22  ASN  90          HD21      ASN  90  -4.563 -28.803   4.044
  190    H    GLY  91           H        GLY  91  -3.091 -34.596   1.970
  191    HA2  GLY  91           HA2      GLY  91  -3.231 -36.714   1.115
  192    HA3  GLY  91           HA3      GLY  91  -4.826 -36.889   1.847
  193    H    HIS  92           H        HIS  92  -4.307 -34.269  -0.425
  194    HA   HIS  92           HA       HIS  92  -6.254 -35.480  -2.323
  195    HB2  HIS  92           HB2      HIS  92  -5.041 -32.686  -2.295
  196    HB3  HIS  92           HB3      HIS  92  -6.371 -33.235  -3.301
  197    HD1  HIS  92           HD1      HIS  92  -8.033 -34.683  -0.820
  198    HD2  HIS  92           HD2      HIS  92  -6.434 -30.785  -1.091
  199    HE1  HIS  92           HE1      HIS  92  -9.426 -33.219   0.766
  200    HE2  HIS  92           HE2      HIS  92  -8.458 -30.834   0.584
  201    H    ASN  93           H        ASN  93  -5.897 -35.577  -4.590
  202    HA   ASN  93           HA       ASN  93  -3.333 -36.718  -5.231
  203    HB2  ASN  93           HB2      ASN  93  -5.529 -37.554  -6.035
  204    HB3  ASN  93           HB3      ASN  93  -5.724 -36.097  -7.013
  205   HD21  ASN  93          HD22      ASN  93  -5.979 -38.004  -8.633
  206   HD22  ASN  93          HD21      ASN  93  -4.492 -38.501  -9.431
  207    H    VAL  94           H        VAL  94  -1.559 -35.765  -5.933
  208    HA   VAL  94           HA       VAL  94  -1.584 -33.831  -8.081
  209    HB   VAL  94           HB       VAL  94  -1.740 -32.270  -6.206
  210   HG11  VAL  94          HG11      VAL  94  -0.676 -33.587  -4.404
  211   HG12  VAL  94          HG12      VAL  94   0.903 -33.436  -5.215
  212   HG13  VAL  94          HG13      VAL  94   0.088 -32.002  -4.589
  213   HG21  VAL  94          HG21      VAL  94   1.052 -32.149  -7.372
  214   HG22  VAL  94          HG22      VAL  94  -0.422 -31.702  -8.256
  215   HG23  VAL  94          HG23      VAL  94   0.035 -30.812  -6.794
  216    H    SER  95           H        SER  95   0.300 -33.949  -9.334
  217    HA   SER  95           HA       SER  95   2.184 -36.121  -8.636
  218    HB2  SER  95           HB2      SER  95   1.212 -36.141 -10.872
  219    HB3  SER  95           HB3      SER  95   1.892 -34.533 -11.200
  220    HG   SER  95           HG       SER  95   3.193 -36.370 -11.948
  221    H    THR  96           H        THR  96   4.413 -35.844  -8.466
  222    HA   THR  96           HA       THR  96   5.424 -33.242  -7.596
  223    HB   THR  96           HB       THR  96   7.600 -34.499  -7.432
  224    HG1  THR  96           HG1      THR  96   7.492 -36.726  -7.711
  225   HG21  THR  96          HG21      THR  96   5.994 -34.407  -5.521
  226   HG22  THR  96          HG22      THR  96   5.236 -35.905  -6.108
  227   HG23  THR  96          HG23      THR  96   6.929 -35.915  -5.567
  228    H    ARG  97           H        ARG  97   5.079 -34.735 -10.649
  229    HA   ARG  97           HA       ARG  97   7.111 -32.938 -11.949
  230    HB2  ARG  97           HB2      ARG  97   5.945 -35.628 -12.782
  231    HB3  ARG  97           HB3      ARG  97   6.910 -34.616 -13.857
  232    HG2  ARG  97           HG2      ARG  97   8.855 -35.258 -12.959
  233    HG3  ARG  97           HG3      ARG  97   8.315 -35.002 -11.303
  234    HD2  ARG  97           HD2      ARG  97   7.614 -37.450 -12.969
  235    HD3  ARG  97           HD3      ARG  97   8.972 -37.367 -11.843
  236    HE   ARG  97           HE       ARG  97   7.221 -36.767 -10.060
  237   HH11  ARG  97          HH11      ARG  97   6.415 -38.989 -12.660
  238   HH12  ARG  97          HH12      ARG  97   5.245 -39.831 -11.680
  239   HH21  ARG  97          HH21      ARG  97   5.801 -37.867  -8.895
  240   HH22  ARG  97          HH22      ARG  97   4.888 -39.196  -9.580
  241    H    GLY  98           H        GLY  98   6.547 -32.060 -14.010
  242    HA2  GLY  98           HA2      GLY  98   5.224 -30.891 -15.498
  243    HA3  GLY  98           HA3      GLY  98   3.982 -32.107 -15.197
  244    H    ARG  99           H        ARG  99   2.472 -30.388 -15.558
  245    HA   ARG  99           HA       ARG  99   2.195 -28.184 -13.618
  246    HB2  ARG  99           HB2      ARG  99   0.394 -29.143 -15.891
  247    HB3  ARG  99           HB3      ARG  99   0.084 -27.719 -14.888
  248    HG2  ARG  99           HG2      ARG  99   2.232 -26.710 -15.634
  249    HG3  ARG  99           HG3      ARG  99   2.529 -28.110 -16.678
  250    HD2  ARG  99           HD2      ARG  99   0.446 -27.642 -17.919
  251    HD3  ARG  99           HD3      ARG  99   0.148 -26.225 -16.885
  252    HE   ARG  99           HE       ARG  99   2.749 -25.968 -18.013
  253   HH11  ARG  99          HH11      ARG  99  -0.564 -25.867 -19.157
  254   HH12  ARG  99          HH12      ARG  99  -0.171 -24.813 -20.487
  255   HH21  ARG  99          HH21      ARG  99   3.181 -24.616 -19.728
  256   HH22  ARG  99          HH22      ARG  99   1.902 -24.130 -20.798
  257    H    ILE 100           H        ILE 100   0.374 -27.850 -12.292
  258    HA   ILE 100           HA       ILE 100  -0.488 -30.246 -10.827
  259    HB   ILE 100           HB       ILE 100  -0.928 -27.290 -10.352
  260   HG12  ILE 100          HG12      ILE 100   0.896 -29.340  -9.005
  261   HG13  ILE 100          HG13      ILE 100   1.414 -28.066 -10.113
  262   HG21  ILE 100          HG21      ILE 100  -1.845 -27.805  -8.181
  263   HG22  ILE 100          HG22      ILE 100  -2.799 -28.689  -9.352
  264   HG23  ILE 100          HG23      ILE 100  -1.574 -29.540  -8.381
  265   HD11  ILE 100          HD11      ILE 100   0.504 -26.359  -8.491
  266   HD12  ILE 100          HD12      ILE 100   0.289 -27.693  -7.328
  267   HD13  ILE 100          HD13      ILE 100   1.907 -27.305  -7.945
  268    HA   PRO 101           HA       PRO 101  -4.451 -30.523 -12.986
  269    HB2  PRO 101           HB2      PRO 101  -5.978 -31.816 -11.076
  270    HB3  PRO 101           HB3      PRO 101  -4.736 -32.624 -12.090
  271    HG2  PRO 101           HG2      PRO 101  -4.437 -31.532  -9.277
  272    HG3  PRO 101           HG3      PRO 101  -3.952 -33.145  -9.887
  273    HD2  PRO 101           HD2      PRO 101  -2.199 -31.143  -9.636
  274    HD3  PRO 101           HD3      PRO 101  -2.115 -32.213 -11.066
  275    H    ALA 102           H        ALA 102  -6.098 -29.073 -13.266
  276    HA   ALA 102           HA       ALA 102  -6.367 -26.848 -11.606
  277    HB1  ALA 102           HB1      ALA 102  -8.224 -26.227 -12.994
  278    HB2  ALA 102           HB2      ALA 102  -6.926 -26.915 -13.991
  279    HB3  ALA 102           HB3      ALA 102  -8.376 -27.892 -13.613
  280    H    ASP 103           H        ASP 103  -8.123 -29.909 -11.367
  281    HA   ASP 103           HA       ASP 103 -10.243 -29.121  -9.770
  282    HB2  ASP 103           HB2      ASP 103 -10.016 -31.321 -10.815
  283    HB3  ASP 103           HB3      ASP 103  -8.663 -31.714  -9.751
  284    H    VAL 104           H        VAL 104  -6.884 -29.970  -8.779
  285    HA   VAL 104           HA       VAL 104  -7.542 -29.610  -5.993
  286    HB   VAL 104           HB       VAL 104  -5.857 -31.284  -6.879
  287   HG11  VAL 104          HG11      VAL 104  -4.409 -29.673  -8.115
  288   HG12  VAL 104          HG12      VAL 104  -3.917 -28.951  -6.570
  289   HG13  VAL 104          HG13      VAL 104  -3.536 -30.651  -6.944
  290   HG21  VAL 104          HG21      VAL 104  -5.059 -29.584  -4.492
  291   HG22  VAL 104          HG22      VAL 104  -6.323 -30.839  -4.487
  292   HG23  VAL 104          HG23      VAL 104  -4.638 -31.280  -4.802
  293    H    ILE 105           H        ILE 105  -6.108 -27.585  -8.507
  294    HA   ILE 105           HA       ILE 105  -5.396 -25.367  -6.800
  295    HB   ILE 105           HB       ILE 105  -6.224 -25.585  -9.722
  296   HG12  ILE 105          HG12      ILE 105  -3.469 -24.800  -8.718
  297   HG13  ILE 105          HG13      ILE 105  -3.919 -26.495  -8.605
  298   HG21  ILE 105          HG21      ILE 105  -6.761 -23.314  -9.080
  299   HG22  ILE 105          HG22      ILE 105  -5.214 -23.133  -8.215
  300   HG23  ILE 105          HG23      ILE 105  -5.249 -23.280  -9.984
  301   HD11  ILE 105          HD11      ILE 105  -2.723 -25.933 -10.713
  302   HD12  ILE 105          HD12      ILE 105  -4.317 -26.669 -10.941
  303   HD13  ILE 105          HD13      ILE 105  -4.095 -24.920 -11.199
  304    H    ASP 106           H        ASP 106  -8.492 -26.133  -8.526
  305    HA   ASP 106           HA       ASP 106  -9.952 -23.985  -7.539
  306    HB2  ASP 106           HB2      ASP 106 -10.662 -25.410  -9.400
  307    HB3  ASP 106           HB3      ASP 106 -10.903 -26.764  -8.289
  308    H    ALA 107           H        ALA 107  -9.655 -27.307  -6.120
  309    HA   ALA 107           HA       ALA 107 -11.161 -26.878  -3.845
  310    HB1  ALA 107           HB1      ALA 107  -9.963 -28.811  -2.927
  311    HB2  ALA 107           HB2      ALA 107 -10.329 -29.068  -4.641
  312    HB3  ALA 107           HB3      ALA 107  -8.681 -28.619  -4.143
  313    H    TYR 108           H        TYR 108  -7.649 -26.218  -4.304
  314    HA   TYR 108           HA       TYR 108  -7.092 -25.204  -1.699
  315    HB2  TYR 108           HB2      TYR 108  -5.327 -25.829  -3.207
  316    HB3  TYR 108           HB3      TYR 108  -5.864 -24.701  -4.432
  317    HD1  TYR 108           HD1      TYR 108  -4.300 -24.948  -1.062
  318    HD2  TYR 108           HD2      TYR 108  -5.178 -22.407  -4.435
  319    HE1  TYR 108           HE1      TYR 108  -2.707 -23.245  -0.190
  320    HE2  TYR 108           HE2      TYR 108  -3.618 -20.686  -3.545
  321    HH   TYR 108           HH       TYR 108  -2.134 -20.128  -1.874
  322    H    HIS 109           H        HIS 109  -8.142 -23.429  -4.680
  323    HA   HIS 109           HA       HIS 109  -8.316 -20.848  -3.423
  324    HB2  HIS 109           HB2      HIS 109  -9.829 -22.010  -5.805
  325    HB3  HIS 109           HB3      HIS 109  -9.901 -20.328  -5.313
  326    HD1  HIS 109           HD1      HIS 109  -8.769 -21.194  -8.163
  327    HD2  HIS 109           HD2      HIS 109  -6.568 -20.177  -4.702
  328    HE1  HIS 109           HE1      HIS 109  -6.474 -20.354  -8.976
  329    HE2  HIS 109           HE2      HIS 109  -5.140 -19.748  -6.857
  330    H    ALA 110           H        ALA 110 -10.902 -23.388  -3.717
  331    HA   ALA 110           HA       ALA 110 -12.846 -21.860  -2.342
  332    HB1  ALA 110           HB1      ALA 110 -13.332 -23.916  -3.624
  333    HB2  ALA 110           HB2      ALA 110 -12.454 -24.889  -2.426
  334    HB3  ALA 110           HB3      ALA 110 -13.950 -24.050  -1.969
  335    H    ALA 111           H        ALA 111 -10.458 -24.228  -0.957
  336    HA   ALA 111           HA       ALA 111 -11.247 -23.976   1.682
  337    HB1  ALA 111           HB1      ALA 111  -8.499 -24.587   0.523
  338    HB2  ALA 111           HB2      ALA 111  -9.036 -24.977   2.169
  339    HB3  ALA 111           HB3      ALA 111  -9.820 -25.754   0.782
  340    H    THR 112           H        THR 112  -8.908 -21.994  -0.130
  341    HA   THR 112           HA       THR 112  -8.079 -20.489   2.256
  342    HB   THR 112           HB       THR 112  -6.640 -19.218   0.667
  343    HG1  THR 112           HG1      THR 112  -7.342 -21.192  -1.211
  344   HG21  THR 112          HG21      THR 112  -5.101 -21.064   0.190
  345   HG22  THR 112          HG22      THR 112  -5.766 -21.193   1.826
  346   HG23  THR 112          HG23      THR 112  -6.374 -22.255   0.538
  347    H    LEU 113           H        LEU 113 -10.228 -19.788  -0.508
  348    HA   LEU 113           HA       LEU 113 -10.442 -16.957   0.309
  349    HB2  LEU 113           HB2      LEU 113 -11.778 -18.464  -1.969
  350    HB3  LEU 113           HB3      LEU 113 -11.776 -16.718  -1.743
  351    HG   LEU 113           HG       LEU 113  -9.306 -18.415  -2.250
  352   HD11  LEU 113          HD11      LEU 113 -10.821 -18.281  -4.200
  353   HD12  LEU 113          HD12      LEU 113 -10.803 -16.511  -4.098
  354   HD13  LEU 113          HD13      LEU 113  -9.310 -17.400  -4.485
  355   HD21  LEU 113          HD21      LEU 113  -8.168 -16.249  -2.679
  356   HD22  LEU 113          HD22      LEU 113  -9.624 -15.383  -2.123
  357   HD23  LEU 113          HD23      LEU 113  -8.695 -16.400  -1.001
  358    H    GLU 114           H        GLU 114 -12.530 -19.820   0.246
  359    HA   GLU 114           HA       GLU 114 -14.843 -18.288   1.222
  360    HB2  GLU 114           HB2      GLU 114 -14.992 -20.218  -0.397
  361    HB3  GLU 114           HB3      GLU 114 -14.685 -21.306   0.962
  362    HG2  GLU 114           HG2      GLU 114 -16.680 -20.435   2.129
  363    HG3  GLU 114           HG3      GLU 114 -16.961 -19.280   0.825
  364    H    HIS 115           H        HIS 115 -13.502 -17.478   3.070
  365    HA   HIS 115           HA       HIS 115 -12.521 -19.025   5.165
  366    HB2  HIS 115           HB2      HIS 115 -12.122 -16.603   4.759
  367    HB3  HIS 115           HB3      HIS 115 -13.754 -16.237   5.302
  368    HD1  HIS 115           HD1      HIS 115 -10.438 -17.668   6.745
  369    HD2  HIS 115           HD2      HIS 115 -14.062 -15.811   7.882
  370    HE1  HIS 115           HE1      HIS 115 -10.219 -17.127   9.253
  371    HE2  HIS 115           HE2      HIS 115 -12.434 -15.998   9.938
  372    H    HIS 116           H        HIS 116 -15.888 -18.337   4.598
  373    HA   HIS 116           HA       HIS 116 -16.771 -19.181   7.272
  374    HB2  HIS 116           HB2      HIS 116 -17.725 -17.314   5.700
  375    HB3  HIS 116           HB3      HIS 116 -18.610 -18.624   4.937
  376    HD1  HIS 116           HD1      HIS 116 -19.860 -20.195   7.247
  377    HD2  HIS 116           HD2      HIS 116 -19.175 -16.029   7.347
  378    HE1  HIS 116           HE1      HIS 116 -21.502 -19.225   8.997
  379    HE2  HIS 116           HE2      HIS 116 -21.066 -16.684   9.051
  380    H    HIS 117           H        HIS 117 -15.684 -21.105   4.774
  381    HA   HIS 117           HA       HIS 117 -17.772 -23.010   4.482
  382    HB2  HIS 117           HB2      HIS 117 -16.209 -24.447   3.451
  383    HB3  HIS 117           HB3      HIS 117 -15.762 -22.817   3.008
  384    HD1  HIS 117           HD1      HIS 117 -13.376 -21.954   3.887
  385    HD2  HIS 117           HD2      HIS 117 -14.490 -25.869   5.005
  386    HE1  HIS 117           HE1      HIS 117 -11.244 -23.078   4.851
  387    HE2  HIS 117           HE2      HIS 117 -11.946 -25.465   5.521
  388    H    HIS 118           H        HIS 118 -18.182 -25.041   5.356
  389    HA   HIS 118           HA       HIS 118 -16.916 -25.880   7.898
  390    HB2  HIS 118           HB2      HIS 118 -18.728 -24.160   8.427
  391    HB3  HIS 118           HB3      HIS 118 -19.908 -25.251   7.718
  392    HD1  HIS 118           HD1      HIS 118 -20.929 -26.995   9.434
  393    HD2  HIS 118           HD2      HIS 118 -17.307 -25.152  10.645
  394    HE1  HIS 118           HE1      HIS 118 -20.512 -27.719  11.870
  395    HE2  HIS 118           HE2      HIS 118 -18.306 -26.593  12.600
  396    H    HIS 119           H        HIS 119 -17.731 -27.994   8.649
  397    HA   HIS 119           HA       HIS 119 -18.167 -29.872   6.433
  398    HB2  HIS 119           HB2      HIS 119 -17.886 -31.602   8.244
  399    HB3  HIS 119           HB3      HIS 119 -16.526 -30.552   7.922
  400    HD1  HIS 119           HD1      HIS 119 -15.495 -29.310   9.972
  401    HD2  HIS 119           HD2      HIS 119 -19.263 -31.088  10.659
  402    HE1  HIS 119           HE1      HIS 119 -15.929 -29.155  12.508
  403    HE2  HIS 119           HE2      HIS 119 -18.221 -30.251  12.914
  404    H    HIS 120           H        HIS 120 -20.230 -28.728   5.976
  405    HA   HIS 120           HA       HIS 120 -22.473 -28.432   5.965
  406    HB2  HIS 120           HB2      HIS 120 -22.591 -31.328   6.876
  407    HB3  HIS 120           HB3      HIS 120 -23.877 -30.427   6.084
  408    HD1  HIS 120           HD1      HIS 120 -21.286 -32.817   5.193
  409    HD2  HIS 120           HD2      HIS 120 -22.985 -29.339   3.502
  410    HE1  HIS 120           HE1      HIS 120 -20.759 -32.905   2.671
  411    HE2  HIS 120           HE2      HIS 120 -21.791 -30.778   1.648
  Start of MODEL    8
    1    H1   SER  66           H1       SER  66   2.610  -1.727 -23.462
    2    H2   SER  66           H2       SER  66   2.809  -2.090 -21.881
    3    H3   SER  66           H3       SER  66   3.694  -0.891 -22.560
    4    HA   SER  66           HA       SER  66   3.863  -3.755 -23.235
    5    HB2  SER  66           HB2      SER  66   5.551  -1.461 -24.308
    6    HB3  SER  66           HB3      SER  66   5.734  -3.183 -24.703
    7    HG   SER  66           HG       SER  66   4.486  -2.096 -26.287
    8    H    GLY  67           H        GLY  67   5.788  -4.856 -22.551
    9    HA2  GLY  67           HA2      GLY  67   7.591  -5.344 -21.186
   10    HA3  GLY  67           HA3      GLY  67   7.805  -3.630 -20.864
   11    H    SER  68           H        SER  68   8.376  -4.420 -18.719
   12    HA   SER  68           HA       SER  68   6.070  -4.437 -16.876
   13    HB2  SER  68           HB2      SER  68   6.649  -6.847 -17.375
   14    HB3  SER  68           HB3      SER  68   8.253  -6.543 -16.684
   15    HG   SER  68           HG       SER  68   5.702  -6.441 -15.400
   16    H    GLY  69           H        GLY  69   6.605  -3.830 -14.729
   17    HA2  GLY  69           HA2      GLY  69   8.676  -1.844 -14.455
   18    HA3  GLY  69           HA3      GLY  69   7.584  -2.404 -13.192
   19    H    ARG  70           H        ARG  70  10.306  -1.753 -12.842
   20    HA   ARG  70           HA       ARG  70  11.754  -4.348 -12.435
   21    HB2  ARG  70           HB2      ARG  70  13.002  -1.600 -12.797
   22    HB3  ARG  70           HB3      ARG  70  13.807  -3.169 -12.859
   23    HG2  ARG  70           HG2      ARG  70  11.869  -2.009 -14.904
   24    HG3  ARG  70           HG3      ARG  70  13.604  -2.199 -15.087
   25    HD2  ARG  70           HD2      ARG  70  13.416  -4.626 -15.147
   26    HD3  ARG  70           HD3      ARG  70  11.716  -4.556 -14.697
   27    HE   ARG  70           HE       ARG  70  11.085  -3.806 -16.803
   28   HH11  ARG  70          HH11      ARG  70  14.576  -4.256 -16.790
   29   HH12  ARG  70          HH12      ARG  70  14.683  -4.128 -18.527
   30   HH21  ARG  70          HH21      ARG  70  11.315  -3.611 -18.989
   31   HH22  ARG  70          HH22      ARG  70  12.876  -3.795 -19.741
   32    H    GLY  71           H        GLY  71  13.540  -4.167 -10.753
   33    HA2  GLY  71           HA2      GLY  71  14.200  -3.887  -8.556
   34    HA3  GLY  71           HA3      GLY  71  13.212  -2.424  -8.478
   35    H    ARG  72           H        ARG  72  12.067  -5.701  -9.193
   36    HA   ARG  72           HA       ARG  72  10.501  -5.836  -6.653
   37    HB2  ARG  72           HB2      ARG  72   8.497  -6.437  -7.883
   38    HB3  ARG  72           HB3      ARG  72   9.067  -4.852  -8.402
   39    HG2  ARG  72           HG2      ARG  72   9.958  -5.761 -10.477
   40    HG3  ARG  72           HG3      ARG  72   9.682  -7.423  -9.939
   41    HD2  ARG  72           HD2      ARG  72   7.217  -6.960  -9.857
   42    HD3  ARG  72           HD3      ARG  72   7.537  -5.351 -10.505
   43    HE   ARG  72           HE       ARG  72   8.017  -6.236 -12.603
   44   HH11  ARG  72          HH21      ARG  72   7.947  -9.018 -10.417
   45   HH12  ARG  72          HH22      ARG  72   7.645 -10.117 -11.735
   46   HH21  ARG  72          HH11      ARG  72   7.507  -7.697 -14.169
   47   HH22  ARG  72          HH12      ARG  72   7.531  -9.406 -13.813
   48    H    GLY  73           H        GLY  73   9.483  -7.938  -6.275
   49    HA2  GLY  73           HA2      GLY  73  11.249 -10.224  -6.793
   50    HA3  GLY  73           HA3      GLY  73   9.762 -10.223  -5.853
   51    H    ALA  74           H        ALA  74  10.320 -12.293  -7.500
   52    HA   ALA  74           HA       ALA  74   7.949 -12.344  -9.203
   53    HB1  ALA  74           HB1      ALA  74   9.707 -11.593 -10.795
   54    HB2  ALA  74           HB2      ALA  74  10.713 -12.981 -10.340
   55    HB3  ALA  74           HB3      ALA  74   9.163 -13.239 -11.169
   56    H    ILE  75           H        ILE  75   7.268 -14.502  -9.733
   57    HA   ILE  75           HA       ILE  75   8.205 -16.523  -7.755
   58    HB   ILE  75           HB       ILE  75   5.614 -16.314  -9.309
   59   HG12  ILE  75          HG12      ILE  75   4.585 -16.334  -7.002
   60   HG13  ILE  75          HG13      ILE  75   6.190 -16.172  -6.303
   61   HG21  ILE  75          HG21      ILE  75   6.514 -18.514  -7.392
   62   HG22  ILE  75          HG22      ILE  75   4.876 -18.330  -8.053
   63   HG23  ILE  75          HG23      ILE  75   6.197 -18.705  -9.135
   64   HD11  ILE  75          HD11      ILE  75   4.956 -14.132  -8.210
   65   HD12  ILE  75          HD12      ILE  75   4.786 -14.069  -6.445
   66   HD13  ILE  75          HD13      ILE  75   6.386 -13.909  -7.166
   67    H    ASP  76           H        ASP  76   9.280 -18.248  -8.371
   68    HA   ASP  76           HA       ASP  76   9.435 -19.029 -11.250
   69    HB2  ASP  76           HB2      ASP  76  11.554 -18.766 -10.076
   70    HB3  ASP  76           HB3      ASP  76  11.070 -19.954  -8.869
   71    H    ARG  77           H        ARG  77   9.098 -20.778  -8.132
   72    HA   ARG  77           HA       ARG  77   6.710 -22.221  -9.195
   73    HB2  ARG  77           HB2      ARG  77   7.640 -24.345  -8.734
   74    HB3  ARG  77           HB3      ARG  77   8.842 -23.411  -9.628
   75    HG2  ARG  77           HG2      ARG  77   9.930 -22.884  -7.335
   76    HG3  ARG  77           HG3      ARG  77   8.853 -24.114  -6.662
   77    HD2  ARG  77           HD2      ARG  77  10.963 -25.153  -7.105
   78    HD3  ARG  77           HD3      ARG  77   9.808 -25.765  -8.307
   79    HE   ARG  77           HE       ARG  77  11.162 -23.434  -9.341
   80   HH11  ARG  77          HH11      ARG  77  11.957 -26.814  -8.752
   81   HH12  ARG  77          HH12      ARG  77  13.174 -26.793  -9.999
   82   HH21  ARG  77          HH21      ARG  77  12.580 -23.459 -10.772
   83   HH22  ARG  77          HH22      ARG  77  13.553 -24.879 -11.171
   84    H    GLU  78           H        GLU  78   7.659 -20.381  -6.642
   85    HA   GLU  78           HA       GLU  78   7.142 -21.852  -4.344
   86    HB2  GLU  78           HB2      GLU  78   8.159 -19.600  -4.476
   87    HB3  GLU  78           HB3      GLU  78   6.567 -18.896  -4.777
   88    HG2  GLU  78           HG2      GLU  78   5.792 -19.655  -2.559
   89    HG3  GLU  78           HG3      GLU  78   7.321 -20.496  -2.286
   90    H    GLN  79           H        GLN  79   4.631 -19.995  -6.174
   91    HA   GLN  79           HA       GLN  79   2.519 -20.699  -4.362
   92    HB2  GLN  79           HB2      GLN  79   1.010 -19.811  -5.953
   93    HB3  GLN  79           HB3      GLN  79   2.461 -18.806  -5.942
   94    HG2  GLN  79           HG2      GLN  79   3.207 -20.001  -8.059
   95    HG3  GLN  79           HG3      GLN  79   1.655 -20.837  -8.074
   96   HE21  GLN  79          HE22      GLN  79   2.033 -19.532 -10.340
   97   HE22  GLN  79          HE21      GLN  79   1.167 -18.008 -10.352
   98    H    SER  80           H        SER  80   3.800 -22.361  -7.193
   99    HA   SER  80           HA       SER  80   1.785 -24.435  -7.362
  100    HB2  SER  80           HB2      SER  80   3.373 -23.771  -9.188
  101    HB3  SER  80           HB3      SER  80   4.694 -24.512  -8.274
  102    HG   SER  80           HG       SER  80   3.762 -25.954  -9.828
  103    H    ALA  81           H        ALA  81   5.076 -24.367  -5.863
  104    HA   ALA  81           HA       ALA  81   4.951 -26.853  -4.610
  105    HB1  ALA  81           HB1      ALA  81   6.391 -24.310  -3.738
  106    HB2  ALA  81           HB2      ALA  81   6.769 -25.960  -3.189
  107    HB3  ALA  81           HB3      ALA  81   6.995 -25.520  -4.892
  108    H    ALA  82           H        ALA  82   3.769 -23.677  -3.363
  109    HA   ALA  82           HA       ALA  82   2.936 -24.614  -0.811
  110    HB1  ALA  82           HB1      ALA  82   1.567 -22.573  -0.772
  111    HB2  ALA  82           HB2      ALA  82   3.185 -22.238  -1.415
  112    HB3  ALA  82           HB3      ALA  82   1.799 -22.357  -2.520
  113    H    ILE  83           H        ILE  83   1.074 -24.488  -3.915
  114    HA   ILE  83           HA       ILE  83  -1.321 -25.642  -2.790
  115    HB   ILE  83           HB       ILE  83  -0.322 -25.399  -5.645
  116   HG12  ILE  83          HG12      ILE  83  -2.507 -23.953  -4.069
  117   HG13  ILE  83          HG13      ILE  83  -0.913 -23.303  -4.363
  118   HG21  ILE  83          HG21      ILE  83  -3.065 -26.361  -4.674
  119   HG22  ILE  83          HG22      ILE  83  -2.632 -26.012  -6.363
  120   HG23  ILE  83          HG23      ILE  83  -1.869 -27.351  -5.537
  121   HD11  ILE  83          HD11      ILE  83  -1.391 -23.412  -6.855
  122   HD12  ILE  83          HD12      ILE  83  -3.082 -23.795  -6.426
  123   HD13  ILE  83          HD13      ILE  83  -2.367 -22.262  -5.917
  124    H    ARG  84           H        ARG  84   1.529 -27.158  -4.373
  125    HA   ARG  84           HA       ARG  84   0.619 -29.875  -4.235
  126    HB2  ARG  84           HB2      ARG  84   2.672 -29.034  -5.469
  127    HB3  ARG  84           HB3      ARG  84   3.455 -28.784  -3.915
  128    HG2  ARG  84           HG2      ARG  84   2.940 -31.384  -3.557
  129    HG3  ARG  84           HG3      ARG  84   2.726 -31.372  -5.306
  130    HD2  ARG  84           HD2      ARG  84   5.009 -31.976  -4.857
  131    HD3  ARG  84           HD3      ARG  84   5.029 -30.318  -5.483
  132    HE   ARG  84           HE       ARG  84   4.950 -30.659  -2.524
  133   HH11  ARG  84          HH11      ARG  84   7.130 -30.116  -5.225
  134   HH12  ARG  84          HH12      ARG  84   8.363 -29.469  -4.182
  135   HH21  ARG  84          HH21      ARG  84   6.491 -29.867  -1.293
  136   HH22  ARG  84          HH22      ARG  84   8.021 -29.340  -1.976
  137    H    GLU  85           H        GLU  85   2.619 -28.068  -1.812
  138    HA   GLU  85           HA       GLU  85   2.591 -30.191  -0.002
  139    HB2  GLU  85           HB2      GLU  85   4.037 -27.943  -0.152
  140    HB3  GLU  85           HB3      GLU  85   2.866 -27.391   1.044
  141    HG2  GLU  85           HG2      GLU  85   4.776 -28.333   2.187
  142    HG3  GLU  85           HG3      GLU  85   3.394 -29.406   2.429
  143    H    TRP  86           H        TRP  86   0.356 -27.374  -0.192
  144    HA   TRP  86           HA       TRP  86  -1.291 -28.002   1.955
  145    HB2  TRP  86           HB2      TRP  86  -1.501 -25.932   0.728
  146    HB3  TRP  86           HB3      TRP  86  -1.903 -26.788  -0.755
  147    HD1  TRP  86           HD1      TRP  86  -3.435 -25.555   2.478
  148    HE1  TRP  86           HE1      TRP  86  -5.983 -25.887   2.444
  149    HE3  TRP  86           HE3      TRP  86  -3.861 -28.180  -1.902
  150    HZ2  TRP  86           HZ2      TRP  86  -7.905 -27.385   0.891
  151    HZ3  TRP  86           HZ3      TRP  86  -6.045 -29.123  -2.600
  152    HH2  TRP  86           HH2      TRP  86  -8.069 -28.769  -1.163
  153    H    ALA  87           H        ALA  87  -1.481 -29.227  -1.436
  154    HA   ALA  87           HA       ALA  87  -3.747 -30.890  -1.011
  155    HB1  ALA  87           HB1      ALA  87  -2.977 -30.166  -3.216
  156    HB2  ALA  87           HB2      ALA  87  -1.471 -31.085  -3.049
  157    HB3  ALA  87           HB3      ALA  87  -3.022 -31.941  -3.165
  158    H    ARG  88           H        ARG  88  -0.261 -31.672  -0.791
  159    HA   ARG  88           HA       ARG  88  -0.430 -34.409  -0.045
  160    HB2  ARG  88           HB2      ARG  88   1.628 -33.083  -0.667
  161    HB3  ARG  88           HB3      ARG  88   1.563 -32.302   0.910
  162    HG2  ARG  88           HG2      ARG  88   1.768 -34.626   1.962
  163    HG3  ARG  88           HG3      ARG  88   2.066 -35.244   0.320
  164    HD2  ARG  88           HD2      ARG  88   3.987 -33.625   0.131
  165    HD3  ARG  88           HD3      ARG  88   3.641 -33.092   1.791
  166    HE   ARG  88           HE       ARG  88   4.105 -35.972   1.524
  167   HH11  ARG  88          HH11      ARG  88   5.710 -32.875   2.127
  168   HH12  ARG  88          HH12      ARG  88   7.103 -33.664   2.827
  169   HH21  ARG  88          HH21      ARG  88   5.910 -36.866   2.466
  170   HH22  ARG  88          HH22      ARG  88   7.202 -35.851   3.031
  171    H    ARG  89           H        ARG  89  -0.505 -31.512   2.066
  172    HA   ARG  89           HA       ARG  89  -0.879 -32.957   4.550
  173    HB2  ARG  89           HB2      ARG  89  -1.338 -30.061   3.728
  174    HB3  ARG  89           HB3      ARG  89  -1.580 -30.645   5.377
  175    HG2  ARG  89           HG2      ARG  89   0.757 -31.317   5.573
  176    HG3  ARG  89           HG3      ARG  89   1.055 -30.981   3.872
  177    HD2  ARG  89           HD2      ARG  89   1.957 -29.172   5.143
  178    HD3  ARG  89           HD3      ARG  89   0.543 -28.578   4.252
  179    HE   ARG  89           HE       ARG  89  -0.207 -29.453   6.905
  180   HH11  ARG  89          HH11      ARG  89   1.446 -26.753   5.388
  181   HH12  ARG  89          HH12      ARG  89   1.031 -25.660   6.680
  182   HH21  ARG  89          HH21      ARG  89  -0.725 -27.993   8.499
  183   HH22  ARG  89          HH22      ARG  89  -0.166 -26.353   8.390
  184    H    ASN  90           H        ASN  90  -3.205 -31.789   2.177
  185    HA   ASN  90           HA       ASN  90  -5.503 -32.532   3.895
  186    HB2  ASN  90           HB2      ASN  90  -5.237 -31.199   1.177
  187    HB3  ASN  90           HB3      ASN  90  -6.785 -31.745   1.803
  188   HD21  ASN  90          HD22      ASN  90  -4.149 -29.467   2.356
  189   HD22  ASN  90          HD21      ASN  90  -5.070 -28.439   3.452
  190    H    GLY  91           H        GLY  91  -3.471 -34.332   1.900
  191    HA2  GLY  91           HA2      GLY  91  -3.595 -36.516   1.206
  192    HA3  GLY  91           HA3      GLY  91  -5.213 -36.649   1.907
  193    H    HIS  92           H        HIS  92  -4.596 -34.120  -0.453
  194    HA   HIS  92           HA       HIS  92  -6.497 -35.404  -2.349
  195    HB2  HIS  92           HB2      HIS  92  -6.772 -33.015  -1.511
  196    HB3  HIS  92           HB3      HIS  92  -5.364 -32.579  -2.470
  197    HD1  HIS  92           HD1      HIS  92  -9.072 -33.331  -2.787
  198    HD2  HIS  92           HD2      HIS  92  -5.674 -32.785  -5.239
  199    HE1  HIS  92           HE1      HIS  92  -9.949 -32.956  -5.183
  200    HE2  HIS  92           HE2      HIS  92  -7.886 -32.635  -6.686
  201    H    ASN  93           H        ASN  93  -5.982 -35.896  -4.486
  202    HA   ASN  93           HA       ASN  93  -3.317 -36.817  -4.952
  203    HB2  ASN  93           HB2      ASN  93  -5.432 -37.830  -5.837
  204    HB3  ASN  93           HB3      ASN  93  -5.615 -36.452  -6.922
  205   HD21  ASN  93          HD22      ASN  93  -5.664 -38.418  -8.465
  206   HD22  ASN  93          HD21      ASN  93  -4.102 -38.918  -9.095
  207    H    VAL  94           H        VAL  94  -1.570 -35.921  -5.933
  208    HA   VAL  94           HA       VAL  94  -1.812 -33.736  -7.849
  209    HB   VAL  94           HB       VAL  94  -1.804 -32.514  -5.707
  210   HG11  VAL  94          HG11      VAL  94  -0.425 -34.022  -4.312
  211   HG12  VAL  94          HG12      VAL  94   1.011 -33.587  -5.257
  212   HG13  VAL  94          HG13      VAL  94   0.174 -32.360  -4.292
  213   HG21  VAL  94          HG21      VAL  94  -0.850 -31.520  -7.774
  214   HG22  VAL  94          HG22      VAL  94  -0.155 -30.872  -6.282
  215   HG23  VAL  94          HG23      VAL  94   0.772 -32.037  -7.248
  216    H    SER  95           H        SER  95  -0.097 -33.651  -9.288
  217    HA   SER  95           HA       SER  95   1.732 -35.977  -9.208
  218    HB2  SER  95           HB2      SER  95   0.389 -35.620 -11.210
  219    HB3  SER  95           HB3      SER  95   1.128 -34.020 -11.443
  220    HG   SER  95           HG       SER  95   2.095 -35.831 -12.647
  221    H    THR  96           H        THR  96   3.930 -35.892  -9.363
  222    HA   THR  96           HA       THR  96   5.351 -33.305  -8.914
  223    HB   THR  96           HB       THR  96   7.288 -34.762  -8.363
  224    HG1  THR  96           HG1      THR  96   6.846 -36.995  -8.088
  225   HG21  THR  96          HG21      THR  96   5.728 -34.002  -6.566
  226   HG22  THR  96          HG22      THR  96   4.793 -35.501  -6.763
  227   HG23  THR  96          HG23      THR  96   6.482 -35.569  -6.211
  228    H    ARG  97           H        ARG  97   4.440 -35.229 -11.512
  229    HA   ARG  97           HA       ARG  97   7.019 -35.094 -12.980
  230    HB2  ARG  97           HB2      ARG  97   4.416 -36.458 -13.762
  231    HB3  ARG  97           HB3      ARG  97   5.990 -36.677 -14.506
  232    HG2  ARG  97           HG2      ARG  97   5.118 -37.566 -11.731
  233    HG3  ARG  97           HG3      ARG  97   5.504 -38.588 -13.107
  234    HD2  ARG  97           HD2      ARG  97   7.469 -36.856 -11.547
  235    HD3  ARG  97           HD3      ARG  97   7.293 -38.614 -11.439
  236    HE   ARG  97           HE       ARG  97   7.787 -38.139 -14.136
  237   HH11  ARG  97          HH11      ARG  97   9.583 -37.558 -11.182
  238   HH12  ARG  97          HH12      ARG  97  11.123 -37.646 -11.993
  239   HH21  ARG  97          HH21      ARG  97   9.788 -38.231 -15.111
  240   HH22  ARG  97          HH22      ARG  97  11.228 -38.038 -14.156
  241    H    GLY  98           H        GLY  98   4.540 -32.974 -12.704
  242    HA2  GLY  98           HA2      GLY  98   5.271 -31.389 -14.992
  243    HA3  GLY  98           HA3      GLY  98   3.739 -32.220 -15.281
  244    H    ARG  99           H        ARG  99   2.919 -29.988 -15.425
  245    HA   ARG  99           HA       ARG  99   2.751 -28.256 -13.098
  246    HB2  ARG  99           HB2      ARG  99   1.125 -28.336 -15.678
  247    HB3  ARG  99           HB3      ARG  99   0.983 -27.083 -14.442
  248    HG2  ARG  99           HG2      ARG  99   3.390 -26.512 -14.733
  249    HG3  ARG  99           HG3      ARG  99   3.512 -27.713 -16.029
  250    HD2  ARG  99           HD2      ARG  99   1.758 -26.475 -17.316
  251    HD3  ARG  99           HD3      ARG  99   1.660 -25.293 -16.013
  252    HE   ARG  99           HE       ARG  99   3.722 -24.371 -16.618
  253   HH11  ARG  99          HH11      ARG  99   3.166 -27.162 -18.674
  254   HH12  ARG  99          HH12      ARG  99   4.437 -26.708 -19.775
  255   HH21  ARG  99          HH21      ARG  99   5.324 -23.861 -18.060
  256   HH22  ARG  99          HH22      ARG  99   5.631 -24.890 -19.424
  257    H    ILE 100           H        ILE 100   0.936 -27.738 -11.836
  258    HA   ILE 100           HA       ILE 100  -0.484 -30.056 -10.859
  259    HB   ILE 100           HB       ILE 100  -0.618 -27.134 -10.089
  260   HG12  ILE 100          HG12      ILE 100   0.695 -29.621  -8.884
  261   HG13  ILE 100          HG13      ILE 100   1.513 -28.250  -9.626
  262   HG21  ILE 100          HG21      ILE 100  -1.950 -29.499  -8.682
  263   HG22  ILE 100          HG22      ILE 100  -1.900 -27.821  -8.102
  264   HG23  ILE 100          HG23      ILE 100  -2.802 -28.196  -9.547
  265   HD11  ILE 100          HD11      ILE 100   0.564 -26.785  -7.787
  266   HD12  ILE 100          HD12      ILE 100   0.043 -28.292  -6.977
  267   HD13  ILE 100          HD13      ILE 100   1.758 -28.003  -7.297
  268    HA   PRO 101           HA       PRO 101  -4.044 -29.474 -13.558
  269    HB2  PRO 101           HB2      PRO 101  -5.735 -31.395 -12.552
  270    HB3  PRO 101           HB3      PRO 101  -4.327 -31.739 -13.600
  271    HG2  PRO 101           HG2      PRO 101  -4.532 -31.958 -10.604
  272    HG3  PRO 101           HG3      PRO 101  -3.743 -33.076 -11.749
  273    HD2  PRO 101           HD2      PRO 101  -2.374 -31.196 -10.274
  274    HD3  PRO 101           HD3      PRO 101  -1.834 -31.750 -11.888
  275    H    ALA 102           H        ALA 102  -6.050 -28.460 -13.549
  276    HA   ALA 102           HA       ALA 102  -6.255 -26.456 -11.671
  277    HB1  ALA 102           HB1      ALA 102  -8.245 -25.764 -12.847
  278    HB2  ALA 102           HB2      ALA 102  -7.003 -26.300 -13.992
  279    HB3  ALA 102           HB3      ALA 102  -8.384 -27.367 -13.620
  280    H    ASP 103           H        ASP 103  -7.959 -29.575 -11.493
  281    HA   ASP 103           HA       ASP 103  -9.942 -28.811  -9.701
  282    HB2  ASP 103           HB2      ASP 103 -10.288 -31.074  -9.210
  283    HB3  ASP 103           HB3      ASP 103  -9.791 -31.014 -10.892
  284    H    VAL 104           H        VAL 104  -6.512 -29.487  -9.048
  285    HA   VAL 104           HA       VAL 104  -6.833 -29.490  -6.191
  286    HB   VAL 104           HB       VAL 104  -4.217 -28.928  -7.511
  287   HG11  VAL 104          HG11      VAL 104  -5.002 -30.463  -5.005
  288   HG12  VAL 104          HG12      VAL 104  -3.337 -30.267  -5.619
  289   HG13  VAL 104          HG13      VAL 104  -4.264 -28.861  -5.075
  290   HG21  VAL 104          HG21      VAL 104  -3.771 -31.372  -7.678
  291   HG22  VAL 104          HG22      VAL 104  -5.484 -31.683  -7.329
  292   HG23  VAL 104          HG23      VAL 104  -5.015 -30.822  -8.800
  293    H    ILE 105           H        ILE 105  -5.965 -27.086  -8.639
  294    HA   ILE 105           HA       ILE 105  -5.268 -24.943  -6.814
  295    HB   ILE 105           HB       ILE 105  -6.161 -25.040  -9.720
  296   HG12  ILE 105          HG12      ILE 105  -3.411 -24.157  -8.800
  297   HG13  ILE 105          HG13      ILE 105  -3.763 -25.870  -8.661
  298   HG21  ILE 105          HG21      ILE 105  -5.305 -22.687  -9.887
  299   HG22  ILE 105          HG22      ILE 105  -6.776 -22.834  -8.924
  300   HG23  ILE 105          HG23      ILE 105  -5.199 -22.629  -8.115
  301   HD11  ILE 105          HD11      ILE 105  -4.066 -24.317 -11.254
  302   HD12  ILE 105          HD12      ILE 105  -2.664 -25.307 -10.790
  303   HD13  ILE 105          HD13      ILE 105  -4.244 -26.076 -10.997
  304    H    ASP 106           H        ASP 106  -8.352 -25.835  -8.466
  305    HA   ASP 106           HA       ASP 106  -9.967 -23.972  -7.151
  306    HB2  ASP 106           HB2      ASP 106 -10.647 -25.274  -9.116
  307    HB3  ASP 106           HB3      ASP 106 -10.631 -26.762  -8.161
  308    H    ALA 107           H        ALA 107  -9.201 -27.382  -6.152
  309    HA   ALA 107           HA       ALA 107 -10.581 -27.463  -3.786
  310    HB1  ALA 107           HB1      ALA 107  -9.453 -29.389  -4.847
  311    HB2  ALA 107           HB2      ALA 107  -7.862 -28.713  -4.413
  312    HB3  ALA 107           HB3      ALA 107  -8.997 -29.246  -3.155
  313    H    TYR 108           H        TYR 108  -7.225 -26.268  -4.250
  314    HA   TYR 108           HA       TYR 108  -6.710 -25.402  -1.590
  315    HB2  TYR 108           HB2      TYR 108  -4.922 -25.622  -3.152
  316    HB3  TYR 108           HB3      TYR 108  -5.688 -24.559  -4.320
  317    HD1  TYR 108           HD2      TYR 108  -4.147 -24.591  -0.906
  318    HD2  TYR 108           HD1      TYR 108  -5.263 -22.227  -4.339
  319    HE1  TYR 108           HE2      TYR 108  -2.867 -22.664   0.010
  320    HE2  TYR 108           HE1      TYR 108  -3.975 -20.304  -3.429
  321    HH   TYR 108           HH       TYR 108  -2.649 -19.520  -1.715
  322    H    HIS 109           H        HIS 109  -8.108 -23.556  -4.399
  323    HA   HIS 109           HA       HIS 109  -8.490 -21.241  -2.757
  324    HB2  HIS 109           HB2      HIS 109  -9.521 -21.948  -5.501
  325    HB3  HIS 109           HB3      HIS 109 -10.044 -20.489  -4.640
  326    HD1  HIS 109           HD1      HIS 109  -7.656 -19.160  -3.468
  327    HD2  HIS 109           HD2      HIS 109  -7.508 -21.352  -7.076
  328    HE1  HIS 109           HE1      HIS 109  -5.605 -18.277  -4.777
  329    HE2  HIS 109           HE2      HIS 109  -5.519 -19.625  -6.973
  330    H    ALA 110           H        ALA 110 -10.647 -24.024  -3.119
  331    HA   ALA 110           HA       ALA 110 -12.905 -22.832  -1.982
  332    HB1  ALA 110           HB1      ALA 110 -13.514 -25.075  -1.238
  333    HB2  ALA 110           HB2      ALA 110 -12.815 -25.156  -2.865
  334    HB3  ALA 110           HB3      ALA 110 -11.851 -25.642  -1.453
  335    H    ALA 111           H        ALA 111  -9.971 -24.148  -0.313
  336    HA   ALA 111           HA       ALA 111 -10.781 -23.457   2.278
  337    HB1  ALA 111           HB1      ALA 111  -8.455 -23.861   2.888
  338    HB2  ALA 111           HB2      ALA 111  -8.992 -25.089   1.723
  339    HB3  ALA 111           HB3      ALA 111  -7.952 -23.748   1.193
  340    H    THR 112           H        THR 112  -8.849 -21.555  -0.123
  341    HA   THR 112           HA       THR 112  -8.390 -19.361   1.705
  342    HB   THR 112           HB       THR 112  -7.638 -18.031  -0.130
  343    HG1  THR 112           HG1      THR 112  -9.097 -18.451  -1.748
  344   HG21  THR 112          HG21      THR 112  -5.892 -19.413  -1.071
  345   HG22  THR 112          HG22      THR 112  -6.125 -19.856   0.632
  346   HG23  THR 112          HG23      THR 112  -6.766 -20.896  -0.659
  347    H    LEU 113           H        LEU 113 -11.035 -19.938  -0.639
  348    HA   LEU 113           HA       LEU 113 -12.293 -17.381  -0.244
  349    HB2  LEU 113           HB2      LEU 113 -12.544 -18.677  -2.293
  350    HB3  LEU 113           HB3      LEU 113 -13.186 -20.053  -1.395
  351    HG   LEU 113           HG       LEU 113 -15.189 -18.807  -0.813
  352   HD11  LEU 113          HD11      LEU 113 -14.372 -16.484  -0.790
  353   HD12  LEU 113          HD12      LEU 113 -14.041 -16.566  -2.536
  354   HD13  LEU 113          HD13      LEU 113 -15.710 -16.637  -1.928
  355   HD21  LEU 113          HD21      LEU 113 -15.126 -20.141  -2.881
  356   HD22  LEU 113          HD22      LEU 113 -16.188 -18.733  -3.059
  357   HD23  LEU 113          HD23      LEU 113 -14.566 -18.718  -3.791
  358    H    GLU 114           H        GLU 114 -12.905 -20.633   1.119
  359    HA   GLU 114           HA       GLU 114 -15.182 -19.773   2.642
  360    HB2  GLU 114           HB2      GLU 114 -13.397 -22.187   2.974
  361    HB3  GLU 114           HB3      GLU 114 -14.812 -21.883   3.986
  362    HG2  GLU 114           HG2      GLU 114 -15.001 -22.017   0.955
  363    HG3  GLU 114           HG3      GLU 114 -15.199 -23.415   2.005
  364    H    HIS 115           H        HIS 115 -11.846 -19.166   3.381
  365    HA   HIS 115           HA       HIS 115 -12.280 -18.591   6.215
  366    HB2  HIS 115           HB2      HIS 115 -10.130 -17.855   4.204
  367    HB3  HIS 115           HB3      HIS 115 -10.204 -17.042   5.756
  368    HD1  HIS 115           HD1      HIS 115  -9.751 -20.661   4.430
  369    HD2  HIS 115           HD2      HIS 115  -9.347 -18.267   7.894
  370    HE1  HIS 115           HE1      HIS 115  -8.548 -22.114   6.197
  371    HE2  HIS 115           HE2      HIS 115  -8.299 -20.641   8.296
  372    H    HIS 116           H        HIS 116 -13.119 -16.878   3.301
  373    HA   HIS 116           HA       HIS 116 -14.075 -14.507   4.881
  374    HB2  HIS 116           HB2      HIS 116 -13.672 -14.795   1.871
  375    HB3  HIS 116           HB3      HIS 116 -14.125 -13.329   2.732
  376    HD1  HIS 116           HD1      HIS 116 -12.135 -12.400   4.532
  377    HD2  HIS 116           HD2      HIS 116 -11.102 -15.259   1.591
  378    HE1  HIS 116           HE1      HIS 116  -9.564 -12.377   4.359
  379    HE2  HIS 116           HE2      HIS 116  -8.946 -14.113   2.554
  380    H    HIS 117           H        HIS 117 -15.238 -17.032   2.672
  381    HA   HIS 117           HA       HIS 117 -17.290 -17.761   2.083
  382    HB2  HIS 117           HB2      HIS 117 -18.602 -18.570   3.939
  383    HB3  HIS 117           HB3      HIS 117 -16.889 -18.797   4.213
  384    HD1  HIS 117           HD1      HIS 117 -19.751 -16.467   5.387
  385    HD2  HIS 117           HD2      HIS 117 -15.937 -17.889   6.501
  386    HE1  HIS 117           HE1      HIS 117 -19.349 -15.675   7.822
  387    HE2  HIS 117           HE2      HIS 117 -17.006 -16.533   8.473
  388    H    HIS 118           H        HIS 118 -17.270 -15.188   1.259
  389    HA   HIS 118           HA       HIS 118 -20.174 -14.506   1.345
  390    HB2  HIS 118           HB2      HIS 118 -17.858 -12.572   1.753
  391    HB3  HIS 118           HB3      HIS 118 -19.425 -12.038   1.170
  392    HD1  HIS 118           HD1      HIS 118 -17.820 -13.402   4.388
  393    HD2  HIS 118           HD2      HIS 118 -21.466 -11.898   2.863
  394    HE1  HIS 118           HE1      HIS 118 -19.303 -12.862   6.433
  395    HE2  HIS 118           HE2      HIS 118 -21.538 -11.982   5.486
  396    H    HIS 119           H        HIS 119 -21.021 -13.634  -0.550
  397    HA   HIS 119           HA       HIS 119 -19.797 -14.568  -2.999
  398    HB2  HIS 119           HB2      HIS 119 -22.235 -14.624  -2.555
  399    HB3  HIS 119           HB3      HIS 119 -22.286 -12.863  -2.542
  400    HD1  HIS 119           HD1      HIS 119 -21.748 -15.790  -5.016
  401    HD2  HIS 119           HD2      HIS 119 -22.415 -11.615  -4.885
  402    HE1  HIS 119           HE1      HIS 119 -22.175 -15.040  -7.445
  403    HE2  HIS 119           HE2      HIS 119 -22.587 -12.500  -7.352
  404    H    HIS 120           H        HIS 120 -19.101 -13.430  -4.798
  405    HA   HIS 120           HA       HIS 120 -18.615 -10.508  -4.662
  406    HB2  HIS 120           HB2      HIS 120 -16.459 -12.607  -5.169
  407    HB3  HIS 120           HB3      HIS 120 -16.289 -10.893  -5.521
  408    HD1  HIS 120           HD1      HIS 120 -16.152 -13.295  -2.569
  409    HD2  HIS 120           HD2      HIS 120 -16.193  -9.157  -3.419
  410    HE1  HIS 120           HE1      HIS 120 -15.392 -12.102  -0.417
  411    HE2  HIS 120           HE2      HIS 120 -15.413  -9.576  -0.941
  Start of MODEL    9
    1    H1   SER  66           H1       SER  66  15.429  -5.454 -24.733
    2    H2   SER  66           H2       SER  66  15.307  -6.529 -25.966
    3    H3   SER  66           H3       SER  66  15.352  -4.922 -26.280
    4    HA   SER  66           HA       SER  66  13.256  -4.570 -25.147
    5    HB2  SER  66           HB2      SER  66  13.083  -6.648 -27.371
    6    HB3  SER  66           HB3      SER  66  11.802  -5.535 -26.858
    7    HG   SER  66           HG       SER  66  12.949  -4.714 -28.664
    8    H    GLY  67           H        GLY  67  11.323  -5.468 -24.201
    9    HA2  GLY  67           HA2      GLY  67  10.907  -8.228 -23.616
   10    HA3  GLY  67           HA3      GLY  67  11.709  -7.472 -22.237
   11    H    SER  68           H        SER  68   9.403  -8.450 -21.576
   12    HA   SER  68           HA       SER  68   7.146  -6.657 -22.051
   13    HB2  SER  68           HB2      SER  68   5.880  -8.342 -20.773
   14    HB3  SER  68           HB3      SER  68   6.823  -9.044 -22.103
   15    HG   SER  68           HG       SER  68   7.127 -10.293 -20.247
   16    H    GLY  69           H        GLY  69   9.646  -6.378 -19.857
   17    HA2  GLY  69           HA2      GLY  69   9.959  -5.060 -17.982
   18    HA3  GLY  69           HA3      GLY  69   8.500  -4.207 -18.477
   19    H    ARG  70           H        ARG  70   6.901  -4.209 -17.016
   20    HA   ARG  70           HA       ARG  70   6.867  -5.661 -14.567
   21    HB2  ARG  70           HB2      ARG  70   5.751  -3.466 -15.062
   22    HB3  ARG  70           HB3      ARG  70   4.587  -4.304 -16.077
   23    HG2  ARG  70           HG2      ARG  70   3.627  -3.739 -13.911
   24    HG3  ARG  70           HG3      ARG  70   3.660  -5.478 -14.137
   25    HD2  ARG  70           HD2      ARG  70   4.295  -4.935 -11.842
   26    HD3  ARG  70           HD3      ARG  70   5.653  -5.654 -12.676
   27    HE   ARG  70           HE       ARG  70   6.847  -3.666 -12.534
   28   HH11  ARG  70          HH11      ARG  70   3.566  -2.962 -11.504
   29   HH12  ARG  70          HH12      ARG  70   3.998  -1.380 -10.908
   30   HH21  ARG  70          HH21      ARG  70   7.322  -1.641 -11.754
   31   HH22  ARG  70          HH22      ARG  70   6.071  -0.666 -11.039
   32    H    GLY  71           H        GLY  71   5.768  -6.651 -17.720
   33    HA2  GLY  71           HA2      GLY  71   3.987  -8.782 -16.925
   34    HA3  GLY  71           HA3      GLY  71   4.750  -8.556 -18.498
   35    H    ARG  72           H        ARG  72   7.450  -8.616 -16.710
   36    HA   ARG  72           HA       ARG  72   8.034 -11.427 -17.196
   37    HB2  ARG  72           HB2      ARG  72   9.596  -9.260 -15.724
   38    HB3  ARG  72           HB3      ARG  72  10.206 -10.876 -16.078
   39    HG2  ARG  72           HG2      ARG  72   9.988 -10.455 -18.518
   40    HG3  ARG  72           HG3      ARG  72   9.334  -8.849 -18.188
   41    HD2  ARG  72           HD2      ARG  72  11.642  -8.584 -18.745
   42    HD3  ARG  72           HD3      ARG  72  11.441  -8.238 -17.019
   43    HE   ARG  72           HE       ARG  72  12.179 -11.018 -17.590
   44   HH11  ARG  72          HH11      ARG  72  13.593  -7.844 -17.106
   45   HH12  ARG  72          HH12      ARG  72  15.129  -8.504 -16.616
   46   HH21  ARG  72          HH21      ARG  72  14.156 -11.793 -16.934
   47   HH22  ARG  72          HH22      ARG  72  15.434 -10.683 -16.533
   48    H    GLY  73           H        GLY  73   8.554 -13.044 -15.705
   49    HA2  GLY  73           HA2      GLY  73   6.916 -13.222 -13.335
   50    HA3  GLY  73           HA3      GLY  73   8.136 -14.378 -13.848
   51    H    ALA  74           H        ALA  74   7.430 -13.075 -11.190
   52    HA   ALA  74           HA       ALA  74  10.180 -12.341 -10.348
   53    HB1  ALA  74           HB1      ALA  74   9.327 -10.350  -9.181
   54    HB2  ALA  74           HB2      ALA  74   8.948 -10.257 -10.910
   55    HB3  ALA  74           HB3      ALA  74   7.676 -10.703  -9.750
   56    H    ILE  75           H        ILE  75   8.795 -14.803  -9.969
   57    HA   ILE  75           HA       ILE  75   8.975 -15.010  -7.045
   58    HB   ILE  75           HB       ILE  75   6.585 -14.520  -7.583
   59   HG12  ILE  75          HG12      ILE  75   7.061 -17.249  -6.341
   60   HG13  ILE  75          HG13      ILE  75   7.335 -15.700  -5.541
   61   HG21  ILE  75          HG21      ILE  75   6.444 -17.310  -8.807
   62   HG22  ILE  75          HG22      ILE  75   5.143 -16.113  -8.658
   63   HG23  ILE  75          HG23      ILE  75   6.480 -15.805  -9.757
   64   HD11  ILE  75          HD11      ILE  75   4.902 -15.142  -5.855
   65   HD12  ILE  75          HD12      ILE  75   4.651 -16.784  -6.498
   66   HD13  ILE  75          HD13      ILE  75   5.191 -16.557  -4.827
   67    H    ASP  76           H        ASP  76   9.634 -17.029  -6.305
   68    HA   ASP  76           HA       ASP  76  10.868 -18.769  -8.306
   69    HB2  ASP  76           HB2      ASP  76  12.041 -17.935  -6.278
   70    HB3  ASP  76           HB3      ASP  76  10.953 -18.898  -5.276
   71    H    ARG  77           H        ARG  77   8.233 -18.939  -8.667
   72    HA   ARG  77           HA       ARG  77   6.287 -20.134  -8.639
   73    HB2  ARG  77           HB2      ARG  77   7.785 -21.273 -10.175
   74    HB3  ARG  77           HB3      ARG  77   8.321 -22.379  -8.912
   75    HG2  ARG  77           HG2      ARG  77   6.340 -23.571  -8.908
   76    HG3  ARG  77           HG3      ARG  77   5.366 -22.212  -9.494
   77    HD2  ARG  77           HD2      ARG  77   7.374 -23.754 -11.185
   78    HD3  ARG  77           HD3      ARG  77   5.664 -24.149 -11.103
   79    HE   ARG  77           HE       ARG  77   6.893 -21.992 -12.599
   80   HH11  ARG  77          HH11      ARG  77   3.828 -22.808 -11.038
   81   HH12  ARG  77          HH12      ARG  77   2.926 -21.814 -12.151
   82   HH21  ARG  77          HH21      ARG  77   5.660 -20.726 -13.929
   83   HH22  ARG  77          HH22      ARG  77   3.938 -20.651 -13.721
   84    H    GLU  78           H        GLU  78   6.988 -19.448  -6.023
   85    HA   GLU  78           HA       GLU  78   6.685 -21.519  -4.134
   86    HB2  GLU  78           HB2      GLU  78   7.503 -19.204  -3.723
   87    HB3  GLU  78           HB3      GLU  78   5.846 -18.608  -3.856
   88    HG2  GLU  78           HG2      GLU  78   5.180 -19.936  -1.897
   89    HG3  GLU  78           HG3      GLU  78   6.788 -20.667  -1.818
   90    H    GLN  79           H        GLN  79   4.133 -19.820  -5.948
   91    HA   GLN  79           HA       GLN  79   1.925 -20.667  -4.322
   92    HB2  GLN  79           HB2      GLN  79   2.075 -19.914  -7.269
   93    HB3  GLN  79           HB3      GLN  79   0.571 -20.218  -6.388
   94    HG2  GLN  79           HG2      GLN  79   1.103 -18.400  -4.793
   95    HG3  GLN  79           HG3      GLN  79   2.597 -18.052  -5.661
   96   HE21  GLN  79          HE22      GLN  79   1.114 -15.884  -5.453
   97   HE22  GLN  79          HE21      GLN  79   0.218 -15.557  -6.929
   98    H    SER  80           H        SER  80   3.403 -22.264  -7.227
   99    HA   SER  80           HA       SER  80   1.610 -24.504  -7.215
  100    HB2  SER  80           HB2      SER  80   4.508 -24.493  -8.127
  101    HB3  SER  80           HB3      SER  80   3.228 -25.581  -8.670
  102    HG   SER  80           HG       SER  80   2.140 -23.685  -9.526
  103    H    ALA  81           H        ALA  81   4.766 -23.994  -5.559
  104    HA   ALA  81           HA       ALA  81   4.915 -26.527  -4.350
  105    HB1  ALA  81           HB1      ALA  81   6.542 -25.464  -2.851
  106    HB2  ALA  81           HB2      ALA  81   6.807 -24.951  -4.527
  107    HB3  ALA  81           HB3      ALA  81   6.006 -23.856  -3.378
  108    H    ALA  82           H        ALA  82   3.373 -23.492  -3.154
  109    HA   ALA  82           HA       ALA  82   2.481 -24.528  -0.658
  110    HB1  ALA  82           HB1      ALA  82   0.984 -22.588  -0.661
  111    HB2  ALA  82           HB2      ALA  82   2.601 -22.132  -1.230
  112    HB3  ALA  82           HB3      ALA  82   1.269 -22.337  -2.397
  113    H    ILE  83           H        ILE  83   0.821 -24.527  -3.866
  114    HA   ILE  83           HA       ILE  83  -1.571 -25.825  -2.943
  115    HB   ILE  83           HB       ILE  83  -0.278 -25.785  -5.697
  116   HG12  ILE  83          HG12      ILE  83  -2.754 -24.279  -4.823
  117   HG13  ILE  83          HG13      ILE  83  -1.173 -23.583  -4.531
  118   HG21  ILE  83          HG21      ILE  83  -1.799 -27.702  -5.633
  119   HG22  ILE  83          HG22      ILE  83  -3.042 -26.750  -4.795
  120   HG23  ILE  83          HG23      ILE  83  -2.642 -26.406  -6.479
  121   HD11  ILE  83          HD11      ILE  83  -2.090 -22.697  -6.591
  122   HD12  ILE  83          HD12      ILE  83  -0.677 -23.695  -6.974
  123   HD13  ILE  83          HD13      ILE  83  -2.315 -24.322  -7.252
  124    H    ARG  84           H        ARG  84   1.474 -27.217  -4.284
  125    HA   ARG  84           HA       ARG  84   0.693 -29.985  -4.041
  126    HB2  ARG  84           HB2      ARG  84   3.400 -28.582  -4.052
  127    HB3  ARG  84           HB3      ARG  84   3.254 -30.337  -3.948
  128    HG2  ARG  84           HG2      ARG  84   2.233 -30.520  -6.094
  129    HG3  ARG  84           HG3      ARG  84   1.960 -28.774  -6.208
  130    HD2  ARG  84           HD2      ARG  84   4.366 -28.361  -6.293
  131    HD3  ARG  84           HD3      ARG  84   4.701 -30.097  -6.115
  132    HE   ARG  84           HE       ARG  84   3.244 -30.254  -8.314
  133   HH11  ARG  84          HH21      ARG  84   5.862 -28.008  -7.665
  134   HH12  ARG  84          HH22      ARG  84   6.227 -27.811  -9.352
  135   HH21  ARG  84          HH11      ARG  84   3.781 -29.951 -10.479
  136   HH22  ARG  84          HH12      ARG  84   5.061 -28.860 -10.882
  137    H    GLU  85           H        GLU  85   2.523 -27.946  -1.685
  138    HA   GLU  85           HA       GLU  85   2.656 -29.913   0.282
  139    HB2  GLU  85           HB2      GLU  85   3.931 -27.739   0.192
  140    HB3  GLU  85           HB3      GLU  85   2.486 -26.930   0.827
  141    HG2  GLU  85           HG2      GLU  85   2.552 -28.551   2.782
  142    HG3  GLU  85           HG3      GLU  85   4.072 -29.183   2.152
  143    H    TRP  86           H        TRP  86   0.099 -27.351  -0.092
  144    HA   TRP  86           HA       TRP  86  -1.499 -28.107   2.039
  145    HB2  TRP  86           HB2      TRP  86  -1.863 -26.058   0.824
  146    HB3  TRP  86           HB3      TRP  86  -2.210 -26.936  -0.661
  147    HD1  TRP  86           HD1      TRP  86  -3.772 -26.014   2.698
  148    HE1  TRP  86           HE1      TRP  86  -6.293 -26.496   2.657
  149    HE3  TRP  86           HE3      TRP  86  -4.105 -28.269  -1.898
  150    HZ2  TRP  86           HZ2      TRP  86  -8.162 -27.901   0.965
  151    HZ3  TRP  86           HZ3      TRP  86  -6.277 -29.175  -2.690
  152    HH2  TRP  86           HH2      TRP  86  -8.302 -29.025  -1.244
  153    H    ALA  87           H        ALA  87  -1.599 -29.363  -1.334
  154    HA   ALA  87           HA       ALA  87  -3.728 -31.211  -0.937
  155    HB1  ALA  87           HB1      ALA  87  -2.953 -30.507  -3.148
  156    HB2  ALA  87           HB2      ALA  87  -1.367 -31.242  -2.867
  157    HB3  ALA  87           HB3      ALA  87  -2.810 -32.275  -3.001
  158    H    ARG  88           H        ARG  88  -0.172 -31.673  -0.547
  159    HA   ARG  88           HA       ARG  88  -0.275 -34.407   0.275
  160    HB2  ARG  88           HB2      ARG  88   1.736 -33.096  -0.499
  161    HB3  ARG  88           HB3      ARG  88   1.774 -32.288   1.071
  162    HG2  ARG  88           HG2      ARG  88   2.075 -34.537   2.174
  163    HG3  ARG  88           HG3      ARG  88   2.030 -35.291   0.575
  164    HD2  ARG  88           HD2      ARG  88   4.327 -35.098   1.183
  165    HD3  ARG  88           HD3      ARG  88   4.017 -33.896  -0.076
  166    HE   ARG  88           HE       ARG  88   3.748 -32.893   2.682
  167   HH11  ARG  88          HH21      ARG  88   6.109 -33.424   0.144
  168   HH12  ARG  88          HH22      ARG  88   7.228 -32.270   0.818
  169   HH21  ARG  88          HH11      ARG  88   5.239 -31.451   3.504
  170   HH22  ARG  88          HH12      ARG  88   6.740 -31.190   2.667
  171    H    ARG  89           H        ARG  89  -0.341 -31.439   2.279
  172    HA   ARG  89           HA       ARG  89  -0.570 -32.688   4.858
  173    HB2  ARG  89           HB2      ARG  89  -1.532 -30.001   3.787
  174    HB3  ARG  89           HB3      ARG  89  -1.707 -30.475   5.475
  175    HG2  ARG  89           HG2      ARG  89   0.705 -30.692   5.756
  176    HG3  ARG  89           HG3      ARG  89   0.985 -30.325   4.049
  177    HD2  ARG  89           HD2      ARG  89  -0.067 -28.102   4.344
  178    HD3  ARG  89           HD3      ARG  89  -0.351 -28.439   6.053
  179    HE   ARG  89           HE       ARG  89   2.167 -27.647   4.757
  180   HH11  ARG  89          HH11      ARG  89   0.941 -29.082   7.738
  181   HH12  ARG  89          HH12      ARG  89   2.384 -28.629   8.603
  182   HH21  ARG  89          HH21      ARG  89   3.830 -27.133   5.827
  183   HH22  ARG  89          HH22      ARG  89   4.034 -27.514   7.540
  184    H    ASN  90           H        ASN  90  -3.049 -32.057   2.430
  185    HA   ASN  90           HA       ASN  90  -5.193 -33.078   4.211
  186    HB2  ASN  90           HB2      ASN  90  -5.198 -31.762   1.468
  187    HB3  ASN  90           HB3      ASN  90  -6.633 -32.466   2.208
  188   HD21  ASN  90          HD22      ASN  90  -4.277 -29.839   2.533
  189   HD22  ASN  90          HD21      ASN  90  -5.264 -28.924   3.666
  190    H    GLY  91           H        GLY  91  -2.914 -34.676   2.442
  191    HA2  GLY  91           HA2      GLY  91  -2.742 -36.849   1.765
  192    HA3  GLY  91           HA3      GLY  91  -4.347 -37.161   2.426
  193    H    HIS  92           H        HIS  92  -4.042 -34.688  -0.036
  194    HA   HIS  92           HA       HIS  92  -5.724 -36.282  -1.899
  195    HB2  HIS  92           HB2      HIS  92  -4.837 -33.368  -2.015
  196    HB3  HIS  92           HB3      HIS  92  -6.002 -34.133  -3.082
  197    HD1  HIS  92           HD1      HIS  92  -7.445 -35.592  -0.293
  198    HD2  HIS  92           HD2      HIS  92  -6.816 -31.568  -1.437
  199    HE1  HIS  92           HE1      HIS  92  -9.238 -34.199   0.916
  200    HE2  HIS  92           HE2      HIS  92  -8.855 -31.751   0.215
  201    H    ASN  93           H        ASN  93  -5.201 -36.721  -4.039
  202    HA   ASN  93           HA       ASN  93  -2.399 -37.139  -4.670
  203    HB2  ASN  93           HB2      ASN  93  -4.286 -38.617  -5.400
  204    HB3  ASN  93           HB3      ASN  93  -4.877 -37.319  -6.441
  205   HD21  ASN  93          HD22      ASN  93  -4.621 -39.162  -8.056
  206   HD22  ASN  93          HD21      ASN  93  -3.036 -39.319  -8.808
  207    H    VAL  94           H        VAL  94  -1.031 -35.935  -5.960
  208    HA   VAL  94           HA       VAL  94  -1.964 -33.668  -7.548
  209    HB   VAL  94           HB       VAL  94  -1.843 -32.755  -5.228
  210   HG11  VAL  94          HG11      VAL  94   0.286 -32.303  -4.148
  211   HG12  VAL  94          HG12      VAL  94   0.113 -34.040  -4.380
  212   HG13  VAL  94          HG13      VAL  94   1.179 -33.100  -5.453
  213   HG21  VAL  94          HG21      VAL  94   0.177 -31.481  -7.109
  214   HG22  VAL  94          HG22      VAL  94  -1.596 -31.320  -7.223
  215   HG23  VAL  94          HG23      VAL  94  -0.741 -30.699  -5.807
  216    H    SER  95           H        SER  95  -0.575 -33.055  -9.126
  217    HA   SER  95           HA       SER  95   1.559 -34.808  -9.906
  218    HB2  SER  95           HB2      SER  95   0.780 -32.042 -10.878
  219    HB3  SER  95           HB3      SER  95   1.853 -33.178 -11.731
  220    HG   SER  95           HG       SER  95  -0.323 -33.275 -12.499
  221    H    THR  96           H        THR  96   3.492 -34.886  -8.861
  222    HA   THR  96           HA       THR  96   4.582 -32.644  -7.356
  223    HB   THR  96           HB       THR  96   6.506 -34.277  -7.012
  224    HG1  THR  96           HG1      THR  96   6.069 -36.415  -7.674
  225   HG21  THR  96          HG21      THR  96   3.706 -35.305  -6.351
  226   HG22  THR  96          HG22      THR  96   5.217 -35.757  -5.533
  227   HG23  THR  96          HG23      THR  96   4.608 -34.097  -5.409
  228    H    ARG  97           H        ARG  97   5.660 -34.405 -10.266
  229    HA   ARG  97           HA       ARG  97   7.595 -32.221 -10.895
  230    HB2  ARG  97           HB2      ARG  97   8.466 -34.491 -10.712
  231    HB3  ARG  97           HB3      ARG  97   7.309 -35.082 -11.899
  232    HG2  ARG  97           HG2      ARG  97   9.550 -34.862 -12.849
  233    HG3  ARG  97           HG3      ARG  97   8.398 -33.824 -13.678
  234    HD2  ARG  97           HD2      ARG  97   9.279 -31.882 -12.231
  235    HD3  ARG  97           HD3      ARG  97  10.497 -32.998 -11.634
  236    HE   ARG  97           HE       ARG  97  11.633 -32.862 -13.654
  237   HH11  ARG  97          HH21      ARG  97   8.471 -31.355 -14.177
  238   HH12  ARG  97          HH22      ARG  97   8.984 -30.664 -15.695
  239   HH21  ARG  97          HH11      ARG  97  12.170 -31.953 -15.595
  240   HH22  ARG  97          HH12      ARG  97  11.004 -31.004 -16.477
  241    H    GLY  98           H        GLY  98   4.643 -33.607 -12.157
  242    HA2  GLY  98           HA2      GLY  98   4.753 -32.078 -14.689
  243    HA3  GLY  98           HA3      GLY  98   3.490 -33.188 -14.182
  244    H    ARG  99           H        ARG  99   2.623 -30.973 -15.296
  245    HA   ARG  99           HA       ARG  99   2.194 -28.674 -13.646
  246    HB2  ARG  99           HB2      ARG  99   2.006 -28.779 -16.124
  247    HB3  ARG  99           HB3      ARG  99   0.526 -29.732 -15.973
  248    HG2  ARG  99           HG2      ARG  99  -0.588 -27.841 -14.812
  249    HG3  ARG  99           HG3      ARG  99   0.905 -26.886 -14.912
  250    HD2  ARG  99           HD2      ARG  99  -0.663 -27.965 -17.291
  251    HD3  ARG  99           HD3      ARG  99  -0.811 -26.323 -16.644
  252    HE   ARG  99           HE       ARG  99   1.911 -26.620 -17.153
  253   HH11  ARG  99          HH11      ARG  99  -0.979 -26.684 -19.141
  254   HH12  ARG  99          HH12      ARG  99  -0.122 -26.175 -20.569
  255   HH21  ARG  99          HH21      ARG  99   2.944 -25.973 -19.017
  256   HH22  ARG  99          HH22      ARG  99   2.037 -25.766 -20.485
  257    H    ILE 100           H        ILE 100   0.540 -28.072 -12.296
  258    HA   ILE 100           HA       ILE 100  -0.751 -30.185 -10.811
  259    HB   ILE 100           HB       ILE 100  -0.994 -27.183 -10.567
  260   HG12  ILE 100          HG12      ILE 100   0.673 -29.292  -9.099
  261   HG13  ILE 100          HG13      ILE 100   1.288 -28.041 -10.181
  262   HG21  ILE 100          HG21      ILE 100  -1.977 -27.590  -8.363
  263   HG22  ILE 100          HG22      ILE 100  -2.986 -28.349  -9.573
  264   HG23  ILE 100          HG23      ILE 100  -1.884 -29.348  -8.596
  265   HD11  ILE 100          HD11      ILE 100   1.741 -27.297  -8.004
  266   HD12  ILE 100          HD12      ILE 100   0.376 -26.310  -8.566
  267   HD13  ILE 100          HD13      ILE 100   0.101 -27.657  -7.433
  268    HA   PRO 101           HA       PRO 101  -4.561 -30.227 -13.222
  269    HB2  PRO 101           HB2      PRO 101  -5.912 -31.419 -10.848
  270    HB3  PRO 101           HB3      PRO 101  -5.757 -32.070 -12.501
  271    HG2  PRO 101           HG2      PRO 101  -4.321 -33.092 -10.408
  272    HG3  PRO 101           HG3      PRO 101  -3.614 -32.953 -12.056
  273    HD2  PRO 101           HD2      PRO 101  -3.249 -31.086  -9.697
  274    HD3  PRO 101           HD3      PRO 101  -2.034 -31.763 -10.822
  275    H    ALA 102           H        ALA 102  -6.269 -28.808 -13.499
  276    HA   ALA 102           HA       ALA 102  -6.539 -26.563 -11.877
  277    HB1  ALA 102           HB1      ALA 102  -8.560 -27.702 -13.823
  278    HB2  ALA 102           HB2      ALA 102  -8.451 -26.018 -13.237
  279    HB3  ALA 102           HB3      ALA 102  -7.151 -26.691 -14.248
  280    H    ASP 103           H        ASP 103  -8.326 -29.626 -11.679
  281    HA   ASP 103           HA       ASP 103 -10.318 -28.903  -9.899
  282    HB2  ASP 103           HB2      ASP 103 -10.160 -31.066 -11.049
  283    HB3  ASP 103           HB3      ASP 103  -8.747 -31.492 -10.073
  284    H    VAL 104           H        VAL 104  -6.885 -29.658  -9.219
  285    HA   VAL 104           HA       VAL 104  -7.234 -29.543  -6.352
  286    HB   VAL 104           HB       VAL 104  -4.627 -29.548  -7.837
  287   HG11  VAL 104          HG11      VAL 104  -3.730 -30.550  -5.749
  288   HG12  VAL 104          HG12      VAL 104  -4.389 -28.941  -5.463
  289   HG13  VAL 104          HG13      VAL 104  -5.323 -30.376  -4.990
  290   HG21  VAL 104          HG21      VAL 104  -4.570 -32.014  -7.412
  291   HG22  VAL 104          HG22      VAL 104  -6.233 -31.931  -6.806
  292   HG23  VAL 104          HG23      VAL 104  -5.879 -31.571  -8.510
  293    H    ILE 105           H        ILE 105  -6.064 -27.354  -8.909
  294    HA   ILE 105           HA       ILE 105  -5.293 -25.172  -7.184
  295    HB   ILE 105           HB       ILE 105  -6.317 -25.338 -10.043
  296   HG12  ILE 105          HG12      ILE 105  -3.555 -24.399  -9.232
  297   HG13  ILE 105          HG13      ILE 105  -3.890 -26.113  -9.045
  298   HG21  ILE 105          HG21      ILE 105  -5.343 -22.866  -8.544
  299   HG22  ILE 105          HG22      ILE 105  -5.493 -22.980 -10.312
  300   HG23  ILE 105          HG23      ILE 105  -6.934 -23.110  -9.309
  301   HD11  ILE 105          HD11      ILE 105  -4.279 -24.616 -11.659
  302   HD12  ILE 105          HD12      ILE 105  -2.854 -25.585 -11.220
  303   HD13  ILE 105          HD13      ILE 105  -4.436 -26.367 -11.363
  304    H    ASP 106           H        ASP 106  -8.493 -25.931  -8.700
  305    HA   ASP 106           HA       ASP 106  -9.940 -23.936  -7.415
  306    HB2  ASP 106           HB2      ASP 106 -10.749 -25.263  -9.316
  307    HB3  ASP 106           HB3      ASP 106 -10.855 -26.691  -8.282
  308    H    ALA 107           H        ALA 107  -9.350 -27.326  -6.293
  309    HA   ALA 107           HA       ALA 107 -10.668 -27.236  -3.889
  310    HB1  ALA 107           HB1      ALA 107  -9.211 -29.100  -3.255
  311    HB2  ALA 107           HB2      ALA 107  -9.647 -29.240  -4.958
  312    HB3  ALA 107           HB3      ALA 107  -8.030 -28.659  -4.509
  313    H    TYR 108           H        TYR 108  -7.279 -26.201  -4.507
  314    HA   TYR 108           HA       TYR 108  -6.692 -25.310  -1.851
  315    HB2  TYR 108           HB2      TYR 108  -4.987 -25.792  -3.511
  316    HB3  TYR 108           HB3      TYR 108  -5.575 -24.519  -4.566
  317    HD1  TYR 108           HD2      TYR 108  -4.019 -25.171  -1.240
  318    HD2  TYR 108           HD1      TYR 108  -4.817 -22.262  -4.318
  319    HE1  TYR 108           HE2      TYR 108  -2.438 -23.598  -0.145
  320    HE2  TYR 108           HE1      TYR 108  -3.233 -20.677  -3.219
  321    HH   TYR 108           HH       TYR 108  -1.489 -21.493  -0.194
  322    H    HIS 109           H        HIS 109  -7.962 -23.471  -4.721
  323    HA   HIS 109           HA       HIS 109  -8.245 -20.970  -3.338
  324    HB2  HIS 109           HB2      HIS 109  -9.827 -22.116  -5.680
  325    HB3  HIS 109           HB3      HIS 109  -9.920 -20.449  -5.124
  326    HD1  HIS 109           HD1      HIS 109  -8.997 -21.028  -8.061
  327    HD2  HIS 109           HD2      HIS 109  -6.506 -20.382  -4.713
  328    HE1  HIS 109           HE1      HIS 109  -6.749 -20.164  -8.979
  329    HE2  HIS 109           HE2      HIS 109  -5.239 -19.767  -6.931
  330    H    ALA 110           H        ALA 110 -10.531 -23.745  -3.453
  331    HA   ALA 110           HA       ALA 110 -12.602 -22.410  -1.999
  332    HB1  ALA 110           HB1      ALA 110 -11.862 -25.373  -2.028
  333    HB2  ALA 110           HB2      ALA 110 -13.409 -24.677  -1.509
  334    HB3  ALA 110           HB3      ALA 110 -12.908 -24.550  -3.205
  335    H    ALA 111           H        ALA 111  -9.738 -24.288  -0.780
  336    HA   ALA 111           HA       ALA 111 -10.404 -23.945   1.910
  337    HB1  ALA 111           HB1      ALA 111  -7.680 -24.382   0.621
  338    HB2  ALA 111           HB2      ALA 111  -8.082 -24.669   2.326
  339    HB3  ALA 111           HB3      ALA 111  -8.855 -25.645   1.055
  340    H    THR 112           H        THR 112  -8.342 -21.892  -0.215
  341    HA   THR 112           HA       THR 112  -7.601 -20.117   1.970
  342    HB   THR 112           HB       THR 112  -6.551 -18.720   0.264
  343    HG1  THR 112           HG1      THR 112  -6.615 -19.336  -1.874
  344   HG21  THR 112          HG21      THR 112  -4.861 -20.293  -0.492
  345   HG22  THR 112          HG22      THR 112  -5.313 -20.660   1.177
  346   HG23  THR 112          HG23      THR 112  -5.917 -21.672  -0.151
  347    H    LEU 113           H        LEU 113 -10.225 -19.980  -0.405
  348    HA   LEU 113           HA       LEU 113 -10.911 -17.216   0.470
  349    HB2  LEU 113           HB2      LEU 113 -12.084 -18.901  -1.757
  350    HB3  LEU 113           HB3      LEU 113 -12.381 -17.191  -1.470
  351    HG   LEU 113           HG       LEU 113  -9.696 -18.405  -2.258
  352   HD11  LEU 113          HD11      LEU 113 -11.672 -16.730  -3.855
  353   HD12  LEU 113          HD12      LEU 113 -10.086 -17.312  -4.418
  354   HD13  LEU 113          HD13      LEU 113 -11.375 -18.470  -4.061
  355   HD21  LEU 113          HD21      LEU 113 -10.530 -15.493  -1.943
  356   HD22  LEU 113          HD22      LEU 113  -9.348 -16.366  -0.944
  357   HD23  LEU 113          HD23      LEU 113  -8.995 -16.053  -2.646
  358    H    GLU 114           H        GLU 114 -12.439 -20.426   0.314
  359    HA   GLU 114           HA       GLU 114 -14.845 -19.392   1.720
  360    HB2  GLU 114           HB2      GLU 114 -14.427 -22.184   0.609
  361    HB3  GLU 114           HB3      GLU 114 -15.932 -21.418   1.112
  362    HG2  GLU 114           HG2      GLU 114 -15.519 -19.667  -0.710
  363    HG3  GLU 114           HG3      GLU 114 -14.247 -20.731  -1.319
  364    H    HIS 115           H        HIS 115 -11.946 -20.850   2.647
  365    HA   HIS 115           HA       HIS 115 -11.193 -21.895   4.526
  366    HB2  HIS 115           HB2      HIS 115 -13.315 -20.254   5.932
  367    HB3  HIS 115           HB3      HIS 115 -11.760 -20.786   6.575
  368    HD1  HIS 115           HD1      HIS 115 -13.203 -17.730   5.300
  369    HD2  HIS 115           HD2      HIS 115  -9.632 -19.874   4.592
  370    HE1  HIS 115           HE1      HIS 115 -11.585 -16.087   4.162
  371    HE2  HIS 115           HE2      HIS 115  -9.422 -17.411   3.699
  372    H    HIS 116           H        HIS 116 -12.871 -23.529   3.145
  373    HA   HIS 116           HA       HIS 116 -13.997 -25.484   3.191
  374    HB2  HIS 116           HB2      HIS 116 -11.835 -25.918   4.460
  375    HB3  HIS 116           HB3      HIS 116 -12.789 -25.915   5.938
  376    HD1  HIS 116           HD1      HIS 116 -12.509 -27.914   2.605
  377    HD2  HIS 116           HD2      HIS 116 -13.974 -28.197   6.560
  378    HE1  HIS 116           HE1      HIS 116 -13.254 -30.360   2.936
  379    HE2  HIS 116           HE2      HIS 116 -14.140 -30.522   5.347
  380    H    HIS 117           H        HIS 117 -15.655 -23.282   4.049
  381    HA   HIS 117           HA       HIS 117 -17.595 -24.446   5.944
  382    HB2  HIS 117           HB2      HIS 117 -17.763 -22.055   4.067
  383    HB3  HIS 117           HB3      HIS 117 -19.069 -22.563   5.132
  384    HD1  HIS 117           HD1      HIS 117 -15.814 -20.676   5.216
  385    HD2  HIS 117           HD2      HIS 117 -18.656 -22.368   7.842
  386    HE1  HIS 117           HE1      HIS 117 -15.379 -19.627   7.555
  387    HE2  HIS 117           HE2      HIS 117 -17.115 -20.680   9.144
  388    H    HIS 118           H        HIS 118 -19.437 -25.595   5.470
  389    HA   HIS 118           HA       HIS 118 -19.525 -26.983   2.906
  390    HB2  HIS 118           HB2      HIS 118 -19.979 -28.133   5.039
  391    HB3  HIS 118           HB3      HIS 118 -21.379 -27.105   5.323
  392    HD1  HIS 118           HD1      HIS 118 -20.223 -29.944   2.953
  393    HD2  HIS 118           HD2      HIS 118 -23.661 -27.782   4.133
  394    HE1  HIS 118           HE1      HIS 118 -22.242 -31.146   1.892
  395    HE2  HIS 118           HE2      HIS 118 -24.330 -29.829   2.620
  396    H    HIS 119           H        HIS 119 -20.876 -26.757   1.223
  397    HA   HIS 119           HA       HIS 119 -23.392 -25.267   1.341
  398    HB2  HIS 119           HB2      HIS 119 -22.820 -23.679  -0.463
  399    HB3  HIS 119           HB3      HIS 119 -21.833 -23.411   0.950
  400    HD1  HIS 119           HD1      HIS 119 -21.495 -24.933  -2.626
  401    HD2  HIS 119           HD2      HIS 119 -19.230 -23.389   0.610
  402    HE1  HIS 119           HE1      HIS 119 -19.079 -24.629  -3.476
  403    HE2  HIS 119           HE2      HIS 119 -17.718 -23.653  -1.514
  404    H    HIS 120           H        HIS 120 -24.573 -25.385  -0.742
  405    HA   HIS 120           HA       HIS 120 -24.456 -27.958  -2.052
  406    HB2  HIS 120           HB2      HIS 120 -26.153 -26.991  -3.565
  407    HB3  HIS 120           HB3      HIS 120 -26.551 -26.806  -1.861
  408    HD1  HIS 120           HD1      HIS 120 -24.228 -24.324  -3.671
  409    HD2  HIS 120           HD2      HIS 120 -28.155 -24.709  -2.171
  410    HE1  HIS 120           HE1      HIS 120 -25.298 -21.954  -3.789
  411    HE2  HIS 120           HE2      HIS 120 -27.694 -22.214  -2.866
  Start of MODEL   10
    1    H1   SER  66           H1       SER  66   6.978 -15.368 -23.425
    2    H2   SER  66           H2       SER  66   6.244 -15.286 -24.886
    3    H3   SER  66           H3       SER  66   7.551 -14.350 -24.573
    4    HA   SER  66           HA       SER  66   5.531 -13.036 -24.487
    5    HB2  SER  66           HB2      SER  66   3.927 -13.485 -22.604
    6    HB3  SER  66           HB3      SER  66   3.941 -14.727 -23.863
    7    HG   SER  66           HG       SER  66   3.990 -15.617 -21.724
    8    H    GLY  67           H        GLY  67   5.188 -11.296 -22.906
    9    HA2  GLY  67           HA2      GLY  67   7.655 -10.530 -21.583
   10    HA3  GLY  67           HA3      GLY  67   6.158  -9.610 -21.661
   11    H    SER  68           H        SER  68   7.658  -9.554 -19.402
   12    HA   SER  68           HA       SER  68   6.526 -11.440 -17.408
   13    HB2  SER  68           HB2      SER  68   8.705  -9.353 -17.146
   14    HB3  SER  68           HB3      SER  68   8.185 -10.472 -15.875
   15    HG   SER  68           HG       SER  68   9.298 -11.195 -18.411
   16    H    GLY  69           H        GLY  69   5.336  -8.650 -18.655
   17    HA2  GLY  69           HA2      GLY  69   3.584  -7.307 -17.990
   18    HA3  GLY  69           HA3      GLY  69   3.428  -8.296 -16.544
   19    H    ARG  70           H        ARG  70   2.776  -6.154 -15.702
   20    HA   ARG  70           HA       ARG  70   4.496  -3.916 -15.436
   21    HB2  ARG  70           HB2      ARG  70   2.023  -3.940 -15.107
   22    HB3  ARG  70           HB3      ARG  70   2.236  -4.811 -13.587
   23    HG2  ARG  70           HG2      ARG  70   3.532  -2.901 -12.665
   24    HG3  ARG  70           HG3      ARG  70   3.353  -2.027 -14.191
   25    HD2  ARG  70           HD2      ARG  70   1.051  -2.943 -12.420
   26    HD3  ARG  70           HD3      ARG  70   1.765  -1.318 -12.394
   27    HE   ARG  70           HE       ARG  70   1.069  -1.721 -15.057
   28   HH11  ARG  70          HH11      ARG  70  -0.736  -1.616 -12.054
   29   HH12  ARG  70          HH12      ARG  70  -2.195  -1.079 -12.843
   30   HH21  ARG  70          HH21      ARG  70  -0.831  -1.067 -16.004
   31   HH22  ARG  70          HH22      ARG  70  -2.243  -0.779 -15.026
   32    H    GLY  71           H        GLY  71   6.182  -3.460 -14.206
   33    HA2  GLY  71           HA2      GLY  71   7.845  -3.586 -12.620
   34    HA3  GLY  71           HA3      GLY  71   6.745  -4.497 -11.585
   35    H    ARG  72           H        ARG  72   7.237  -5.990 -14.649
   36    HA   ARG  72           HA       ARG  72   7.946  -8.075 -15.161
   37    HB2  ARG  72           HB2      ARG  72  10.565  -7.060 -14.006
   38    HB3  ARG  72           HB3      ARG  72  10.370  -8.435 -15.103
   39    HG2  ARG  72           HG2      ARG  72   9.398  -6.908 -16.828
   40    HG3  ARG  72           HG3      ARG  72   9.698  -5.526 -15.768
   41    HD2  ARG  72           HD2      ARG  72  11.840  -7.424 -16.806
   42    HD3  ARG  72           HD3      ARG  72  11.435  -5.854 -17.525
   43    HE   ARG  72           HE       ARG  72  11.978  -5.339 -14.818
   44   HH11  ARG  72          HH21      ARG  72  13.815  -6.481 -17.574
   45   HH12  ARG  72          HH22      ARG  72  15.326  -5.881 -16.940
   46   HH21  ARG  72          HH11      ARG  72  13.940  -4.598 -14.062
   47   HH22  ARG  72          HH12      ARG  72  15.381  -4.823 -15.009
   48    H    GLY  73           H        GLY  73   6.402  -8.441 -13.129
   49    HA2  GLY  73           HA2      GLY  73   7.391  -9.740 -10.807
   50    HA3  GLY  73           HA3      GLY  73   5.801 -10.005 -11.528
   51    H    ALA  74           H        ALA  74   7.906 -11.845 -10.312
   52    HA   ALA  74           HA       ALA  74   8.101 -13.861 -12.502
   53    HB1  ALA  74           HB1      ALA  74  10.427 -14.309 -11.831
   54    HB2  ALA  74           HB2      ALA  74  10.235 -12.630 -12.366
   55    HB3  ALA  74           HB3      ALA  74  10.346 -13.001 -10.632
   56    H    ILE  75           H        ILE  75   8.303 -16.017 -11.875
   57    HA   ILE  75           HA       ILE  75   7.615 -16.678  -9.056
   58    HB   ILE  75           HB       ILE  75   6.329 -17.962 -11.499
   59   HG12  ILE  75          HG12      ILE  75   5.081 -16.111  -9.416
   60   HG13  ILE  75          HG13      ILE  75   5.439 -15.680 -11.087
   61   HG21  ILE  75          HG21      ILE  75   6.651 -19.552  -9.603
   62   HG22  ILE  75          HG22      ILE  75   5.838 -18.412  -8.511
   63   HG23  ILE  75          HG23      ILE  75   4.960 -19.205  -9.839
   64   HD11  ILE  75          HD11      ILE  75   3.103 -16.130 -10.955
   65   HD12  ILE  75          HD12      ILE  75   3.857 -17.442 -11.879
   66   HD13  ILE  75          HD13      ILE  75   3.360 -17.700 -10.187
   67    H    ASP  76           H        ASP  76   8.813 -18.262  -8.197
   68    HA   ASP  76           HA       ASP  76  10.571 -19.935  -9.955
   69    HB2  ASP  76           HB2      ASP  76  11.784 -18.113  -8.834
   70    HB3  ASP  76           HB3      ASP  76  11.224 -18.686  -7.263
   71    H    ARG  77           H        ARG  77   8.439 -21.108  -9.765
   72    HA   ARG  77           HA       ARG  77   7.111 -22.813  -9.152
   73    HB2  ARG  77           HB2      ARG  77   9.353 -23.895  -9.464
   74    HB3  ARG  77           HB3      ARG  77   9.547 -23.911  -7.708
   75    HG2  ARG  77           HG2      ARG  77   7.535 -25.378  -7.505
   76    HG3  ARG  77           HG3      ARG  77   7.282 -25.256  -9.255
   77    HD2  ARG  77           HD2      ARG  77   8.328 -27.366  -8.778
   78    HD3  ARG  77           HD3      ARG  77   9.478 -26.332  -9.644
   79    HE   ARG  77           HE       ARG  77   9.680 -26.237  -6.701
   80   HH11  ARG  77          HH11      ARG  77  10.898 -27.909  -9.536
   81   HH12  ARG  77          HH12      ARG  77  12.323 -28.465  -8.708
   82   HH21  ARG  77          HH21      ARG  77  11.527 -26.979  -5.708
   83   HH22  ARG  77          HH22      ARG  77  12.664 -27.948  -6.594
   84    H    GLU  78           H        GLU  78   8.398 -21.142  -6.433
   85    HA   GLU  78           HA       GLU  78   7.321 -22.384  -4.272
   86    HB2  GLU  78           HB2      GLU  78   8.793 -20.393  -4.305
   87    HB3  GLU  78           HB3      GLU  78   7.402 -19.372  -4.708
   88    HG2  GLU  78           HG2      GLU  78   6.344 -19.950  -2.547
   89    HG3  GLU  78           HG3      GLU  78   7.656 -21.076  -2.185
   90    H    GLN  79           H        GLN  79   5.395 -20.202  -6.385
   91    HA   GLN  79           HA       GLN  79   3.040 -20.316  -4.681
   92    HB2  GLN  79           HB2      GLN  79   3.338 -19.567  -7.627
   93    HB3  GLN  79           HB3      GLN  79   1.866 -19.369  -6.662
   94    HG2  GLN  79           HG2      GLN  79   3.132 -17.892  -5.080
   95    HG3  GLN  79           HG3      GLN  79   4.542 -17.999  -6.136
   96   HE21  GLN  79          HE22      GLN  79   4.170 -15.531  -5.997
   97   HE22  GLN  79          HE21      GLN  79   3.093 -14.856  -7.211
   98    H    SER  80           H        SER  80   4.266 -22.501  -7.168
   99    HA   SER  80           HA       SER  80   1.751 -24.063  -7.175
  100    HB2  SER  80           HB2      SER  80   2.687 -25.471  -8.728
  101    HB3  SER  80           HB3      SER  80   3.400 -23.919  -9.156
  102    HG   SER  80           HG       SER  80   5.316 -24.558  -8.088
  103    H    ALA  81           H        ALA  81   5.032 -24.291  -5.723
  104    HA   ALA  81           HA       ALA  81   4.678 -26.683  -4.334
  105    HB1  ALA  81           HB1      ALA  81   6.822 -25.492  -4.673
  106    HB2  ALA  81           HB2      ALA  81   6.316 -24.278  -3.474
  107    HB3  ALA  81           HB3      ALA  81   6.562 -25.963  -2.982
  108    H    ALA  82           H        ALA  82   3.682 -23.405  -3.312
  109    HA   ALA  82           HA       ALA  82   2.656 -23.979  -0.756
  110    HB1  ALA  82           HB1      ALA  82   1.636 -22.093  -2.943
  111    HB2  ALA  82           HB2      ALA  82   1.186 -22.021  -1.220
  112    HB3  ALA  82           HB3      ALA  82   2.866 -21.731  -1.721
  113    H    ILE  83           H        ILE  83   1.102 -24.562  -3.942
  114    HA   ILE  83           HA       ILE  83  -1.363 -25.615  -2.765
  115    HB   ILE  83           HB       ILE  83  -0.377 -25.625  -5.642
  116   HG12  ILE  83          HG12      ILE  83  -2.295 -23.792  -4.127
  117   HG13  ILE  83          HG13      ILE  83  -0.708 -23.357  -4.743
  118   HG21  ILE  83          HG21      ILE  83  -3.145 -26.245  -4.499
  119   HG22  ILE  83          HG22      ILE  83  -2.735 -26.156  -6.223
  120   HG23  ILE  83          HG23      ILE  83  -2.050 -27.433  -5.232
  121   HD11  ILE  83          HD11      ILE  83  -3.183 -23.941  -6.396
  122   HD12  ILE  83          HD12      ILE  83  -2.301 -22.419  -6.221
  123   HD13  ILE  83          HD13      ILE  83  -1.546 -23.774  -7.085
  124    H    ARG  84           H        ARG  84   1.619 -27.019  -4.175
  125    HA   ARG  84           HA       ARG  84   0.835 -29.789  -4.027
  126    HB2  ARG  84           HB2      ARG  84   3.623 -28.606  -3.634
  127    HB3  ARG  84           HB3      ARG  84   3.266 -30.300  -3.959
  128    HG2  ARG  84           HG2      ARG  84   2.430 -29.771  -6.193
  129    HG3  ARG  84           HG3      ARG  84   2.560 -28.051  -5.861
  130    HD2  ARG  84           HD2      ARG  84   5.102 -28.545  -5.445
  131    HD3  ARG  84           HD3      ARG  84   4.799 -30.017  -6.343
  132    HE   ARG  84           HE       ARG  84   4.843 -27.232  -7.347
  133   HH11  ARG  84          HH11      ARG  84   3.760 -30.480  -8.227
  134   HH12  ARG  84          HH12      ARG  84   3.689 -30.023  -9.927
  135   HH21  ARG  84          HH21      ARG  84   4.697 -26.807  -9.494
  136   HH22  ARG  84          HH22      ARG  84   4.270 -28.101 -10.611
  137    H    GLU  85           H        GLU  85   2.554 -27.786  -1.582
  138    HA   GLU  85           HA       GLU  85   2.582 -29.764   0.376
  139    HB2  GLU  85           HB2      GLU  85   2.782 -26.759   0.527
  140    HB3  GLU  85           HB3      GLU  85   2.845 -27.760   1.983
  141    HG2  GLU  85           HG2      GLU  85   4.642 -28.193  -0.423
  142    HG3  GLU  85           HG3      GLU  85   5.098 -27.211   0.979
  143    H    TRP  86           H        TRP  86   0.123 -27.140  -0.087
  144    HA   TRP  86           HA       TRP  86  -1.598 -27.884   1.959
  145    HB2  TRP  86           HB2      TRP  86  -1.918 -25.844   0.712
  146    HB3  TRP  86           HB3      TRP  86  -2.183 -26.736  -0.783
  147    HD1  TRP  86           HD1      TRP  86  -3.927 -25.767   2.458
  148    HE1  TRP  86           HE1      TRP  86  -6.431 -26.312   2.311
  149    HE3  TRP  86           HE3      TRP  86  -3.969 -28.157  -2.078
  150    HZ2  TRP  86           HZ2      TRP  86  -8.165 -27.882   0.597
  151    HZ3  TRP  86           HZ3      TRP  86  -6.069 -29.161  -2.940
  152    HH2  TRP  86           HH2      TRP  86  -8.152 -29.075  -1.580
  153    H    ALA  87           H        ALA  87  -1.527 -29.172  -1.408
  154    HA   ALA  87           HA       ALA  87  -3.698 -30.985  -1.095
  155    HB1  ALA  87           HB1      ALA  87  -2.833 -30.242  -3.265
  156    HB2  ALA  87           HB2      ALA  87  -1.275 -31.029  -2.940
  157    HB3  ALA  87           HB3      ALA  87  -2.733 -32.014  -3.165
  158    H    ARG  88           H        ARG  88  -0.213 -31.403  -0.457
  159    HA   ARG  88           HA       ARG  88  -0.310 -34.243   0.120
  160    HB2  ARG  88           HB2      ARG  88   1.730 -32.944  -0.554
  161    HB3  ARG  88           HB3      ARG  88   1.710 -32.133   1.016
  162    HG2  ARG  88           HG2      ARG  88   1.991 -34.365   2.136
  163    HG3  ARG  88           HG3      ARG  88   2.006 -35.134   0.543
  164    HD2  ARG  88           HD2      ARG  88   4.294 -34.918   1.243
  165    HD3  ARG  88           HD3      ARG  88   4.024 -33.772  -0.059
  166    HE   ARG  88           HE       ARG  88   4.482 -32.010   1.366
  167   HH11  ARG  88          HH21      ARG  88   4.070 -34.843   3.423
  168   HH12  ARG  88          HH22      ARG  88   4.609 -33.979   4.835
  169   HH21  ARG  88          HH11      ARG  88   5.075 -30.979   3.172
  170   HH22  ARG  88          HH12      ARG  88   5.193 -31.849   4.691
  171    H    ARG  89           H        ARG  89  -0.375 -31.332   2.169
  172    HA   ARG  89           HA       ARG  89  -0.749 -32.542   4.720
  173    HB2  ARG  89           HB2      ARG  89  -0.112 -30.217   4.336
  174    HB3  ARG  89           HB3      ARG  89  -1.659 -29.864   3.562
  175    HG2  ARG  89           HG2      ARG  89  -2.863 -30.231   5.618
  176    HG3  ARG  89           HG3      ARG  89  -1.384 -30.762   6.450
  177    HD2  ARG  89           HD2      ARG  89  -1.842 -27.987   5.263
  178    HD3  ARG  89           HD3      ARG  89  -2.105 -28.407   6.965
  179    HE   ARG  89           HE       ARG  89   0.523 -29.206   6.400
  180   HH11  ARG  89          HH11      ARG  89  -1.188 -26.150   6.526
  181   HH12  ARG  89          HH12      ARG  89   0.257 -25.250   6.902
  182   HH21  ARG  89          HH21      ARG  89   2.330 -27.995   6.878
  183   HH22  ARG  89          HH22      ARG  89   2.194 -26.276   7.093
  184    H    ASN  90           H        ASN  90  -3.134 -31.810   2.194
  185    HA   ASN  90           HA       ASN  90  -5.353 -32.871   3.847
  186    HB2  ASN  90           HB2      ASN  90  -5.216 -31.482   1.148
  187    HB3  ASN  90           HB3      ASN  90  -6.689 -32.222   1.777
  188   HD21  ASN  90          HD22      ASN  90  -4.361 -29.605   2.348
  189   HD22  ASN  90          HD21      ASN  90  -5.417 -28.732   3.458
  190    H    GLY  91           H        GLY  91  -3.019 -34.494   2.219
  191    HA2  GLY  91           HA2      GLY  91  -2.852 -36.703   1.635
  192    HA3  GLY  91           HA3      GLY  91  -4.514 -36.944   2.174
  193    H    HIS  92           H        HIS  92  -3.979 -34.576  -0.345
  194    HA   HIS  92           HA       HIS  92  -5.451 -36.265  -2.302
  195    HB2  HIS  92           HB2      HIS  92  -4.656 -33.329  -2.439
  196    HB3  HIS  92           HB3      HIS  92  -5.730 -34.166  -3.552
  197    HD1  HIS  92           HD1      HIS  92  -7.441 -35.613  -1.041
  198    HD2  HIS  92           HD2      HIS  92  -6.547 -31.551  -1.784
  199    HE1  HIS  92           HE1      HIS  92  -9.255 -34.235   0.158
  200    HE2  HIS  92           HE2      HIS  92  -8.718 -31.764  -0.313
  201    H    ASN  93           H        ASN  93  -4.719 -36.694  -4.398
  202    HA   ASN  93           HA       ASN  93  -1.880 -37.204  -4.647
  203    HB2  ASN  93           HB2      ASN  93  -3.704 -38.663  -5.545
  204    HB3  ASN  93           HB3      ASN  93  -4.123 -37.399  -6.709
  205   HD21  ASN  93          HD22      ASN  93  -3.714 -39.386  -8.156
  206   HD22  ASN  93          HD21      ASN  93  -2.060 -39.580  -8.721
  207    H    VAL  94           H        VAL  94  -0.306 -35.983  -5.567
  208    HA   VAL  94           HA       VAL  94  -0.843 -33.966  -7.598
  209    HB   VAL  94           HB       VAL  94  -1.321 -32.794  -5.410
  210   HG11  VAL  94          HG11      VAL  94   0.486 -32.094  -3.963
  211   HG12  VAL  94          HG12      VAL  94   0.463 -33.853  -4.024
  212   HG13  VAL  94          HG13      VAL  94   1.688 -32.943  -4.941
  213   HG21  VAL  94          HG21      VAL  94   1.008 -31.597  -6.947
  214   HG22  VAL  94          HG22      VAL  94  -0.694 -31.576  -7.478
  215   HG23  VAL  94          HG23      VAL  94  -0.221 -30.749  -5.989
  216    H    SER  95           H        SER  95   1.024 -33.344  -8.768
  217    HA   SER  95           HA       SER  95   3.331 -35.126  -8.552
  218    HB2  SER  95           HB2      SER  95   2.553 -34.379 -10.755
  219    HB3  SER  95           HB3      SER  95   2.878 -32.694 -10.309
  220    HG   SER  95           HG       SER  95   4.684 -34.785 -10.882
  221    H    THR  96           H        THR  96   5.462 -34.585  -7.997
  222    HA   THR  96           HA       THR  96   5.882 -32.419  -6.073
  223    HB   THR  96           HB       THR  96   8.241 -33.275  -6.103
  224    HG1  THR  96           HG1      THR  96   8.570 -35.226  -7.261
  225   HG21  THR  96          HG21      THR  96   6.543 -34.235  -4.547
  226   HG22  THR  96          HG22      THR  96   6.141 -35.468  -5.762
  227   HG23  THR  96          HG23      THR  96   7.766 -35.421  -5.038
  228    H    ARG  97           H        ARG  97   6.374 -32.811  -9.520
  229    HA   ARG  97           HA       ARG  97   7.660 -30.100  -9.675
  230    HB2  ARG  97           HB2      ARG  97   9.388 -30.938 -11.160
  231    HB3  ARG  97           HB3      ARG  97   9.437 -31.761  -9.599
  232    HG2  ARG  97           HG2      ARG  97   8.301 -33.745 -10.612
  233    HG3  ARG  97           HG3      ARG  97   8.235 -32.900 -12.165
  234    HD2  ARG  97           HD2      ARG  97  10.102 -34.418 -12.238
  235    HD3  ARG  97           HD3      ARG  97  10.726 -32.777 -12.184
  236    HE   ARG  97           HE       ARG  97  11.634 -33.152 -10.073
  237   HH11  ARG  97          HH21      ARG  97   9.659 -35.945 -10.854
  238   HH12  ARG  97          HH22      ARG  97  10.335 -36.894  -9.559
  239   HH21  ARG  97          HH11      ARG  97  12.419 -34.408  -8.423
  240   HH22  ARG  97          HH12      ARG  97  11.848 -36.037  -8.217
  241    H    GLY  98           H        GLY  98   5.539 -32.384 -11.280
  242    HA2  GLY  98           HA2      GLY  98   5.479 -31.007 -13.847
  243    HA3  GLY  98           HA3      GLY  98   4.408 -32.283 -13.287
  244    H    ARG  99           H        ARG  99   3.034 -30.668 -14.652
  245    HA   ARG  99           HA       ARG  99   2.041 -28.267 -13.385
  246    HB2  ARG  99           HB2      ARG  99   1.950 -28.727 -15.812
  247    HB3  ARG  99           HB3      ARG  99   0.783 -30.030 -15.532
  248    HG2  ARG  99           HG2      ARG  99  -0.870 -28.416 -14.704
  249    HG3  ARG  99           HG3      ARG  99   0.323 -27.109 -14.771
  250    HD2  ARG  99           HD2      ARG  99  -1.157 -26.938 -16.693
  251    HD3  ARG  99           HD3      ARG  99   0.471 -27.338 -17.217
  252    HE   ARG  99           HE       ARG  99  -0.240 -29.422 -17.973
  253   HH11  ARG  99          HH11      ARG  99  -2.927 -28.007 -16.211
  254   HH12  ARG  99          HH12      ARG  99  -4.057 -29.181 -16.827
  255   HH21  ARG  99          HH21      ARG  99  -1.722 -30.901 -18.680
  256   HH22  ARG  99          HH22      ARG  99  -3.378 -30.796 -18.167
  257    H    ILE 100           H        ILE 100   0.339 -27.915 -12.048
  258    HA   ILE 100           HA       ILE 100  -0.742 -30.190 -10.526
  259    HB   ILE 100           HB       ILE 100  -1.148 -27.219 -10.152
  260   HG12  ILE 100          HG12      ILE 100   0.702 -29.251  -8.813
  261   HG13  ILE 100          HG13      ILE 100   1.183 -27.891  -9.829
  262   HG21  ILE 100          HG21      ILE 100  -1.862 -29.530  -8.278
  263   HG22  ILE 100          HG22      ILE 100  -2.074 -27.800  -7.946
  264   HG23  ILE 100          HG23      ILE 100  -3.039 -28.558  -9.191
  265   HD11  ILE 100          HD11      ILE 100   0.106 -26.352  -8.099
  266   HD12  ILE 100          HD12      ILE 100   0.045 -27.786  -7.034
  267   HD13  ILE 100          HD13      ILE 100   1.599 -27.191  -7.640
  268    HA   PRO 101           HA       PRO 101  -4.512 -30.267 -13.002
  269    HB2  PRO 101           HB2      PRO 101  -5.899 -31.418 -10.620
  270    HB3  PRO 101           HB3      PRO 101  -5.754 -32.079 -12.273
  271    HG2  PRO 101           HG2      PRO 101  -4.329 -33.120 -10.188
  272    HG3  PRO 101           HG3      PRO 101  -3.617 -32.977 -11.827
  273    HD2  PRO 101           HD2      PRO 101  -3.249 -31.135  -9.453
  274    HD3  PRO 101           HD3      PRO 101  -2.030 -31.804 -10.578
  275    H    ALA 102           H        ALA 102  -6.146 -28.794 -13.360
  276    HA   ALA 102           HA       ALA 102  -6.408 -26.544 -11.731
  277    HB1  ALA 102           HB1      ALA 102  -6.878 -26.613 -14.133
  278    HB2  ALA 102           HB2      ALA 102  -8.353 -27.568 -13.811
  279    HB3  ALA 102           HB3      ALA 102  -8.206 -25.897 -13.193
  280    H    ASP 103           H        ASP 103  -8.333 -29.528 -11.685
  281    HA   ASP 103           HA       ASP 103 -10.374 -28.740  -9.991
  282    HB2  ASP 103           HB2      ASP 103 -10.260 -30.888 -11.189
  283    HB3  ASP 103           HB3      ASP 103  -8.926 -31.405 -10.156
  284    H    VAL 104           H        VAL 104  -7.019 -29.657  -9.173
  285    HA   VAL 104           HA       VAL 104  -7.464 -29.603  -6.317
  286    HB   VAL 104           HB       VAL 104  -4.858 -29.708  -7.805
  287   HG11  VAL 104          HG11      VAL 104  -4.529 -29.051  -5.455
  288   HG12  VAL 104          HG12      VAL 104  -5.497 -30.439  -4.923
  289   HG13  VAL 104          HG13      VAL 104  -3.936 -30.690  -5.732
  290   HG21  VAL 104          HG21      VAL 104  -6.249 -31.694  -8.374
  291   HG22  VAL 104          HG22      VAL 104  -4.884 -32.151  -7.363
  292   HG23  VAL 104          HG23      VAL 104  -6.504 -32.000  -6.649
  293    H    ILE 105           H        ILE 105  -6.091 -27.390  -8.777
  294    HA   ILE 105           HA       ILE 105  -5.334 -25.289  -6.966
  295    HB   ILE 105           HB       ILE 105  -6.222 -25.350  -9.875
  296   HG12  ILE 105          HG12      ILE 105  -3.466 -24.559  -8.874
  297   HG13  ILE 105          HG13      ILE 105  -3.892 -26.261  -8.810
  298   HG21  ILE 105          HG21      ILE 105  -6.789 -23.117  -9.151
  299   HG22  ILE 105          HG22      ILE 105  -5.236 -22.939  -8.290
  300   HG23  ILE 105          HG23      ILE 105  -5.283 -23.026 -10.062
  301   HD11  ILE 105          HD11      ILE 105  -2.721 -25.636 -10.906
  302   HD12  ILE 105          HD12      ILE 105  -4.313 -26.378 -11.150
  303   HD13  ILE 105          HD13      ILE 105  -4.101 -24.616 -11.356
  304    H    ASP 106           H        ASP 106  -8.486 -25.891  -8.638
  305    HA   ASP 106           HA       ASP 106  -9.907 -23.854  -7.376
  306    HB2  ASP 106           HB2      ASP 106 -10.703 -25.079  -9.338
  307    HB3  ASP 106           HB3      ASP 106 -10.868 -26.552  -8.378
  308    H    ALA 107           H        ALA 107  -9.494 -27.307  -6.320
  309    HA   ALA 107           HA       ALA 107 -10.925 -27.207  -3.987
  310    HB1  ALA 107           HB1      ALA 107  -9.573 -29.152  -3.328
  311    HB2  ALA 107           HB2      ALA 107  -9.951 -29.236  -5.045
  312    HB3  ALA 107           HB3      ALA 107  -8.329 -28.736  -4.527
  313    H    TYR 108           H        TYR 108  -7.471 -26.321  -4.414
  314    HA   TYR 108           HA       TYR 108  -6.892 -25.530  -1.746
  315    HB2  TYR 108           HB2      TYR 108  -5.111 -25.854  -3.248
  316    HB3  TYR 108           HB3      TYR 108  -5.805 -24.823  -4.478
  317    HD1  TYR 108           HD2      TYR 108  -4.152 -24.789  -1.142
  318    HD2  TYR 108           HD1      TYR 108  -5.367 -22.466  -4.566
  319    HE1  TYR 108           HE2      TYR 108  -2.778 -22.886  -0.329
  320    HE2  TYR 108           HE1      TYR 108  -3.996 -20.554  -3.746
  321    HH   TYR 108           HH       TYR 108  -2.084 -20.715  -0.714
  322    H    HIS 109           H        HIS 109  -8.056 -23.492  -4.524
  323    HA   HIS 109           HA       HIS 109  -8.314 -21.124  -2.933
  324    HB2  HIS 109           HB2      HIS 109  -9.557 -21.957  -5.570
  325    HB3  HIS 109           HB3      HIS 109  -9.914 -20.411  -4.809
  326    HD1  HIS 109           HD1      HIS 109  -7.452 -18.998  -4.080
  327    HD2  HIS 109           HD2      HIS 109  -7.583 -21.759  -7.264
  328    HE1  HIS 109           HE1      HIS 109  -5.444 -18.446  -5.594
  329    HE2  HIS 109           HE2      HIS 109  -5.533 -20.121  -7.544
  330    H    ALA 110           H        ALA 110 -10.756 -23.712  -3.522
  331    HA   ALA 110           HA       ALA 110 -12.868 -22.447  -2.176
  332    HB1  ALA 110           HB1      ALA 110 -12.204 -25.414  -2.406
  333    HB2  ALA 110           HB2      ALA 110 -13.793 -24.729  -2.008
  334    HB3  ALA 110           HB3      ALA 110 -13.085 -24.452  -3.612
  335    H    ALA 111           H        ALA 111 -10.201 -24.475  -0.836
  336    HA   ALA 111           HA       ALA 111 -11.092 -24.436   1.816
  337    HB1  ALA 111           HB1      ALA 111  -9.494 -26.043   0.898
  338    HB2  ALA 111           HB2      ALA 111  -8.273 -24.756   0.731
  339    HB3  ALA 111           HB3      ALA 111  -8.849 -25.237   2.340
  340    H    THR 112           H        THR 112  -8.860 -22.191   0.086
  341    HA   THR 112           HA       THR 112  -8.274 -20.696   2.522
  342    HB   THR 112           HB       THR 112  -6.942 -19.237   1.073
  343    HG1  THR 112           HG1      THR 112  -6.741 -19.756  -1.106
  344   HG21  THR 112          HG21      THR 112  -6.435 -22.191   0.528
  345   HG22  THR 112          HG22      THR 112  -5.257 -20.874   0.400
  346   HG23  THR 112          HG23      THR 112  -5.937 -21.298   1.982
  347    H    LEU 113           H        LEU 113 -10.389 -19.999  -0.316
  348    HA   LEU 113           HA       LEU 113 -10.734 -17.253   0.489
  349    HB2  LEU 113           HB2      LEU 113 -10.562 -18.034  -1.848
  350    HB3  LEU 113           HB3      LEU 113 -12.036 -18.990  -1.637
  351    HG   LEU 113           HG       LEU 113 -13.350 -16.988  -1.313
  352   HD11  LEU 113          HD11      LEU 113 -11.709 -15.401  -0.390
  353   HD12  LEU 113          HD12      LEU 113 -10.772 -15.453  -1.898
  354   HD13  LEU 113          HD13      LEU 113 -12.402 -14.740  -1.869
  355   HD21  LEU 113          HD21      LEU 113 -13.247 -16.170  -3.636
  356   HD22  LEU 113          HD22      LEU 113 -11.634 -16.889  -3.827
  357   HD23  LEU 113          HD23      LEU 113 -13.049 -17.930  -3.574
  358    H    GLU 114           H        GLU 114 -12.693 -20.181   0.883
  359    HA   GLU 114           HA       GLU 114 -15.187 -18.889   1.369
  360    HB2  GLU 114           HB2      GLU 114 -15.020 -21.205   0.696
  361    HB3  GLU 114           HB3      GLU 114 -14.154 -21.612   2.179
  362    HG2  GLU 114           HG2      GLU 114 -16.527 -22.337   2.202
  363    HG3  GLU 114           HG3      GLU 114 -16.117 -21.265   3.527
  364    H    HIS 115           H        HIS 115 -15.619 -17.477   2.929
  365    HA   HIS 115           HA       HIS 115 -14.118 -17.326   5.422
  366    HB2  HIS 115           HB2      HIS 115 -16.482 -15.792   4.276
  367    HB3  HIS 115           HB3      HIS 115 -15.879 -15.512   5.896
  368    HD1  HIS 115           HD1      HIS 115 -13.609 -15.906   2.711
  369    HD2  HIS 115           HD2      HIS 115 -14.810 -13.191   5.729
  370    HE1  HIS 115           HE1      HIS 115 -12.143 -13.819   2.441
  371    HE2  HIS 115           HE2      HIS 115 -12.873 -12.167   4.284
  372    H    HIS 116           H        HIS 116 -16.997 -19.084   4.533
  373    HA   HIS 116           HA       HIS 116 -18.073 -19.357   7.207
  374    HB2  HIS 116           HB2      HIS 116 -19.324 -19.717   5.072
  375    HB3  HIS 116           HB3      HIS 116 -18.395 -21.183   4.783
  376    HD1  HIS 116           HD1      HIS 116 -20.864 -19.796   7.466
  377    HD2  HIS 116           HD2      HIS 116 -19.427 -23.387   5.763
  378    HE1  HIS 116           HE1      HIS 116 -22.272 -21.692   8.483
  379    HE2  HIS 116           HE2      HIS 116 -21.386 -23.880   7.445
  380    H    HIS 117           H        HIS 117 -15.348 -20.951   5.678
  381    HA   HIS 117           HA       HIS 117 -15.249 -23.256   7.475
  382    HB2  HIS 117           HB2      HIS 117 -13.120 -21.969   5.711
  383    HB3  HIS 117           HB3      HIS 117 -12.922 -23.495   6.573
  384    HD1  HIS 117           HD1      HIS 117 -15.986 -24.575   5.613
  385    HD2  HIS 117           HD2      HIS 117 -12.674 -23.185   3.394
  386    HE1  HIS 117           HE1      HIS 117 -16.224 -25.573   3.255
  387    HE2  HIS 117           HE2      HIS 117 -14.200 -24.722   1.903
  388    H    HIS 118           H        HIS 118 -13.958 -23.607   9.259
  389    HA   HIS 118           HA       HIS 118 -12.372 -21.425  10.466
  390    HB2  HIS 118           HB2      HIS 118 -14.806 -21.100  11.153
  391    HB3  HIS 118           HB3      HIS 118 -14.745 -22.666  11.947
  392    HD1  HIS 118           HD1      HIS 118 -13.905 -22.569  14.460
  393    HD2  HIS 118           HD2      HIS 118 -13.002 -19.156  12.108
  394    HE1  HIS 118           HE1      HIS 118 -12.941 -20.799  16.063
  395    HE2  HIS 118           HE2      HIS 118 -12.397 -18.724  14.628
  396    H    HIS 119           H        HIS 119 -11.124 -22.148  12.342
  397    HA   HIS 119           HA       HIS 119 -10.127 -24.889  12.069
  398    HB2  HIS 119           HB2      HIS 119  -8.412 -24.148  13.695
  399    HB3  HIS 119           HB3      HIS 119  -8.516 -23.184  12.236
  400    HD1  HIS 119           HD1      HIS 119  -9.802 -22.880  15.900
  401    HD2  HIS 119           HD2      HIS 119  -8.481 -20.615  12.589
  402    HE1  HIS 119           HE1      HIS 119  -9.618 -20.431  16.716
  403    HE2  HIS 119           HE2      HIS 119  -8.820 -19.059  14.682
  404    H    HIS 120           H        HIS 120 -12.329 -25.702  12.631
  405    HA   HIS 120           HA       HIS 120 -13.915 -26.622  13.943
  406    HB2  HIS 120           HB2      HIS 120 -11.888 -28.058  14.402
  407    HB3  HIS 120           HB3      HIS 120 -11.682 -27.196  15.920
  408    HD1  HIS 120           HD1      HIS 120 -14.306 -27.230  17.296
  409    HD2  HIS 120           HD2      HIS 120 -13.074 -30.333  14.732
  410    HE1  HIS 120           HE1      HIS 120 -15.683 -29.343  17.986
  411    HE2  HIS 120           HE2      HIS 120 -14.912 -31.221  16.394
  Start of MODEL   11
    1    H1   SER  66           H1       SER  66  18.086   1.415 -10.952
    2    H2   SER  66           H2       SER  66  19.571   0.727 -10.922
    3    H3   SER  66           H3       SER  66  18.576   0.476 -12.197
    4    HA   SER  66           HA       SER  66  18.629  -1.482 -10.833
    5    HB2  SER  66           HB2      SER  66  17.593   0.325  -8.608
    6    HB3  SER  66           HB3      SER  66  17.857  -1.428  -8.517
    7    HG   SER  66           HG       SER  66  19.642  -0.246  -7.673
    8    H    GLY  67           H        GLY  67  16.778  -2.856 -10.559
    9    HA2  GLY  67           HA2      GLY  67  14.068  -1.984 -10.500
   10    HA3  GLY  67           HA3      GLY  67  14.533  -2.242 -12.184
   11    H    SER  68           H        SER  68  12.582  -3.742 -11.532
   12    HA   SER  68           HA       SER  68  11.683  -5.795 -11.255
   13    HB2  SER  68           HB2      SER  68  14.353  -6.743 -12.330
   14    HB3  SER  68           HB3      SER  68  12.823  -7.638 -12.358
   15    HG   SER  68           HG       SER  68  13.221  -6.550 -14.355
   16    H    GLY  69           H        GLY  69  12.840  -4.828  -8.800
   17    HA2  GLY  69           HA2      GLY  69  13.127  -5.552  -6.631
   18    HA3  GLY  69           HA3      GLY  69  12.413  -7.076  -7.146
   19    H    ARG  70           H        ARG  70  13.659  -8.781  -6.740
   20    HA   ARG  70           HA       ARG  70  16.572  -8.566  -6.284
   21    HB2  ARG  70           HB2      ARG  70  14.650 -10.926  -6.091
   22    HB3  ARG  70           HB3      ARG  70  16.369 -10.974  -5.676
   23    HG2  ARG  70           HG2      ARG  70  16.017  -9.205  -3.962
   24    HG3  ARG  70           HG3      ARG  70  14.284  -9.210  -4.320
   25    HD2  ARG  70           HD2      ARG  70  14.160 -11.614  -3.669
   26    HD3  ARG  70           HD3      ARG  70  15.892 -11.598  -3.335
   27    HE   ARG  70           HE       ARG  70  15.558 -10.394  -1.375
   28   HH11  ARG  70          HH11      ARG  70  12.439 -10.608  -2.993
   29   HH12  ARG  70          HH12      ARG  70  11.583 -10.040  -1.589
   30   HH21  ARG  70          HH21      ARG  70  14.393  -9.683   0.365
   31   HH22  ARG  70          HH22      ARG  70  12.661  -9.543   0.267
   32    H    GLY  71           H        GLY  71  14.792  -8.930  -9.091
   33    HA2  GLY  71           HA2      GLY  71  15.486  -9.331 -11.248
   34    HA3  GLY  71           HA3      GLY  71  17.114  -9.633 -10.654
   35    H    ARG  72           H        ARG  72  14.615 -11.628  -9.279
   36    HA   ARG  72           HA       ARG  72  15.741 -14.019 -10.648
   37    HB2  ARG  72           HB2      ARG  72  13.876 -13.849  -8.250
   38    HB3  ARG  72           HB3      ARG  72  14.711 -15.286  -8.829
   39    HG2  ARG  72           HG2      ARG  72  15.996 -12.827  -7.581
   40    HG3  ARG  72           HG3      ARG  72  15.815 -14.425  -6.861
   41    HD2  ARG  72           HD2      ARG  72  17.299 -15.377  -8.629
   42    HD3  ARG  72           HD3      ARG  72  17.520 -13.741  -9.289
   43    HE   ARG  72           HE       ARG  72  18.172 -13.716  -6.509
   44   HH11  ARG  72          HH11      ARG  72  19.535 -14.943  -9.496
   45   HH12  ARG  72          HH12      ARG  72  21.169 -14.857  -8.897
   46   HH21  ARG  72          HH21      ARG  72  20.277 -13.618  -5.809
   47   HH22  ARG  72          HH22      ARG  72  21.569 -14.127  -6.854
   48    H    GLY  73           H        GLY  73  13.110 -12.069 -11.218
   49    HA2  GLY  73           HA2      GLY  73  11.402 -12.308 -12.775
   50    HA3  GLY  73           HA3      GLY  73  11.852 -13.989 -13.035
   51    H    ALA  74           H        ALA  74   9.272 -13.490 -13.083
   52    HA   ALA  74           HA       ALA  74   7.984 -13.733 -10.459
   53    HB1  ALA  74           HB1      ALA  74   5.912 -13.546 -11.757
   54    HB2  ALA  74           HB2      ALA  74   7.059 -12.287 -12.231
   55    HB3  ALA  74           HB3      ALA  74   6.819 -13.711 -13.273
   56    H    ILE  75           H        ILE  75   6.409 -15.355  -9.978
   57    HA   ILE  75           HA       ILE  75   5.909 -17.468  -9.383
   58    HB   ILE  75           HB       ILE  75   5.843 -18.008 -12.317
   59   HG12  ILE  75          HG12      ILE  75   3.789 -16.430 -10.704
   60   HG13  ILE  75          HG13      ILE  75   4.796 -15.809 -12.013
   61   HG21  ILE  75          HG21      ILE  75   3.951 -18.892 -10.072
   62   HG22  ILE  75          HG22      ILE  75   3.944 -19.485 -11.744
   63   HG23  ILE  75          HG23      ILE  75   5.270 -19.902 -10.677
   64   HD11  ILE  75          HD11      ILE  75   3.662 -17.381 -13.606
   65   HD12  ILE  75          HD12      ILE  75   2.521 -17.791 -12.296
   66   HD13  ILE  75          HD13      ILE  75   2.615 -16.135 -12.897
   67    H    ASP  76           H        ASP  76   8.255 -17.427  -8.723
   68    HA   ASP  76           HA       ASP  76  10.012 -19.447  -9.877
   69    HB2  ASP  76           HB2      ASP  76  10.855 -17.416  -8.753
   70    HB3  ASP  76           HB3      ASP  76  10.188 -17.988  -7.221
   71    H    ARG  77           H        ARG  77   7.892 -20.810  -9.742
   72    HA   ARG  77           HA       ARG  77   6.513 -22.380  -8.934
   73    HB2  ARG  77           HB2      ARG  77   7.444 -24.443  -8.357
   74    HB3  ARG  77           HB3      ARG  77   8.473 -23.690  -9.552
   75    HG2  ARG  77           HG2      ARG  77   9.233 -23.382  -6.637
   76    HG3  ARG  77           HG3      ARG  77   9.389 -24.970  -7.385
   77    HD2  ARG  77           HD2      ARG  77  10.814 -24.068  -9.156
   78    HD3  ARG  77           HD3      ARG  77  10.729 -22.456  -8.462
   79    HE   ARG  77           HE       ARG  77  12.341 -24.701  -7.547
   80   HH11  ARG  77          HH21      ARG  77  10.939 -21.675  -6.447
   81   HH12  ARG  77          HH22      ARG  77  12.105 -21.506  -5.162
   82   HH21  ARG  77          HH11      ARG  77  13.773 -24.433  -5.873
   83   HH22  ARG  77          HH12      ARG  77  13.642 -23.051  -4.824
   84    H    GLU  78           H        GLU  78   6.885 -20.138  -6.986
   85    HA   GLU  78           HA       GLU  78   6.713 -21.220  -4.349
   86    HB2  GLU  78           HB2      GLU  78   5.720 -18.546  -5.417
   87    HB3  GLU  78           HB3      GLU  78   5.871 -18.977  -3.708
   88    HG2  GLU  78           HG2      GLU  78   8.330 -19.370  -4.081
   89    HG3  GLU  78           HG3      GLU  78   8.138 -18.754  -5.727
   90    H    GLN  79           H        GLN  79   4.037 -20.030  -6.461
   91    HA   GLN  79           HA       GLN  79   2.000 -20.790  -4.585
   92    HB2  GLN  79           HB2      GLN  79   0.411 -20.266  -6.321
   93    HB3  GLN  79           HB3      GLN  79   1.651 -19.026  -6.190
   94    HG2  GLN  79           HG2      GLN  79   2.775 -19.996  -8.232
   95    HG3  GLN  79           HG3      GLN  79   1.440 -21.141  -8.377
   96   HE21  GLN  79          HE22      GLN  79  -0.748 -20.275  -8.908
   97   HE22  GLN  79          HE21      GLN  79  -0.858 -18.681  -9.639
   98    H    SER  80           H        SER  80   3.386 -22.552  -7.375
   99    HA   SER  80           HA       SER  80   1.505 -24.738  -7.242
  100    HB2  SER  80           HB2      SER  80   3.210 -25.932  -8.636
  101    HB3  SER  80           HB3      SER  80   2.669 -24.368  -9.279
  102    HG   SER  80           HG       SER  80   4.971 -24.626  -9.365
  103    H    ALA  81           H        ALA  81   4.841 -24.348  -5.826
  104    HA   ALA  81           HA       ALA  81   4.836 -26.747  -4.405
  105    HB1  ALA  81           HB1      ALA  81   6.810 -25.321  -4.662
  106    HB2  ALA  81           HB2      ALA  81   6.071 -24.070  -3.644
  107    HB3  ALA  81           HB3      ALA  81   6.506 -25.647  -2.948
  108    H    ALA  82           H        ALA  82   3.444 -23.572  -3.362
  109    HA   ALA  82           HA       ALA  82   2.572 -24.436  -0.802
  110    HB1  ALA  82           HB1      ALA  82   1.380 -22.309  -2.628
  111    HB2  ALA  82           HB2      ALA  82   1.111 -22.466  -0.883
  112    HB3  ALA  82           HB3      ALA  82   2.730 -22.075  -1.494
  113    H    ILE  83           H        ILE  83   0.820 -24.542  -3.949
  114    HA   ILE  83           HA       ILE  83  -1.594 -25.691  -2.891
  115    HB   ILE  83           HB       ILE  83  -0.398 -25.614  -5.684
  116   HG12  ILE  83          HG12      ILE  83  -2.798 -24.130  -4.543
  117   HG13  ILE  83          HG13      ILE  83  -1.189 -23.459  -4.449
  118   HG21  ILE  83          HG21      ILE  83  -1.929 -27.552  -5.608
  119   HG22  ILE  83          HG22      ILE  83  -3.186 -26.553  -4.845
  120   HG23  ILE  83          HG23      ILE  83  -2.674 -26.247  -6.517
  121   HD11  ILE  83          HD11      ILE  83  -1.044 -23.590  -6.971
  122   HD12  ILE  83          HD12      ILE  83  -2.766 -24.032  -6.966
  123   HD13  ILE  83          HD13      ILE  83  -2.257 -22.467  -6.322
  124    H    ARG  84           H        ARG  84   1.340 -27.229  -4.277
  125    HA   ARG  84           HA       ARG  84   0.380 -29.942  -4.004
  126    HB2  ARG  84           HB2      ARG  84   2.170 -29.348  -5.503
  127    HB3  ARG  84           HB3      ARG  84   3.191 -28.775  -4.192
  128    HG2  ARG  84           HG2      ARG  84   3.879 -30.884  -3.618
  129    HG3  ARG  84           HG3      ARG  84   2.292 -31.599  -3.876
  130    HD2  ARG  84           HD2      ARG  84   3.944 -32.500  -5.452
  131    HD3  ARG  84           HD3      ARG  84   2.587 -31.682  -6.242
  132    HE   ARG  84           HE       ARG  84   5.022 -30.049  -5.832
  133   HH11  ARG  84          HH11      ARG  84   3.452 -32.227  -8.077
  134   HH12  ARG  84          HH12      ARG  84   4.111 -31.424  -9.488
  135   HH21  ARG  84          HH21      ARG  84   5.932 -29.130  -7.676
  136   HH22  ARG  84          HH22      ARG  84   5.560 -29.792  -9.240
  137    H    GLU  85           H        GLU  85   2.448 -27.985  -1.761
  138    HA   GLU  85           HA       GLU  85   2.518 -29.891   0.293
  139    HB2  GLU  85           HB2      GLU  85   3.942 -27.848   0.060
  140    HB3  GLU  85           HB3      GLU  85   2.564 -26.912   0.652
  141    HG2  GLU  85           HG2      GLU  85   3.907 -27.371   2.558
  142    HG3  GLU  85           HG3      GLU  85   2.494 -28.429   2.650
  143    H    TRP  86           H        TRP  86   0.062 -27.261  -0.193
  144    HA   TRP  86           HA       TRP  86  -1.564 -27.892   1.962
  145    HB2  TRP  86           HB2      TRP  86  -1.940 -25.915   0.627
  146    HB3  TRP  86           HB3      TRP  86  -2.260 -26.874  -0.808
  147    HD1  TRP  86           HD1      TRP  86  -3.884 -25.694   2.415
  148    HE1  TRP  86           HE1      TRP  86  -6.384 -26.259   2.420
  149    HE3  TRP  86           HE3      TRP  86  -4.127 -28.375  -1.950
  150    HZ2  TRP  86           HZ2      TRP  86  -8.172 -27.975   0.928
  151    HZ3  TRP  86           HZ3      TRP  86  -6.232 -29.541  -2.587
  152    HH2  TRP  86           HH2      TRP  86  -8.240 -29.383  -1.125
  153    H    ALA  87           H        ALA  87  -1.722 -29.303  -1.357
  154    HA   ALA  87           HA       ALA  87  -3.879 -31.064  -0.780
  155    HB1  ALA  87           HB1      ALA  87  -3.157 -32.166  -2.924
  156    HB2  ALA  87           HB2      ALA  87  -3.201 -30.389  -3.039
  157    HB3  ALA  87           HB3      ALA  87  -1.648 -31.226  -2.870
  158    H    ARG  88           H        ARG  88  -0.356 -31.646  -0.663
  159    HA   ARG  88           HA       ARG  88  -0.250 -34.350   0.153
  160    HB2  ARG  88           HB2      ARG  88   1.653 -32.938  -0.545
  161    HB3  ARG  88           HB3      ARG  88   1.473 -31.950   0.898
  162    HG2  ARG  88           HG2      ARG  88   2.037 -34.026   2.278
  163    HG3  ARG  88           HG3      ARG  88   2.426 -34.829   0.732
  164    HD2  ARG  88           HD2      ARG  88   4.029 -32.943   0.237
  165    HD3  ARG  88           HD3      ARG  88   3.616 -32.235   1.812
  166    HE   ARG  88           HE       ARG  88   4.586 -34.971   2.021
  167   HH11  ARG  88          HH11      ARG  88   5.643 -31.605   1.885
  168   HH12  ARG  88          HH12      ARG  88   7.207 -32.003   2.550
  169   HH21  ARG  88          HH21      ARG  88   6.596 -35.367   2.907
  170   HH22  ARG  88          HH22      ARG  88   7.720 -34.060   3.127
  171    H    ARG  89           H        ARG  89  -0.609 -31.428   2.209
  172    HA   ARG  89           HA       ARG  89  -0.797 -32.964   4.696
  173    HB2  ARG  89           HB2      ARG  89  -1.259 -30.028   4.037
  174    HB3  ARG  89           HB3      ARG  89  -1.348 -30.708   5.671
  175    HG2  ARG  89           HG2      ARG  89   0.988 -31.514   5.504
  176    HG3  ARG  89           HG3      ARG  89   1.114 -30.859   3.869
  177    HD2  ARG  89           HD2      ARG  89   0.628 -28.573   4.801
  178    HD3  ARG  89           HD3      ARG  89   0.676 -29.289   6.430
  179    HE   ARG  89           HE       ARG  89   3.022 -29.703   4.623
  180   HH11  ARG  89          HH11      ARG  89   1.911 -27.933   7.462
  181   HH12  ARG  89          HH12      ARG  89   3.542 -27.474   7.868
  182   HH21  ARG  89          HH21      ARG  89   4.899 -29.116   5.123
  183   HH22  ARG  89          HH22      ARG  89   5.261 -28.150   6.559
  184    H    ASN  90           H        ASN  90  -3.200 -31.839   2.412
  185    HA   ASN  90           HA       ASN  90  -5.424 -32.579   4.238
  186    HB2  ASN  90           HB2      ASN  90  -5.284 -31.302   1.482
  187    HB3  ASN  90           HB3      ASN  90  -6.796 -31.868   2.176
  188   HD21  ASN  90          HD22      ASN  90  -4.198 -29.522   2.570
  189   HD22  ASN  90          HD21      ASN  90  -5.088 -28.493   3.695
  190    H    GLY  91           H        GLY  91  -3.427 -34.351   2.149
  191    HA2  GLY  91           HA2      GLY  91  -3.550 -36.544   1.442
  192    HA3  GLY  91           HA3      GLY  91  -5.122 -36.716   2.233
  193    H    HIS  92           H        HIS  92  -4.622 -34.148  -0.123
  194    HA   HIS  92           HA       HIS  92  -6.700 -35.333  -1.877
  195    HB2  HIS  92           HB2      HIS  92  -6.741 -32.918  -1.027
  196    HB3  HIS  92           HB3      HIS  92  -5.419 -32.584  -2.132
  197    HD1  HIS  92           HD1      HIS  92  -9.171 -33.193  -2.044
  198    HD2  HIS  92           HD2      HIS  92  -6.048 -32.707  -4.850
  199    HE1  HIS  92           HE1      HIS  92 -10.293 -32.760  -4.325
  200    HE2  HIS  92           HE2      HIS  92  -8.403 -32.471  -6.033
  201    H    ASN  93           H        ASN  93  -6.406 -35.734  -4.108
  202    HA   ASN  93           HA       ASN  93  -3.898 -36.913  -4.781
  203    HB2  ASN  93           HB2      ASN  93  -6.144 -37.654  -5.576
  204    HB3  ASN  93           HB3      ASN  93  -6.268 -36.200  -6.570
  205   HD21  ASN  93          HD22      ASN  93  -6.634 -38.097  -8.173
  206   HD22  ASN  93          HD21      ASN  93  -5.185 -38.688  -8.967
  207    H    VAL  94           H        VAL  94  -2.091 -36.100  -5.640
  208    HA   VAL  94           HA       VAL  94  -2.083 -34.031  -7.671
  209    HB   VAL  94           HB       VAL  94  -2.104 -32.685  -5.557
  210   HG11  VAL  94          HG11      VAL  94   0.686 -33.802  -5.055
  211   HG12  VAL  94          HG12      VAL  94  -0.125 -32.514  -4.154
  212   HG13  VAL  94          HG13      VAL  94  -0.765 -34.164  -4.089
  213   HG21  VAL  94          HG21      VAL  94  -0.382 -31.133  -6.211
  214   HG22  VAL  94          HG22      VAL  94   0.474 -32.378  -7.143
  215   HG23  VAL  94          HG23      VAL  94  -1.133 -31.814  -7.661
  216    H    SER  95           H        SER  95  -0.151 -34.090  -8.947
  217    HA   SER  95           HA       SER  95   1.411 -36.522  -8.773
  218    HB2  SER  95           HB2      SER  95   1.010 -35.408 -10.942
  219    HB3  SER  95           HB3      SER  95   1.941 -34.003 -10.393
  220    HG   SER  95           HG       SER  95   2.827 -36.595 -11.079
  221    H    THR  96           H        THR  96   3.495 -36.852  -7.987
  222    HA   THR  96           HA       THR  96   4.557 -34.970  -6.019
  223    HB   THR  96           HB       THR  96   6.339 -36.712  -5.772
  224    HG1  THR  96           HG1      THR  96   6.002 -38.670  -6.889
  225   HG21  THR  96          HG21      THR  96   3.494 -37.811  -5.670
  226   HG22  THR  96          HG22      THR  96   4.899 -38.414  -4.765
  227   HG23  THR  96          HG23      THR  96   4.247 -36.807  -4.418
  228    H    ARG  97           H        ARG  97   5.150 -35.544  -9.385
  229    HA   ARG  97           HA       ARG  97   7.590 -33.777  -9.324
  230    HB2  ARG  97           HB2      ARG  97   8.119 -36.228  -9.410
  231    HB3  ARG  97           HB3      ARG  97   7.250 -36.340 -10.943
  232    HG2  ARG  97           HG2      ARG  97   8.850 -34.784 -11.993
  233    HG3  ARG  97           HG3      ARG  97   9.680 -34.549 -10.447
  234    HD2  ARG  97           HD2      ARG  97   9.420 -37.210 -11.906
  235    HD3  ARG  97           HD3      ARG  97  10.818 -36.127 -12.034
  236    HE   ARG  97           HE       ARG  97  10.468 -36.576  -9.288
  237   HH11  ARG  97          HH11      ARG  97  11.293 -38.560 -12.058
  238   HH12  ARG  97          HH12      ARG  97  12.193 -39.697 -11.092
  239   HH21  ARG  97          HH21      ARG  97  11.619 -38.075  -8.111
  240   HH22  ARG  97          HH22      ARG  97  12.373 -39.419  -8.913
  241    H    GLY  98           H        GLY  98   4.751 -34.788 -11.169
  242    HA2  GLY  98           HA2      GLY  98   5.364 -33.194 -13.536
  243    HA3  GLY  98           HA3      GLY  98   3.873 -34.059 -13.176
  244    H    ARG  99           H        ARG  99   3.183 -31.995 -14.300
  245    HA   ARG  99           HA       ARG  99   2.946 -29.546 -12.722
  246    HB2  ARG  99           HB2      ARG  99   1.521 -30.484 -15.253
  247    HB3  ARG  99           HB3      ARG  99   1.344 -28.877 -14.543
  248    HG2  ARG  99           HG2      ARG  99   3.789 -28.487 -14.790
  249    HG3  ARG  99           HG3      ARG  99   3.960 -30.048 -15.604
  250    HD2  ARG  99           HD2      ARG  99   2.193 -27.755 -16.560
  251    HD3  ARG  99           HD3      ARG  99   3.825 -28.099 -17.159
  252    HE   ARG  99           HE       ARG  99   2.420 -30.494 -17.489
  253   HH11  ARG  99          HH11      ARG  99   2.136 -27.254 -18.790
  254   HH12  ARG  99          HH12      ARG  99   1.393 -27.812 -20.266
  255   HH21  ARG  99          HH21      ARG  99   1.461 -31.140 -19.386
  256   HH22  ARG  99          HH22      ARG  99   1.039 -29.963 -20.596
  257    H    ILE 100           H        ILE 100   0.925 -28.614 -12.049
  258    HA   ILE 100           HA       ILE 100  -0.659 -30.584 -10.513
  259    HB   ILE 100           HB       ILE 100  -0.475 -27.582 -10.257
  260   HG12  ILE 100          HG12      ILE 100   0.739 -29.930  -8.721
  261   HG13  ILE 100          HG13      ILE 100   1.602 -28.706  -9.655
  262   HG21  ILE 100          HG21      ILE 100  -2.708 -28.455  -9.510
  263   HG22  ILE 100          HG22      ILE 100  -1.879 -29.618  -8.455
  264   HG23  ILE 100          HG23      ILE 100  -1.752 -27.868  -8.172
  265   HD11  ILE 100          HD11      ILE 100   0.713 -26.970  -8.019
  266   HD12  ILE 100          HD12      ILE 100   0.205 -28.349  -7.006
  267   HD13  ILE 100          HD13      ILE 100   1.921 -28.126  -7.415
  268    HA   PRO 101           HA       PRO 101  -4.038 -29.873 -13.462
  269    HB2  PRO 101           HB2      PRO 101  -5.908 -31.589 -12.399
  270    HB3  PRO 101           HB3      PRO 101  -4.515 -32.100 -13.400
  271    HG2  PRO 101           HG2      PRO 101  -4.832 -32.229 -10.417
  272    HG3  PRO 101           HG3      PRO 101  -4.052 -33.399 -11.507
  273    HD2  PRO 101           HD2      PRO 101  -2.677 -31.506  -9.993
  274    HD3  PRO 101           HD3      PRO 101  -2.059 -32.232 -11.505
  275    H    ALA 102           H        ALA 102  -5.979 -28.734 -13.533
  276    HA   ALA 102           HA       ALA 102  -6.172 -26.618 -11.762
  277    HB1  ALA 102           HB1      ALA 102  -8.295 -27.635 -13.671
  278    HB2  ALA 102           HB2      ALA 102  -8.145 -25.987 -13.009
  279    HB3  ALA 102           HB3      ALA 102  -6.898 -26.611 -14.110
  280    H    ASP 103           H        ASP 103  -7.866 -29.698 -11.498
  281    HA   ASP 103           HA       ASP 103  -9.898 -29.125  -9.729
  282    HB2  ASP 103           HB2      ASP 103  -9.545 -31.323 -10.699
  283    HB3  ASP 103           HB3      ASP 103  -7.986 -31.486  -9.886
  284    H    VAL 104           H        VAL 104  -6.418 -29.602  -9.005
  285    HA   VAL 104           HA       VAL 104  -6.790 -29.415  -6.156
  286    HB   VAL 104           HB       VAL 104  -4.126 -29.008  -7.431
  287   HG11  VAL 104          HG11      VAL 104  -3.318 -30.282  -5.495
  288   HG12  VAL 104          HG12      VAL 104  -4.279 -28.892  -4.972
  289   HG13  VAL 104          HG13      VAL 104  -4.993 -30.515  -4.939
  290   HG21  VAL 104          HG21      VAL 104  -3.791 -31.495  -7.492
  291   HG22  VAL 104          HG22      VAL 104  -5.533 -31.694  -7.213
  292   HG23  VAL 104          HG23      VAL 104  -4.947 -30.905  -8.690
  293    H    ILE 105           H        ILE 105  -5.801 -27.203  -8.716
  294    HA   ILE 105           HA       ILE 105  -5.028 -24.965  -7.051
  295    HB   ILE 105           HB       ILE 105  -5.994 -25.217  -9.929
  296   HG12  ILE 105          HG12      ILE 105  -3.211 -24.320  -9.168
  297   HG13  ILE 105          HG13      ILE 105  -3.582 -26.009  -8.861
  298   HG21  ILE 105          HG21      ILE 105  -5.101 -22.897 -10.265
  299   HG22  ILE 105          HG22      ILE 105  -6.557 -22.954  -9.271
  300   HG23  ILE 105          HG23      ILE 105  -4.964 -22.731  -8.497
  301   HD11  ILE 105          HD11      ILE 105  -2.533 -25.618 -11.070
  302   HD12  ILE 105          HD12      ILE 105  -4.103 -26.427 -11.150
  303   HD13  ILE 105          HD13      ILE 105  -3.974 -24.697 -11.572
  304    H    ASP 106           H        ASP 106  -8.179 -25.807  -8.630
  305    HA   ASP 106           HA       ASP 106  -9.691 -23.794  -7.432
  306    HB2  ASP 106           HB2      ASP 106 -10.428 -25.167  -9.326
  307    HB3  ASP 106           HB3      ASP 106 -10.495 -26.594  -8.290
  308    H    ALA 107           H        ALA 107  -9.103 -27.174  -6.258
  309    HA   ALA 107           HA       ALA 107 -10.525 -27.082  -3.921
  310    HB1  ALA 107           HB1      ALA 107  -7.863 -28.487  -4.461
  311    HB2  ALA 107           HB2      ALA 107  -9.035 -28.915  -3.195
  312    HB3  ALA 107           HB3      ALA 107  -9.476 -29.105  -4.887
  313    H    TYR 108           H        TYR 108  -7.093 -26.077  -4.339
  314    HA   TYR 108           HA       TYR 108  -6.621 -25.175  -1.679
  315    HB2  TYR 108           HB2      TYR 108  -4.828 -25.532  -3.248
  316    HB3  TYR 108           HB3      TYR 108  -5.480 -24.354  -4.373
  317    HD1  TYR 108           HD2      TYR 108  -3.857 -24.763  -1.055
  318    HD2  TYR 108           HD1      TYR 108  -5.022 -21.995  -4.151
  319    HE1  TYR 108           HE2      TYR 108  -2.429 -23.002  -0.016
  320    HE2  TYR 108           HE1      TYR 108  -3.605 -20.235  -3.108
  321    HH   TYR 108           HH       TYR 108  -2.136 -19.709  -1.410
  322    H    HIS 109           H        HIS 109  -7.790 -23.291  -4.560
  323    HA   HIS 109           HA       HIS 109  -8.133 -20.868  -3.076
  324    HB2  HIS 109           HB2      HIS 109  -9.302 -21.841  -5.702
  325    HB3  HIS 109           HB3      HIS 109  -9.757 -20.289  -4.997
  326    HD1  HIS 109           HD1      HIS 109  -7.411 -18.701  -4.299
  327    HD2  HIS 109           HD2      HIS 109  -7.309 -21.596  -7.364
  328    HE1  HIS 109           HE1      HIS 109  -5.411 -18.093  -5.797
  329    HE2  HIS 109           HE2      HIS 109  -5.349 -19.857  -7.671
  330    H    ALA 110           H        ALA 110 -10.453 -23.568  -3.526
  331    HA   ALA 110           HA       ALA 110 -12.617 -22.275  -2.180
  332    HB1  ALA 110           HB1      ALA 110 -13.479 -24.579  -1.939
  333    HB2  ALA 110           HB2      ALA 110 -12.866 -24.292  -3.576
  334    HB3  ALA 110           HB3      ALA 110 -11.901 -25.235  -2.421
  335    H    ALA 111           H        ALA 111  -9.913 -24.305  -0.879
  336    HA   ALA 111           HA       ALA 111 -10.772 -24.247   1.768
  337    HB1  ALA 111           HB1      ALA 111  -8.491 -25.004   2.275
  338    HB2  ALA 111           HB2      ALA 111  -9.126 -25.819   0.832
  339    HB3  ALA 111           HB3      ALA 111  -7.948 -24.497   0.657
  340    H    THR 112           H        THR 112  -8.623 -21.951   0.010
  341    HA   THR 112           HA       THR 112  -8.128 -20.345   2.390
  342    HB   THR 112           HB       THR 112  -7.067 -18.734   0.890
  343    HG1  THR 112           HG1      THR 112  -6.911 -19.198  -1.293
  344   HG21  THR 112          HG21      THR 112  -6.215 -21.600   0.290
  345   HG22  THR 112          HG22      THR 112  -5.217 -20.141   0.146
  346   HG23  THR 112          HG23      THR 112  -5.774 -20.674   1.739
  347    H    LEU 113           H        LEU 113 -10.471 -19.996  -0.320
  348    HA   LEU 113           HA       LEU 113 -11.362 -17.413   0.627
  349    HB2  LEU 113           HB2      LEU 113 -11.278 -18.008  -1.747
  350    HB3  LEU 113           HB3      LEU 113 -12.408 -19.341  -1.470
  351    HG   LEU 113           HG       LEU 113 -14.165 -17.790  -0.853
  352   HD11  LEU 113          HD11      LEU 113 -12.187 -15.594  -1.626
  353   HD12  LEU 113          HD12      LEU 113 -13.924 -15.351  -1.354
  354   HD13  LEU 113          HD13      LEU 113 -12.888 -15.849  -0.011
  355   HD21  LEU 113          HD21      LEU 113 -14.587 -16.897  -3.105
  356   HD22  LEU 113          HD22      LEU 113 -12.878 -17.137  -3.536
  357   HD23  LEU 113          HD23      LEU 113 -13.919 -18.536  -3.183
  358    H    GLU 114           H        GLU 114 -12.848 -20.664   0.578
  359    HA   GLU 114           HA       GLU 114 -15.147 -19.640   2.171
  360    HB2  GLU 114           HB2      GLU 114 -14.760 -22.297   0.741
  361    HB3  GLU 114           HB3      GLU 114 -16.211 -21.767   1.584
  362    HG2  GLU 114           HG2      GLU 114 -16.387 -19.817   0.010
  363    HG3  GLU 114           HG3      GLU 114 -15.025 -20.479  -0.907
  364    H    HIS 115           H        HIS 115 -12.581 -22.038   2.438
  365    HA   HIS 115           HA       HIS 115 -11.914 -23.546   3.906
  366    HB2  HIS 115           HB2      HIS 115 -11.145 -22.806   5.846
  367    HB3  HIS 115           HB3      HIS 115 -11.480 -21.281   5.054
  368    HD1  HIS 115           HD1      HIS 115 -14.400 -20.625   5.885
  369    HD2  HIS 115           HD2      HIS 115 -11.526 -22.501   8.343
  370    HE1  HIS 115           HE1      HIS 115 -15.056 -20.078   8.328
  371    HE2  HIS 115           HE2      HIS 115 -13.304 -21.244   9.815
  372    H    HIS 116           H        HIS 116 -15.278 -22.935   4.321
  373    HA   HIS 116           HA       HIS 116 -15.651 -25.789   5.187
  374    HB2  HIS 116           HB2      HIS 116 -17.466 -23.388   5.708
  375    HB3  HIS 116           HB3      HIS 116 -17.816 -25.053   6.158
  376    HD1  HIS 116           HD1      HIS 116 -17.541 -22.588   8.240
  377    HD2  HIS 116           HD2      HIS 116 -14.813 -25.710   7.433
  378    HE1  HIS 116           HE1      HIS 116 -16.121 -22.892  10.369
  379    HE2  HIS 116           HE2      HIS 116 -14.453 -24.786   9.857
  380    H    HIS 117           H        HIS 117 -15.121 -25.393   2.587
  381    HA   HIS 117           HA       HIS 117 -16.974 -24.508   0.749
  382    HB2  HIS 117           HB2      HIS 117 -14.694 -25.133   0.202
  383    HB3  HIS 117           HB3      HIS 117 -15.003 -26.824   0.576
  384    HD1  HIS 117           HD1      HIS 117 -16.315 -24.210  -2.037
  385    HD2  HIS 117           HD2      HIS 117 -15.489 -28.327  -1.474
  386    HE1  HIS 117           HE1      HIS 117 -16.745 -25.363  -4.300
  387    HE2  HIS 117           HE2      HIS 117 -16.234 -27.866  -3.954
  388    H    HIS 118           H        HIS 118 -17.225 -27.709   2.308
  389    HA   HIS 118           HA       HIS 118 -19.301 -28.706   0.584
  390    HB2  HIS 118           HB2      HIS 118 -19.641 -30.427   2.280
  391    HB3  HIS 118           HB3      HIS 118 -17.945 -30.202   1.907
  392    HD1  HIS 118           HD1      HIS 118 -20.424 -29.854   4.822
  393    HD2  HIS 118           HD2      HIS 118 -16.315 -29.416   3.889
  394    HE1  HIS 118           HE1      HIS 118 -19.194 -29.571   7.053
  395    HE2  HIS 118           HE2      HIS 118 -16.688 -29.324   6.487
  396    H    HIS 119           H        HIS 119 -19.503 -26.535   3.302
  397    HA   HIS 119           HA       HIS 119 -21.087 -25.497   4.470
  398    HB2  HIS 119           HB2      HIS 119 -22.550 -25.606   1.811
  399    HB3  HIS 119           HB3      HIS 119 -23.039 -24.611   3.175
  400    HD1  HIS 119           HD1      HIS 119 -21.079 -22.748   4.014
  401    HD2  HIS 119           HD2      HIS 119 -20.777 -24.515   0.187
  402    HE1  HIS 119           HE1      HIS 119 -19.461 -21.270   2.648
  403    HE2  HIS 119           HE2      HIS 119 -19.278 -22.348   0.315
  404    H    HIS 120           H        HIS 120 -22.894 -28.107   2.816
  405    HA   HIS 120           HA       HIS 120 -24.822 -28.457   4.975
  406    HB2  HIS 120           HB2      HIS 120 -24.035 -30.331   2.708
  407    HB3  HIS 120           HB3      HIS 120 -25.474 -30.458   3.711
  408    HD1  HIS 120           HD1      HIS 120 -24.518 -29.157   0.425
  409    HD2  HIS 120           HD2      HIS 120 -27.104 -28.018   3.570
  410    HE1  HIS 120           HE1      HIS 120 -26.230 -27.522  -0.595
  411    HE2  HIS 120           HE2      HIS 120 -27.803 -26.833   1.330
  Start of MODEL   12
    1    H1   SER  66           H1       SER  66  -4.505  -2.275 -26.326
    2    H2   SER  66           H2       SER  66  -4.362  -0.847 -27.116
    3    H3   SER  66           H3       SER  66  -3.063  -1.825 -26.957
    4    HA   SER  66           HA       SER  66  -2.880   0.023 -25.443
    5    HB2  SER  66           HB2      SER  66  -5.384   0.321 -25.238
    6    HB3  SER  66           HB3      SER  66  -5.396  -1.043 -24.099
    7    HG   SER  66           HG       SER  66  -5.209   1.022 -23.057
    8    H    GLY  67           H        GLY  67  -2.020  -0.205 -23.225
    9    HA2  GLY  67           HA2      GLY  67  -0.837  -1.307 -21.583
   10    HA3  GLY  67           HA3      GLY  67  -1.762  -2.765 -21.920
   11    H    SER  68           H        SER  68   0.368  -3.711 -21.352
   12    HA   SER  68           HA       SER  68   2.613  -3.441 -23.166
   13    HB2  SER  68           HB2      SER  68   3.705  -5.073 -21.805
   14    HB3  SER  68           HB3      SER  68   2.851  -3.945 -20.749
   15    HG   SER  68           HG       SER  68   1.230  -5.516 -20.427
   16    H    GLY  69           H        GLY  69  -0.208  -5.407 -23.356
   17    HA2  GLY  69           HA2      GLY  69  -0.878  -6.905 -24.983
   18    HA3  GLY  69           HA3      GLY  69   0.683  -6.727 -25.790
   19    H    ARG  70           H        ARG  70   1.153  -7.617 -22.531
   20    HA   ARG  70           HA       ARG  70   2.072 -10.304 -23.283
   21    HB2  ARG  70           HB2      ARG  70   2.055  -8.797 -20.639
   22    HB3  ARG  70           HB3      ARG  70   2.805 -10.377 -20.885
   23    HG2  ARG  70           HG2      ARG  70   4.328  -9.462 -22.573
   24    HG3  ARG  70           HG3      ARG  70   3.611  -7.854 -22.418
   25    HD2  ARG  70           HD2      ARG  70   5.000  -9.367 -20.170
   26    HD3  ARG  70           HD3      ARG  70   5.748  -8.107 -21.173
   27    HE   ARG  70           HE       ARG  70   3.410  -6.956 -20.153
   28   HH11  ARG  70          HH11      ARG  70   6.395  -8.160 -18.752
   29   HH12  ARG  70          HH12      ARG  70   6.284  -7.096 -17.374
   30   HH21  ARG  70          HH21      ARG  70   3.316  -5.655 -18.373
   31   HH22  ARG  70          HH22      ARG  70   4.579  -5.702 -17.174
   32    H    GLY  71           H        GLY  71  -0.913  -9.157 -22.037
   33    HA2  GLY  71           HA2      GLY  71  -2.859 -10.319 -21.514
   34    HA3  GLY  71           HA3      GLY  71  -2.072 -11.799 -22.044
   35    H    ARG  72           H        ARG  72  -2.417 -13.218 -20.456
   36    HA   ARG  72           HA       ARG  72  -2.488 -12.465 -17.598
   37    HB2  ARG  72           HB2      ARG  72  -2.981 -15.121 -19.011
   38    HB3  ARG  72           HB3      ARG  72  -3.130 -14.861 -17.273
   39    HG2  ARG  72           HG2      ARG  72  -4.901 -13.154 -17.660
   40    HG3  ARG  72           HG3      ARG  72  -4.764 -13.410 -19.402
   41    HD2  ARG  72           HD2      ARG  72  -6.670 -14.656 -18.612
   42    HD3  ARG  72           HD3      ARG  72  -5.423 -15.782 -19.123
   43    HE   ARG  72           HE       ARG  72  -5.162 -16.539 -16.943
   44   HH11  ARG  72          HH11      ARG  72  -7.237 -13.707 -16.789
   45   HH12  ARG  72          HH12      ARG  72  -7.674 -14.010 -15.131
   46   HH21  ARG  72          HH21      ARG  72  -5.748 -16.848 -14.832
   47   HH22  ARG  72          HH22      ARG  72  -6.845 -15.749 -14.052
   48    H    GLY  73           H        GLY  73  -1.239 -13.346 -15.964
   49    HA2  GLY  73           HA2      GLY  73   1.572 -13.839 -16.546
   50    HA3  GLY  73           HA3      GLY  73   0.798 -13.828 -14.965
   51    H    ALA  74           H        ALA  74   2.705 -15.628 -15.314
   52    HA   ALA  74           HA       ALA  74   1.289 -18.223 -15.198
   53    HB1  ALA  74           HB1      ALA  74   3.790 -17.722 -16.879
   54    HB2  ALA  74           HB2      ALA  74   3.033 -19.303 -16.597
   55    HB3  ALA  74           HB3      ALA  74   2.164 -18.057 -17.507
   56    H    ILE  75           H        ILE  75   2.412 -19.865 -14.045
   57    HA   ILE  75           HA       ILE  75   4.205 -18.796 -11.918
   58    HB   ILE  75           HB       ILE  75   2.484 -21.297 -11.955
   59   HG12  ILE  75          HG12      ILE  75   0.989 -19.428 -11.896
   60   HG13  ILE  75          HG13      ILE  75   1.049 -20.148 -10.304
   61   HG21  ILE  75          HG21      ILE  75   2.915 -21.365  -9.510
   62   HG22  ILE  75          HG22      ILE  75   4.360 -21.650 -10.463
   63   HG23  ILE  75          HG23      ILE  75   4.119 -20.060  -9.696
   64   HD11  ILE  75          HD11      ILE  75   2.412 -17.552 -11.151
   65   HD12  ILE  75          HD12      ILE  75   0.996 -17.731 -10.108
   66   HD13  ILE  75          HD13      ILE  75   2.577 -18.300  -9.545
   67    H    ASP  76           H        ASP  76   6.215 -19.611 -11.550
   68    HA   ASP  76           HA       ASP  76   7.255 -21.722 -13.375
   69    HB2  ASP  76           HB2      ASP  76   8.512 -19.643 -13.140
   70    HB3  ASP  76           HB3      ASP  76   8.689 -19.924 -11.406
   71    H    ARG  77           H        ARG  77   7.343 -21.076  -9.850
   72    HA   ARG  77           HA       ARG  77   6.678 -23.867  -9.219
   73    HB2  ARG  77           HB2      ARG  77   9.142 -23.891  -9.709
   74    HB3  ARG  77           HB3      ARG  77   9.403 -22.688  -8.444
   75    HG2  ARG  77           HG2      ARG  77   8.623 -24.288  -6.738
   76    HG3  ARG  77           HG3      ARG  77   8.228 -25.470  -8.007
   77    HD2  ARG  77           HD2      ARG  77  10.613 -25.557  -8.664
   78    HD3  ARG  77           HD3      ARG  77  11.001 -24.353  -7.420
   79    HE   ARG  77           HE       ARG  77   9.665 -26.558  -6.182
   80   HH11  ARG  77          HH11      ARG  77  12.774 -25.893  -7.664
   81   HH12  ARG  77          HH12      ARG  77  13.596 -27.088  -6.696
   82   HH21  ARG  77          HH21      ARG  77  10.784 -28.071  -4.972
   83   HH22  ARG  77          HH22      ARG  77  12.488 -28.291  -5.220
   84    H    GLU  78           H        GLU  78   7.569 -20.719  -7.911
   85    HA   GLU  78           HA       GLU  78   7.333 -20.746  -5.291
   86    HB2  GLU  78           HB2      GLU  78   7.502 -18.723  -6.671
   87    HB3  GLU  78           HB3      GLU  78   5.820 -18.877  -7.159
   88    HG2  GLU  78           HG2      GLU  78   5.170 -18.537  -4.712
   89    HG3  GLU  78           HG3      GLU  78   6.869 -18.209  -4.384
   90    H    GLN  79           H        GLN  79   4.345 -20.730  -7.255
   91    HA   GLN  79           HA       GLN  79   2.706 -21.060  -4.812
   92    HB2  GLN  79           HB2      GLN  79   1.719 -20.528  -7.631
   93    HB3  GLN  79           HB3      GLN  79   0.875 -20.283  -6.091
   94    HG2  GLN  79           HG2      GLN  79   2.793 -18.661  -5.480
   95    HG3  GLN  79           HG3      GLN  79   3.297 -18.768  -7.167
   96   HE21  GLN  79          HE22      GLN  79   2.958 -16.353  -6.525
   97   HE22  GLN  79          HE21      GLN  79   1.384 -15.693  -7.019
   98    H    SER  80           H        SER  80   3.560 -22.942  -7.707
   99    HA   SER  80           HA       SER  80   1.742 -25.104  -7.347
  100    HB2  SER  80           HB2      SER  80   4.614 -25.197  -8.364
  101    HB3  SER  80           HB3      SER  80   3.346 -26.406  -8.641
  102    HG   SER  80           HG       SER  80   3.579 -24.901 -10.413
  103    H    ALA  81           H        ALA  81   5.030 -24.534  -5.921
  104    HA   ALA  81           HA       ALA  81   5.150 -26.883  -4.410
  105    HB1  ALA  81           HB1      ALA  81   7.054 -25.381  -4.850
  106    HB2  ALA  81           HB2      ALA  81   6.316 -24.129  -3.821
  107    HB3  ALA  81           HB3      ALA  81   6.863 -25.665  -3.109
  108    H    ALA  82           H        ALA  82   3.732 -23.705  -3.500
  109    HA   ALA  82           HA       ALA  82   2.976 -24.442  -0.840
  110    HB1  ALA  82           HB1      ALA  82   1.573 -22.426  -0.955
  111    HB2  ALA  82           HB2      ALA  82   3.180 -22.117  -1.640
  112    HB3  ALA  82           HB3      ALA  82   1.783 -22.349  -2.716
  113    H    ILE  83           H        ILE  83   1.162 -24.648  -3.945
  114    HA   ILE  83           HA       ILE  83  -1.236 -25.699  -2.704
  115    HB   ILE  83           HB       ILE  83  -0.305 -25.567  -5.587
  116   HG12  ILE  83          HG12      ILE  83  -2.377 -24.001  -3.979
  117   HG13  ILE  83          HG13      ILE  83  -0.776 -23.414  -4.364
  118   HG21  ILE  83          HG21      ILE  83  -2.650 -26.126  -6.225
  119   HG22  ILE  83          HG22      ILE  83  -1.906 -27.466  -5.368
  120   HG23  ILE  83          HG23      ILE  83  -3.050 -26.407  -4.517
  121   HD11  ILE  83          HD11      ILE  83  -3.046 -23.883  -6.310
  122   HD12  ILE  83          HD12      ILE  83  -2.255 -22.366  -5.880
  123   HD13  ILE  83          HD13      ILE  83  -1.359 -23.578  -6.820
  124    H    ARG  84           H        ARG  84   1.624 -27.287  -4.127
  125    HA   ARG  84           HA       ARG  84   0.652 -29.994  -3.818
  126    HB2  ARG  84           HB2      ARG  84   2.583 -29.308  -5.233
  127    HB3  ARG  84           HB3      ARG  84   3.514 -28.906  -3.795
  128    HG2  ARG  84           HG2      ARG  84   3.545 -31.254  -3.099
  129    HG3  ARG  84           HG3      ARG  84   2.421 -31.691  -4.404
  130    HD2  ARG  84           HD2      ARG  84   4.057 -31.012  -6.097
  131    HD3  ARG  84           HD3      ARG  84   5.199 -30.510  -4.828
  132    HE   ARG  84           HE       ARG  84   4.672 -33.162  -4.228
  133   HH11  ARG  84          HH11      ARG  84   5.935 -31.557  -7.079
  134   HH12  ARG  84          HH12      ARG  84   6.719 -33.007  -7.657
  135   HH21  ARG  84          HH21      ARG  84   5.886 -34.909  -4.920
  136   HH22  ARG  84          HH22      ARG  84   6.867 -34.768  -6.347
  137    H    GLU  85           H        GLU  85   2.636 -27.963  -1.582
  138    HA   GLU  85           HA       GLU  85   2.605 -29.771   0.553
  139    HB2  GLU  85           HB2      GLU  85   4.019 -27.681   0.258
  140    HB3  GLU  85           HB3      GLU  85   2.626 -26.776   0.860
  141    HG2  GLU  85           HG2      GLU  85   4.046 -27.255   2.747
  142    HG3  GLU  85           HG3      GLU  85   2.599 -28.265   2.860
  143    H    TRP  86           H        TRP  86   0.190 -27.149  -0.147
  144    HA   TRP  86           HA       TRP  86  -1.561 -27.702   1.926
  145    HB2  TRP  86           HB2      TRP  86  -1.856 -25.778   0.502
  146    HB3  TRP  86           HB3      TRP  86  -2.118 -26.796  -0.912
  147    HD1  TRP  86           HD1      TRP  86  -3.878 -25.510   2.203
  148    HE1  TRP  86           HE1      TRP  86  -6.372 -26.105   2.135
  149    HE3  TRP  86           HE3      TRP  86  -3.943 -28.306  -2.097
  150    HZ2  TRP  86           HZ2      TRP  86  -8.084 -27.899   0.640
  151    HZ3  TRP  86           HZ3      TRP  86  -6.006 -29.507  -2.774
  152    HH2  TRP  86           HH2      TRP  86  -8.066 -29.354  -1.375
  153    H    ALA  87           H        ALA  87  -1.558 -29.229  -1.356
  154    HA   ALA  87           HA       ALA  87  -3.786 -30.881  -0.793
  155    HB1  ALA  87           HB1      ALA  87  -3.003 -30.311  -3.078
  156    HB2  ALA  87           HB2      ALA  87  -1.509 -31.231  -2.824
  157    HB3  ALA  87           HB3      ALA  87  -3.076 -32.070  -2.888
  158    H    ARG  88           H        ARG  88  -0.303 -31.580  -0.463
  159    HA   ARG  88           HA       ARG  88  -0.337 -34.260   0.454
  160    HB2  ARG  88           HB2      ARG  88   1.672 -32.925  -0.097
  161    HB3  ARG  88           HB3      ARG  88   1.375 -31.877   1.284
  162    HG2  ARG  88           HG2      ARG  88   1.719 -33.882   2.801
  163    HG3  ARG  88           HG3      ARG  88   2.196 -34.804   1.358
  164    HD2  ARG  88           HD2      ARG  88   3.987 -33.101   0.924
  165    HD3  ARG  88           HD3      ARG  88   3.474 -32.229   2.380
  166    HE   ARG  88           HE       ARG  88   4.331 -35.077   2.603
  167   HH11  ARG  88          HH11      ARG  88   5.055 -31.707   3.479
  168   HH12  ARG  88          HH12      ARG  88   6.370 -32.217   4.502
  169   HH21  ARG  88          HH21      ARG  88   5.973 -35.584   3.975
  170   HH22  ARG  88          HH22      ARG  88   6.852 -34.336   4.806
  171    H    ARG  89           H        ARG  89  -0.813 -31.261   2.342
  172    HA   ARG  89           HA       ARG  89  -1.253 -32.710   4.860
  173    HB2  ARG  89           HB2      ARG  89  -1.435 -29.765   4.121
  174    HB3  ARG  89           HB3      ARG  89  -1.625 -30.403   5.762
  175    HG2  ARG  89           HG2      ARG  89   0.637 -31.375   5.703
  176    HG3  ARG  89           HG3      ARG  89   0.863 -30.818   4.042
  177    HD2  ARG  89           HD2      ARG  89   0.530 -28.449   4.875
  178    HD3  ARG  89           HD3      ARG  89   0.549 -29.111   6.526
  179    HE   ARG  89           HE       ARG  89   2.812 -29.737   4.667
  180   HH11  ARG  89          HH11      ARG  89   1.904 -27.892   7.530
  181   HH12  ARG  89          HH12      ARG  89   3.575 -27.574   7.917
  182   HH21  ARG  89          HH21      ARG  89   4.758 -29.301   5.151
  183   HH22  ARG  89          HH22      ARG  89   5.211 -28.379   6.587
  184    H    ASN  90           H        ASN  90  -3.366 -31.749   2.328
  185    HA   ASN  90           HA       ASN  90  -5.764 -32.271   4.045
  186    HB2  ASN  90           HB2      ASN  90  -5.466 -30.805   1.396
  187    HB3  ASN  90           HB3      ASN  90  -7.018 -31.209   2.123
  188   HD21  ASN  90          HD22      ASN  90  -4.138 -29.231   2.483
  189   HD22  ASN  90          HD21      ASN  90  -4.827 -28.166   3.713
  190    H    GLY  91           H        GLY  91  -3.805 -34.276   2.544
  191    HA2  GLY  91           HA2      GLY  91  -4.024 -36.382   1.682
  192    HA3  GLY  91           HA3      GLY  91  -5.689 -36.366   2.263
  193    H    HIS  92           H        HIS  92  -4.639 -34.045  -0.171
  194    HA   HIS  92           HA       HIS  92  -6.621 -35.195  -2.090
  195    HB2  HIS  92           HB2      HIS  92  -5.446 -32.431  -1.685
  196    HB3  HIS  92           HB3      HIS  92  -6.105 -32.891  -3.245
  197    HD1  HIS  92           HD1      HIS  92  -7.614 -33.408   0.357
  198    HD2  HIS  92           HD2      HIS  92  -8.447 -31.930  -3.521
  199    HE1  HIS  92           HE1      HIS  92 -10.054 -32.606   0.389
  200    HE2  HIS  92           HE2      HIS  92 -10.561 -31.719  -1.973
  201    H    ASN  93           H        ASN  93  -6.152 -35.591  -4.249
  202    HA   ASN  93           HA       ASN  93  -3.486 -36.577  -4.822
  203    HB2  ASN  93           HB2      ASN  93  -4.397 -37.257  -6.943
  204    HB3  ASN  93           HB3      ASN  93  -5.551 -37.642  -5.683
  205   HD21  ASN  93          HD22      ASN  93  -5.169 -36.093  -8.724
  206   HD22  ASN  93          HD21      ASN  93  -6.722 -35.280  -8.730
  207    H    VAL  94           H        VAL  94  -1.926 -35.798  -6.203
  208    HA   VAL  94           HA       VAL  94  -2.187 -33.285  -7.663
  209    HB   VAL  94           HB       VAL  94  -1.827 -32.491  -5.353
  210   HG11  VAL  94          HG11      VAL  94   0.250 -32.773  -4.160
  211   HG12  VAL  94          HG12      VAL  94  -0.474 -34.356  -4.448
  212   HG13  VAL  94          HG13      VAL  94   0.901 -33.825  -5.441
  213   HG21  VAL  94          HG21      VAL  94   0.616 -31.910  -7.056
  214   HG22  VAL  94          HG22      VAL  94  -0.996 -31.183  -7.286
  215   HG23  VAL  94          HG23      VAL  94  -0.099 -30.903  -5.791
  216    H    SER  95           H        SER  95  -0.426 -32.900  -9.112
  217    HA   SER  95           HA       SER  95   0.762 -35.328 -10.106
  218    HB2  SER  95           HB2      SER  95   1.757 -33.769 -11.809
  219    HB3  SER  95           HB3      SER  95  -0.011 -33.741 -11.673
  220    HG   SER  95           HG       SER  95   1.078 -31.631 -11.761
  221    H    THR  96           H        THR  96   2.916 -35.927 -10.303
  222    HA   THR  96           HA       THR  96   4.605 -35.138  -8.043
  223    HB   THR  96           HB       THR  96   6.047 -37.025  -8.865
  224    HG1  THR  96           HG1      THR  96   5.138 -38.328 -10.513
  225   HG21  THR  96          HG21      THR  96   4.236 -37.407  -7.208
  226   HG22  THR  96          HG22      THR  96   3.094 -37.737  -8.530
  227   HG23  THR  96          HG23      THR  96   4.484 -38.809  -8.262
  228    H    ARG  97           H        ARG  97   4.628 -34.617 -11.501
  229    HA   ARG  97           HA       ARG  97   7.006 -32.829 -11.296
  230    HB2  ARG  97           HB2      ARG  97   6.557 -34.971 -13.426
  231    HB3  ARG  97           HB3      ARG  97   7.778 -33.696 -13.518
  232    HG2  ARG  97           HG2      ARG  97   8.837 -34.546 -11.440
  233    HG3  ARG  97           HG3      ARG  97   7.677 -35.877 -11.380
  234    HD2  ARG  97           HD2      ARG  97   9.593 -35.351 -13.684
  235    HD3  ARG  97           HD3      ARG  97   9.891 -36.493 -12.364
  236    HE   ARG  97           HE       ARG  97   7.415 -37.243 -13.398
  237   HH11  ARG  97          HH11      ARG  97  10.672 -37.098 -14.683
  238   HH12  ARG  97          HH12      ARG  97  10.374 -38.377 -15.831
  239   HH21  ARG  97          HH21      ARG  97   7.098 -38.858 -14.892
  240   HH22  ARG  97          HH22      ARG  97   8.405 -39.350 -15.929
  241    H    GLY  98           H        GLY  98   7.107 -31.234 -12.978
  242    HA2  GLY  98           HA2      GLY  98   6.231 -29.620 -14.401
  243    HA3  GLY  98           HA3      GLY  98   4.937 -30.740 -14.827
  244    H    ARG  99           H        ARG  99   3.567 -28.850 -14.851
  245    HA   ARG  99           HA       ARG  99   2.980 -27.428 -12.335
  246    HB2  ARG  99           HB2      ARG  99   1.788 -27.212 -15.133
  247    HB3  ARG  99           HB3      ARG  99   1.273 -26.236 -13.750
  248    HG2  ARG  99           HG2      ARG  99   3.629 -25.416 -13.477
  249    HG3  ARG  99           HG3      ARG  99   4.068 -26.265 -14.965
  250    HD2  ARG  99           HD2      ARG  99   2.423 -24.907 -16.235
  251    HD3  ARG  99           HD3      ARG  99   1.923 -24.111 -14.744
  252    HE   ARG  99           HE       ARG  99   3.959 -22.915 -14.615
  253   HH11  ARG  99          HH11      ARG  99   4.045 -24.912 -17.511
  254   HH12  ARG  99          HH12      ARG  99   5.377 -24.005 -18.177
  255   HH21  ARG  99          HH21      ARG  99   5.555 -21.847 -15.483
  256   HH22  ARG  99          HH22      ARG  99   6.240 -22.282 -17.040
  257    H    ILE 100           H        ILE 100   0.856 -27.181 -11.507
  258    HA   ILE 100           HA       ILE 100  -0.355 -29.794 -10.956
  259    HB   ILE 100           HB       ILE 100  -0.628 -27.041  -9.728
  260   HG12  ILE 100          HG12      ILE 100   0.585 -29.693  -8.810
  261   HG13  ILE 100          HG13      ILE 100   1.468 -28.250  -9.303
  262   HG21  ILE 100          HG21      ILE 100  -2.032 -27.976  -7.974
  263   HG22  ILE 100          HG22      ILE 100  -2.836 -28.159  -9.508
  264   HG23  ILE 100          HG23      ILE 100  -2.038 -29.563  -8.765
  265   HD11  ILE 100          HD11      ILE 100   1.553 -28.336  -6.960
  266   HD12  ILE 100          HD12      ILE 100   0.430 -27.022  -7.365
  267   HD13  ILE 100          HD13      ILE 100  -0.188 -28.594  -6.790
  268    HA   PRO 101           HA       PRO 101  -3.830 -29.018 -13.690
  269    HB2  PRO 101           HB2      PRO 101  -5.601 -30.956 -12.847
  270    HB3  PRO 101           HB3      PRO 101  -4.171 -31.264 -13.879
  271    HG2  PRO 101           HG2      PRO 101  -4.471 -31.694 -10.914
  272    HG3  PRO 101           HG3      PRO 101  -3.645 -32.727 -12.113
  273    HD2  PRO 101           HD2      PRO 101  -2.338 -30.970 -10.445
  274    HD3  PRO 101           HD3      PRO 101  -1.720 -31.420 -12.059
  275    H    ALA 102           H        ALA 102  -5.777 -27.916 -13.700
  276    HA   ALA 102           HA       ALA 102  -6.041 -26.033 -11.715
  277    HB1  ALA 102           HB1      ALA 102  -8.120 -26.808 -13.783
  278    HB2  ALA 102           HB2      ALA 102  -7.984 -25.251 -12.927
  279    HB3  ALA 102           HB3      ALA 102  -6.708 -25.747 -14.053
  280    H    ASP 103           H        ASP 103  -7.783 -29.113 -11.799
  281    HA   ASP 103           HA       ASP 103  -9.864 -28.549 -10.062
  282    HB2  ASP 103           HB2      ASP 103  -8.233 -31.097 -10.393
  283    HB3  ASP 103           HB3      ASP 103  -9.747 -31.001  -9.497
  284    H    VAL 104           H        VAL 104  -6.457 -29.303  -9.264
  285    HA   VAL 104           HA       VAL 104  -6.962 -29.418  -6.421
  286    HB   VAL 104           HB       VAL 104  -4.214 -28.981  -7.464
  287   HG11  VAL 104          HG11      VAL 104  -3.597 -30.528  -5.668
  288   HG12  VAL 104          HG12      VAL 104  -4.565 -29.192  -5.040
  289   HG13  VAL 104          HG13      VAL 104  -5.310 -30.792  -5.286
  290   HG21  VAL 104          HG21      VAL 104  -3.898 -31.408  -7.885
  291   HG22  VAL 104          HG22      VAL 104  -5.653 -31.654  -7.706
  292   HG23  VAL 104          HG23      VAL 104  -4.996 -30.669  -9.041
  293    H    ILE 105           H        ILE 105  -5.816 -26.984  -8.709
  294    HA   ILE 105           HA       ILE 105  -5.095 -24.950  -6.775
  295    HB   ILE 105           HB       ILE 105  -5.907 -24.901  -9.705
  296   HG12  ILE 105          HG12      ILE 105  -3.175 -24.111  -8.680
  297   HG13  ILE 105          HG13      ILE 105  -3.566 -25.820  -8.607
  298   HG21  ILE 105          HG21      ILE 105  -4.975 -22.569  -7.979
  299   HG22  ILE 105          HG22      ILE 105  -4.971 -22.564  -9.757
  300   HG23  ILE 105          HG23      ILE 105  -6.504 -22.713  -8.899
  301   HD11  ILE 105          HD11      ILE 105  -3.994 -25.931 -10.966
  302   HD12  ILE 105          HD12      ILE 105  -3.761 -24.173 -11.148
  303   HD13  ILE 105          HD13      ILE 105  -2.396 -25.220 -10.686
  304    H    ASP 106           H        ASP 106  -8.168 -25.614  -8.560
  305    HA   ASP 106           HA       ASP 106  -9.733 -23.709  -7.264
  306    HB2  ASP 106           HB2      ASP 106 -10.394 -24.933  -9.282
  307    HB3  ASP 106           HB3      ASP 106 -10.503 -26.433  -8.357
  308    H    ALA 107           H        ALA 107  -9.157 -27.165  -6.303
  309    HA   ALA 107           HA       ALA 107 -10.633 -27.196  -3.984
  310    HB1  ALA 107           HB1      ALA 107  -7.976 -28.608  -4.540
  311    HB2  ALA 107           HB2      ALA 107  -9.207 -29.097  -3.352
  312    HB3  ALA 107           HB3      ALA 107  -9.578 -29.159  -5.077
  313    H    TYR 108           H        TYR 108  -7.207 -26.185  -4.331
  314    HA   TYR 108           HA       TYR 108  -6.712 -25.409  -1.642
  315    HB2  TYR 108           HB2      TYR 108  -4.869 -25.636  -3.068
  316    HB3  TYR 108           HB3      TYR 108  -5.580 -24.673  -4.343
  317    HD1  TYR 108           HD1      TYR 108  -4.087 -24.440  -0.925
  318    HD2  TYR 108           HD2      TYR 108  -5.221 -22.334  -4.516
  319    HE1  TYR 108           HE1      TYR 108  -2.849 -22.425  -0.134
  320    HE2  TYR 108           HE2      TYR 108  -3.983 -20.323  -3.725
  321    HH   TYR 108           HH       TYR 108  -2.690 -19.399  -2.058
  322    H    HIS 109           H        HIS 109  -7.941 -23.376  -4.401
  323    HA   HIS 109           HA       HIS 109  -8.286 -21.048  -2.752
  324    HB2  HIS 109           HB2      HIS 109  -9.524 -21.850  -5.402
  325    HB3  HIS 109           HB3      HIS 109  -9.935 -20.344  -4.578
  326    HD1  HIS 109           HD1      HIS 109  -7.551 -18.812  -3.891
  327    HD2  HIS 109           HD2      HIS 109  -7.587 -21.535  -7.108
  328    HE1  HIS 109           HE1      HIS 109  -5.597 -18.133  -5.433
  329    HE2  HIS 109           HE2      HIS 109  -5.632 -19.786  -7.406
  330    H    ALA 110           H        ALA 110 -10.630 -23.726  -3.406
  331    HA   ALA 110           HA       ALA 110 -12.809 -22.521  -2.115
  332    HB1  ALA 110           HB1      ALA 110 -12.045 -25.469  -2.232
  333    HB2  ALA 110           HB2      ALA 110 -13.655 -24.824  -1.867
  334    HB3  ALA 110           HB3      ALA 110 -12.946 -24.575  -3.473
  335    H    ALA 111           H        ALA 111 -10.160 -24.498  -0.663
  336    HA   ALA 111           HA       ALA 111 -11.075 -24.570   1.943
  337    HB1  ALA 111           HB1      ALA 111  -8.215 -24.477   0.922
  338    HB2  ALA 111           HB2      ALA 111  -8.760 -25.184   2.461
  339    HB3  ALA 111           HB3      ALA 111  -9.255 -25.926   0.925
  340    H    THR 112           H        THR 112  -9.276 -21.984   0.314
  341    HA   THR 112           HA       THR 112  -8.979 -20.441   2.824
  342    HB   THR 112           HB       THR 112  -7.680 -18.856   1.499
  343    HG1  THR 112           HG1      THR 112  -7.191 -19.368  -0.640
  344   HG21  THR 112          HG21      THR 112  -6.773 -21.731   1.014
  345   HG22  THR 112          HG22      THR 112  -5.752 -20.279   1.064
  346   HG23  THR 112          HG23      THR 112  -6.563 -20.835   2.538
  347    H    LEU 113           H        LEU 113 -10.892 -20.183  -0.193
  348    HA   LEU 113           HA       LEU 113 -11.849 -17.543   0.394
  349    HB2  LEU 113           HB2      LEU 113 -11.561 -18.429  -1.881
  350    HB3  LEU 113           HB3      LEU 113 -12.728 -19.717  -1.548
  351    HG   LEU 113           HG       LEU 113 -14.520 -18.100  -1.317
  352   HD11  LEU 113          HD11      LEU 113 -13.334 -16.080  -0.562
  353   HD12  LEU 113          HD12      LEU 113 -12.435 -16.007  -2.095
  354   HD13  LEU 113          HD13      LEU 113 -14.190 -15.732  -2.069
  355   HD21  LEU 113          HD21      LEU 113 -14.027 -19.098  -3.522
  356   HD22  LEU 113          HD22      LEU 113 -14.679 -17.459  -3.689
  357   HD23  LEU 113          HD23      LEU 113 -12.937 -17.744  -3.894
  358    H    GLU 114           H        GLU 114 -13.171 -20.807   0.945
  359    HA   GLU 114           HA       GLU 114 -15.800 -20.126   1.729
  360    HB2  GLU 114           HB2      GLU 114 -15.015 -22.420   1.372
  361    HB3  GLU 114           HB3      GLU 114 -14.029 -22.338   2.847
  362    HG2  GLU 114           HG2      GLU 114 -16.080 -22.042   4.200
  363    HG3  GLU 114           HG3      GLU 114 -17.062 -22.012   2.735
  364    H    HIS 115           H        HIS 115 -16.540 -18.815   3.273
  365    HA   HIS 115           HA       HIS 115 -16.579 -17.307   4.955
  366    HB2  HIS 115           HB2      HIS 115 -16.947 -19.661   5.984
  367    HB3  HIS 115           HB3      HIS 115 -15.375 -19.446   6.733
  368    HD1  HIS 115           HD1      HIS 115 -15.319 -16.973   8.279
  369    HD2  HIS 115           HD2      HIS 115 -18.987 -18.826   7.313
  370    HE1  HIS 115           HE1      HIS 115 -17.066 -16.074   9.970
  371    HE2  HIS 115           HE2      HIS 115 -19.296 -17.208   9.363
  372    H    HIS 116           H        HIS 116 -14.116 -17.181   3.378
  373    HA   HIS 116           HA       HIS 116 -11.966 -16.474   3.318
  374    HB2  HIS 116           HB2      HIS 116 -12.838 -14.601   5.543
  375    HB3  HIS 116           HB3      HIS 116 -11.472 -14.370   4.460
  376    HD1  HIS 116           HD1      HIS 116 -14.985 -13.359   4.718
  377    HD2  HIS 116           HD2      HIS 116 -12.271 -14.390   1.649
  378    HE1  HIS 116           HE1      HIS 116 -15.962 -12.414   2.529
  379    HE2  HIS 116           HE2      HIS 116 -14.302 -13.036   0.666
  380    H    HIS 117           H        HIS 117 -12.235 -18.833   4.823
  381    HA   HIS 117           HA       HIS 117 -10.971 -18.935   7.333
  382    HB2  HIS 117           HB2      HIS 117 -12.245 -20.777   6.530
  383    HB3  HIS 117           HB3      HIS 117 -11.301 -20.910   5.058
  384    HD1  HIS 117           HD1      HIS 117  -9.644 -22.820   5.070
  385    HD2  HIS 117           HD2      HIS 117 -10.601 -21.349   8.915
  386    HE1  HIS 117           HE1      HIS 117  -8.362 -24.312   6.767
  387    HE2  HIS 117           HE2      HIS 117  -8.964 -23.406   9.107
  388    H    HIS 118           H        HIS 118  -8.977 -18.648   8.045
  389    HA   HIS 118           HA       HIS 118  -6.578 -19.246   6.431
  390    HB2  HIS 118           HB2      HIS 118  -5.605 -17.006   6.755
  391    HB3  HIS 118           HB3      HIS 118  -7.060 -16.941   5.788
  392    HD1  HIS 118           HD1      HIS 118  -9.240 -15.742   6.946
  393    HD2  HIS 118           HD2      HIS 118  -5.587 -15.663   9.080
  394    HE1  HIS 118           HE1      HIS 118  -9.521 -13.995   8.828
  395    HE2  HIS 118           HE2      HIS 118  -7.292 -13.960  10.121
  396    H    HIS 119           H        HIS 119  -4.577 -19.170   7.682
  397    HA   HIS 119           HA       HIS 119  -4.941 -20.380  10.324
  398    HB2  HIS 119           HB2      HIS 119  -2.548 -20.825  10.214
  399    HB3  HIS 119           HB3      HIS 119  -3.344 -21.304   8.726
  400    HD1  HIS 119           HD1      HIS 119  -1.047 -18.436  10.038
  401    HD2  HIS 119           HD2      HIS 119  -2.373 -20.322   6.479
  402    HE1  HIS 119           HE1      HIS 119   0.353 -17.451   8.118
  403    HE2  HIS 119           HE2      HIS 119  -0.453 -18.607   5.958
  404    H    HIS 120           H        HIS 120  -3.588 -19.766  12.190
  405    HA   HIS 120           HA       HIS 120  -3.788 -16.982  12.969
  406    HB2  HIS 120           HB2      HIS 120  -2.203 -19.253  14.233
  407    HB3  HIS 120           HB3      HIS 120  -2.571 -17.709  14.979
  408    HD1  HIS 120           HD1      HIS 120  -3.748 -21.047  15.303
  409    HD2  HIS 120           HD2      HIS 120  -5.566 -17.270  14.790
  410    HE1  HIS 120           HE1      HIS 120  -6.176 -21.286  16.147
  411    HE2  HIS 120           HE2      HIS 120  -7.274 -18.978  15.830
  Start of MODEL   13
    1    H1   SER  66           H1       SER  66  23.777   2.364 -11.941
    2    H2   SER  66           H2       SER  66  22.808   1.941 -13.189
    3    H3   SER  66           H3       SER  66  22.171   2.662 -11.858
    4    HA   SER  66           HA       SER  66  23.418  -0.010 -11.960
    5    HB2  SER  66           HB2      SER  66  22.151   1.386  -9.568
    6    HB3  SER  66           HB3      SER  66  22.842  -0.250  -9.595
    7    HG   SER  66           HG       SER  66  24.348   1.292  -8.810
    8    H    GLY  67           H        GLY  67  22.000  -1.820 -11.678
    9    HA2  GLY  67           HA2      GLY  67  19.225  -1.389 -12.667
   10    HA3  GLY  67           HA3      GLY  67  20.124  -2.898 -12.594
   11    H    SER  68           H        SER  68  20.815  -2.271  -9.648
   12    HA   SER  68           HA       SER  68  18.932  -4.054  -8.566
   13    HB2  SER  68           HB2      SER  68  20.027  -3.518  -6.396
   14    HB3  SER  68           HB3      SER  68  21.164  -3.873  -7.706
   15    HG   SER  68           HG       SER  68  21.770  -1.998  -6.491
   16    H    GLY  69           H        GLY  69  18.778  -0.532  -8.581
   17    HA2  GLY  69           HA2      GLY  69  16.648  -0.279  -6.624
   18    HA3  GLY  69           HA3      GLY  69  17.180   0.943  -7.775
   19    H    ARG  70           H        ARG  70  16.574  -1.432  -9.849
   20    HA   ARG  70           HA       ARG  70  13.641  -0.806 -10.193
   21    HB2  ARG  70           HB2      ARG  70  15.896  -0.825 -12.247
   22    HB3  ARG  70           HB3      ARG  70  14.184  -0.772 -12.669
   23    HG2  ARG  70           HG2      ARG  70  13.865   1.338 -11.508
   24    HG3  ARG  70           HG3      ARG  70  15.529   1.338 -10.914
   25    HD2  ARG  70           HD2      ARG  70  14.775   1.345 -13.858
   26    HD3  ARG  70           HD3      ARG  70  15.099   2.811 -12.916
   27    HE   ARG  70           HE       ARG  70  17.350   1.342 -12.439
   28   HH11  ARG  70          HH11      ARG  70  15.858   2.351 -15.443
   29   HH12  ARG  70          HH12      ARG  70  17.378   2.379 -16.295
   30   HH21  ARG  70          HH21      ARG  70  19.245   1.404 -13.560
   31   HH22  ARG  70          HH22      ARG  70  19.253   1.853 -15.246
   32    H    GLY  71           H        GLY  71  16.164  -3.259 -10.708
   33    HA2  GLY  71           HA2      GLY  71  14.475  -5.224 -11.939
   34    HA3  GLY  71           HA3      GLY  71  16.006  -5.523 -11.123
   35    H    ARG  72           H        ARG  72  13.143  -6.726 -11.141
   36    HA   ARG  72           HA       ARG  72  12.838  -7.207  -8.205
   37    HB2  ARG  72           HB2      ARG  72  10.767  -6.270 -10.222
   38    HB3  ARG  72           HB3      ARG  72  10.273  -7.182  -8.798
   39    HG2  ARG  72           HG2      ARG  72  10.861  -5.520  -7.292
   40    HG3  ARG  72           HG3      ARG  72  12.027  -4.756  -8.376
   41    HD2  ARG  72           HD2      ARG  72   9.041  -4.748  -8.928
   42    HD3  ARG  72           HD3      ARG  72   9.870  -3.487  -7.991
   43    HE   ARG  72           HE       ARG  72  11.411  -3.585 -10.246
   44   HH11  ARG  72          HH21      ARG  72   7.953  -3.091  -9.901
   45   HH12  ARG  72          HH22      ARG  72   7.863  -2.150 -11.369
   46   HH21  ARG  72          HH11      ARG  72  11.256  -2.425 -12.020
   47   HH22  ARG  72          HH12      ARG  72   9.723  -1.774 -12.563
   48    H    GLY  73           H        GLY  73  11.854  -9.159  -7.630
   49    HA2  GLY  73           HA2      GLY  73  12.620 -11.400  -9.306
   50    HA3  GLY  73           HA3      GLY  73  11.893 -11.480  -7.708
   51    H    ALA  74           H        ALA  74  11.240 -13.315  -9.525
   52    HA   ALA  74           HA       ALA  74   8.333 -12.940  -9.853
   53    HB1  ALA  74           HB1      ALA  74   9.283 -12.323 -12.055
   54    HB2  ALA  74           HB2      ALA  74  10.163 -13.868 -12.118
   55    HB3  ALA  74           HB3      ALA  74   8.386 -13.847 -12.154
   56    H    ILE  75           H        ILE  75   7.201 -15.035 -10.150
   57    HA   ILE  75           HA       ILE  75   8.298 -17.034  -8.342
   58    HB   ILE  75           HB       ILE  75   5.760 -17.067 -10.001
   59   HG12  ILE  75          HG12      ILE  75   6.232 -16.473  -7.038
   60   HG13  ILE  75          HG13      ILE  75   5.877 -15.259  -8.266
   61   HG21  ILE  75          HG21      ILE  75   5.020 -18.938  -8.559
   62   HG22  ILE  75          HG22      ILE  75   6.443 -19.405  -9.438
   63   HG23  ILE  75          HG23      ILE  75   6.590 -18.932  -7.730
   64   HD11  ILE  75          HD11      ILE  75   3.662 -16.378  -8.691
   65   HD12  ILE  75          HD12      ILE  75   3.983 -17.408  -7.272
   66   HD13  ILE  75          HD13      ILE  75   3.858 -15.661  -7.077
   67    H    ASP  76           H        ASP  76   9.461 -18.745  -8.788
   68    HA   ASP  76           HA       ASP  76   9.733 -19.775 -11.569
   69    HB2  ASP  76           HB2      ASP  76  11.786 -19.457 -10.313
   70    HB3  ASP  76           HB3      ASP  76  11.195 -20.470  -8.999
   71    H    ARG  77           H        ARG  77   9.293 -21.343  -8.381
   72    HA   ARG  77           HA       ARG  77   6.888 -22.858  -9.358
   73    HB2  ARG  77           HB2      ARG  77   9.466 -23.893  -8.152
   74    HB3  ARG  77           HB3      ARG  77   7.981 -24.818  -7.985
   75    HG2  ARG  77           HG2      ARG  77   7.719 -25.143 -10.317
   76    HG3  ARG  77           HG3      ARG  77   8.961 -23.960 -10.732
   77    HD2  ARG  77           HD2      ARG  77   9.568 -26.486  -9.156
   78    HD3  ARG  77           HD3      ARG  77   9.675 -26.370 -10.928
   79    HE   ARG  77           HE       ARG  77  11.147 -24.194  -9.996
   80   HH11  ARG  77          HH11      ARG  77  11.565 -27.675  -9.693
   81   HH12  ARG  77          HH12      ARG  77  13.296 -27.504  -9.526
   82   HH21  ARG  77          HH21      ARG  77  13.145 -24.039  -9.825
   83   HH22  ARG  77          HH22      ARG  77  14.227 -25.421  -9.614
   84    H    GLU  78           H        GLU  78   7.874 -20.741  -6.993
   85    HA   GLU  78           HA       GLU  78   7.318 -21.944  -4.563
   86    HB2  GLU  78           HB2      GLU  78   6.843 -19.050  -5.364
   87    HB3  GLU  78           HB3      GLU  78   6.822 -19.644  -3.703
   88    HG2  GLU  78           HG2      GLU  78   9.159 -20.449  -3.959
   89    HG3  GLU  78           HG3      GLU  78   9.200 -19.802  -5.599
   90    H    GLN  79           H        GLN  79   4.746 -20.195  -6.465
   91    HA   GLN  79           HA       GLN  79   2.730 -20.825  -4.513
   92    HB2  GLN  79           HB2      GLN  79   1.123 -19.991  -6.021
   93    HB3  GLN  79           HB3      GLN  79   2.557 -18.976  -6.136
   94    HG2  GLN  79           HG2      GLN  79   3.161 -20.237  -8.267
   95    HG3  GLN  79           HG3      GLN  79   1.624 -21.088  -8.135
   96   HE21  GLN  79          HE22      GLN  79   1.915 -19.812 -10.468
   97   HE22  GLN  79          HE21      GLN  79   0.988 -18.322 -10.483
   98    H    SER  80           H        SER  80   3.788 -22.531  -7.433
   99    HA   SER  80           HA       SER  80   1.815 -24.609  -7.419
  100    HB2  SER  80           HB2      SER  80   4.657 -24.456  -8.504
  101    HB3  SER  80           HB3      SER  80   3.538 -25.816  -8.816
  102    HG   SER  80           HG       SER  80   3.445 -24.210 -10.475
  103    H    ALA  81           H        ALA  81   5.107 -24.481  -5.943
  104    HA   ALA  81           HA       ALA  81   5.002 -26.975  -4.676
  105    HB1  ALA  81           HB1      ALA  81   6.474 -24.430  -3.866
  106    HB2  ALA  81           HB2      ALA  81   6.853 -26.070  -3.306
  107    HB3  ALA  81           HB3      ALA  81   7.054 -25.653  -5.018
  108    H    ALA  82           H        ALA  82   3.853 -23.769  -3.484
  109    HA   ALA  82           HA       ALA  82   3.005 -24.675  -0.916
  110    HB1  ALA  82           HB1      ALA  82   1.697 -22.610  -0.872
  111    HB2  ALA  82           HB2      ALA  82   3.317 -22.305  -1.533
  112    HB3  ALA  82           HB3      ALA  82   1.909 -22.397  -2.620
  113    H    ILE  83           H        ILE  83   1.202 -24.580  -4.042
  114    HA   ILE  83           HA       ILE  83  -1.250 -25.660  -2.973
  115    HB   ILE  83           HB       ILE  83  -0.127 -25.631  -5.797
  116   HG12  ILE  83          HG12      ILE  83  -2.372 -23.981  -4.564
  117   HG13  ILE  83          HG13      ILE  83  -0.721 -23.411  -4.604
  118   HG21  ILE  83          HG21      ILE  83  -2.925 -26.406  -4.829
  119   HG22  ILE  83          HG22      ILE  83  -2.488 -26.127  -6.522
  120   HG23  ILE  83          HG23      ILE  83  -1.764 -27.471  -5.648
  121   HD11  ILE  83          HD11      ILE  83  -0.773 -23.643  -7.129
  122   HD12  ILE  83          HD12      ILE  83  -2.527 -23.935  -6.981
  123   HD13  ILE  83          HD13      ILE  83  -1.840 -22.401  -6.437
  124    H    ARG  84           H        ARG  84   1.622 -27.266  -4.428
  125    HA   ARG  84           HA       ARG  84   0.663 -29.962  -4.205
  126    HB2  ARG  84           HB2      ARG  84   2.627 -29.200  -5.558
  127    HB3  ARG  84           HB3      ARG  84   3.519 -28.896  -4.068
  128    HG2  ARG  84           HG2      ARG  84   3.250 -31.392  -3.519
  129    HG3  ARG  84           HG3      ARG  84   2.511 -31.582  -5.113
  130    HD2  ARG  84           HD2      ARG  84   4.828 -32.217  -5.261
  131    HD3  ARG  84           HD3      ARG  84   4.614 -30.701  -6.153
  132    HE   ARG  84           HE       ARG  84   5.403 -30.230  -3.389
  133   HH11  ARG  84          HH11      ARG  84   6.898 -31.367  -6.363
  134   HH12  ARG  84          HH12      ARG  84   8.412 -30.594  -5.980
  135   HH21  ARG  84          HH21      ARG  84   7.391 -29.347  -2.947
  136   HH22  ARG  84          HH22      ARG  84   8.693 -29.539  -4.075
  137    H    GLU  85           H        GLU  85   2.645 -28.063  -1.855
  138    HA   GLU  85           HA       GLU  85   2.669 -30.043   0.114
  139    HB2  GLU  85           HB2      GLU  85   4.106 -27.976   0.006
  140    HB3  GLU  85           HB3      GLU  85   2.725 -27.056   0.638
  141    HG2  GLU  85           HG2      GLU  85   2.684 -28.685   2.599
  142    HG3  GLU  85           HG3      GLU  85   4.171 -29.395   1.973
  143    H    TRP  86           H        TRP  86   0.331 -27.286  -0.249
  144    HA   TRP  86           HA       TRP  86  -1.354 -27.894   1.860
  145    HB2  TRP  86           HB2      TRP  86  -1.570 -25.863   0.566
  146    HB3  TRP  86           HB3      TRP  86  -1.967 -26.768  -0.891
  147    HD1  TRP  86           HD1      TRP  86  -3.505 -25.438   2.298
  148    HE1  TRP  86           HE1      TRP  86  -6.043 -25.824   2.302
  149    HE3  TRP  86           HE3      TRP  86  -3.920 -28.232  -1.986
  150    HZ2  TRP  86           HZ2      TRP  86  -7.939 -27.463   0.858
  151    HZ3  TRP  86           HZ3      TRP  86  -6.083 -29.280  -2.590
  152    HH2  TRP  86           HH2      TRP  86  -8.083 -28.953  -1.126
  153    H    ALA  87           H        ALA  87  -1.468 -29.248  -1.481
  154    HA   ALA  87           HA       ALA  87  -3.741 -30.901  -1.022
  155    HB1  ALA  87           HB1      ALA  87  -2.943 -30.269  -3.246
  156    HB2  ALA  87           HB2      ALA  87  -1.427 -31.146  -3.001
  157    HB3  ALA  87           HB3      ALA  87  -2.962 -32.039  -3.114
  158    H    ARG  88           H        ARG  88  -0.238 -31.626  -0.637
  159    HA   ARG  88           HA       ARG  88  -0.543 -34.338   0.265
  160    HB2  ARG  88           HB2      ARG  88   1.585 -33.280  -0.469
  161    HB3  ARG  88           HB3      ARG  88   1.600 -32.289   0.992
  162    HG2  ARG  88           HG2      ARG  88   1.736 -34.321   2.400
  163    HG3  ARG  88           HG3      ARG  88   1.678 -35.344   0.958
  164    HD2  ARG  88           HD2      ARG  88   3.836 -33.268   1.529
  165    HD3  ARG  88           HD3      ARG  88   3.965 -34.985   1.945
  166    HE   ARG  88           HE       ARG  88   3.342 -34.952  -0.776
  167   HH11  ARG  88          HH11      ARG  88   6.030 -33.853   1.174
  168   HH12  ARG  88          HH12      ARG  88   7.184 -34.070  -0.114
  169   HH21  ARG  88          HH21      ARG  88   4.862 -35.215  -2.382
  170   HH22  ARG  88          HH22      ARG  88   6.530 -34.833  -2.076
  171    H    ARG  89           H        ARG  89  -0.505 -31.289   2.157
  172    HA   ARG  89           HA       ARG  89  -0.908 -32.472   4.751
  173    HB2  ARG  89           HB2      ARG  89  -1.602 -29.726   3.626
  174    HB3  ARG  89           HB3      ARG  89  -1.835 -30.163   5.319
  175    HG2  ARG  89           HG2      ARG  89   0.549 -30.588   5.620
  176    HG3  ARG  89           HG3      ARG  89   0.869 -30.275   3.910
  177    HD2  ARG  89           HD2      ARG  89   0.013 -27.958   4.167
  178    HD3  ARG  89           HD3      ARG  89  -0.290 -28.242   5.878
  179    HE   ARG  89           HE       ARG  89   2.281 -27.701   4.566
  180   HH11  ARG  89          HH11      ARG  89   0.949 -28.990   7.572
  181   HH12  ARG  89          HH12      ARG  89   2.429 -28.665   8.423
  182   HH21  ARG  89          HH21      ARG  89   3.992 -27.332   5.624
  183   HH22  ARG  89          HH22      ARG  89   4.171 -27.714   7.340
  184    H    ASN  90           H        ASN  90  -3.250 -31.669   2.242
  185    HA   ASN  90           HA       ASN  90  -5.529 -32.432   3.979
  186    HB2  ASN  90           HB2      ASN  90  -5.315 -31.171   1.217
  187    HB3  ASN  90           HB3      ASN  90  -6.841 -31.714   1.908
  188   HD21  ASN  90          HD22      ASN  90  -4.231 -29.366   2.283
  189   HD22  ASN  90          HD21      ASN  90  -5.135 -28.325   3.384
  190    H    GLY  91           H        GLY  91  -3.405 -34.242   2.139
  191    HA2  GLY  91           HA2      GLY  91  -3.458 -36.422   1.428
  192    HA3  GLY  91           HA3      GLY  91  -5.062 -36.601   2.149
  193    H    HIS  92           H        HIS  92  -4.513 -34.132  -0.293
  194    HA   HIS  92           HA       HIS  92  -6.500 -35.449  -2.066
  195    HB2  HIS  92           HB2      HIS  92  -6.617 -33.000  -1.258
  196    HB3  HIS  92           HB3      HIS  92  -5.321 -32.662  -2.396
  197    HD1  HIS  92           HD1      HIS  92  -9.045 -33.462  -2.234
  198    HD2  HIS  92           HD2      HIS  92  -5.993 -32.792  -5.076
  199    HE1  HIS  92           HE1      HIS  92 -10.224 -33.049  -4.488
  200    HE2  HIS  92           HE2      HIS  92  -8.384 -32.634  -6.224
  201    H    ASN  93           H        ASN  93  -6.124 -35.897  -4.273
  202    HA   ASN  93           HA       ASN  93  -3.519 -36.910  -4.894
  203    HB2  ASN  93           HB2      ASN  93  -5.700 -37.835  -5.695
  204    HB3  ASN  93           HB3      ASN  93  -5.904 -36.419  -6.731
  205   HD21  ASN  93          HD22      ASN  93  -6.090 -38.286  -8.338
  206   HD22  ASN  93          HD21      ASN  93  -4.583 -38.827  -9.068
  207    H    VAL  94           H        VAL  94  -1.788 -36.016  -5.907
  208    HA   VAL  94           HA       VAL  94  -1.995 -33.781  -7.747
  209    HB   VAL  94           HB       VAL  94  -2.028 -32.674  -5.487
  210   HG11  VAL  94          HG11      VAL  94  -0.520 -34.178  -4.240
  211   HG12  VAL  94          HG12      VAL  94   0.854 -33.635  -5.235
  212   HG13  VAL  94          HG13      VAL  94   0.025 -32.497  -4.168
  213   HG21  VAL  94          HG21      VAL  94  -1.214 -31.524  -7.541
  214   HG22  VAL  94          HG22      VAL  94  -0.533 -30.908  -6.030
  215   HG23  VAL  94          HG23      VAL  94   0.452 -31.950  -7.072
  216    H    SER  95           H        SER  95  -0.058 -33.475  -9.002
  217    HA   SER  95           HA       SER  95   1.666 -35.791  -9.216
  218    HB2  SER  95           HB2      SER  95   1.042 -34.361 -11.161
  219    HB3  SER  95           HB3      SER  95   2.016 -33.044 -10.472
  220    HG   SER  95           HG       SER  95   2.845 -35.517 -11.571
  221    H    THR  96           H        THR  96   3.933 -35.923  -8.845
  222    HA   THR  96           HA       THR  96   4.939 -34.492  -6.498
  223    HB   THR  96           HB       THR  96   7.014 -35.823  -6.940
  224    HG1  THR  96           HG1      THR  96   6.808 -37.448  -8.569
  225   HG21  THR  96          HG21      THR  96   6.060 -38.002  -6.399
  226   HG22  THR  96          HG22      THR  96   5.167 -36.745  -5.531
  227   HG23  THR  96          HG23      THR  96   4.457 -37.489  -6.977
  228    H    ARG  97           H        ARG  97   5.679 -34.501  -9.975
  229    HA   ARG  97           HA       ARG  97   7.124 -31.885  -9.700
  230    HB2  ARG  97           HB2      ARG  97   8.950 -32.701 -11.062
  231    HB3  ARG  97           HB3      ARG  97   8.749 -33.716  -9.638
  232    HG2  ARG  97           HG2      ARG  97   7.590 -35.446 -11.030
  233    HG3  ARG  97           HG3      ARG  97   7.749 -34.399 -12.444
  234    HD2  ARG  97           HD2      ARG  97   9.468 -36.042 -12.567
  235    HD3  ARG  97           HD3      ARG  97  10.226 -34.484 -12.208
  236    HE   ARG  97           HE       ARG  97   9.646 -35.982  -9.790
  237   HH11  ARG  97          HH12      ARG  97  11.987 -35.912 -12.399
  238   HH12  ARG  97          HH11      ARG  97  13.230 -36.649 -11.425
  239   HH21  ARG  97          HH21      ARG  97  11.288 -36.911  -8.597
  240   HH22  ARG  97          HH22      ARG  97  12.836 -37.203  -9.334
  241    H    GLY  98           H        GLY  98   4.738 -33.533 -11.470
  242    HA2  GLY  98           HA2      GLY  98   5.113 -32.133 -14.025
  243    HA3  GLY  98           HA3      GLY  98   3.784 -33.193 -13.561
  244    H    ARG  99           H        ARG  99   2.915 -31.203 -14.897
  245    HA   ARG  99           HA       ARG  99   2.304 -28.743 -13.533
  246    HB2  ARG  99           HB2      ARG  99   2.198 -29.091 -15.991
  247    HB3  ARG  99           HB3      ARG  99   0.799 -30.151 -15.788
  248    HG2  ARG  99           HG2      ARG  99  -0.508 -28.258 -14.864
  249    HG3  ARG  99           HG3      ARG  99   0.915 -27.200 -14.990
  250    HD2  ARG  99           HD2      ARG  99   0.937 -27.528 -17.439
  251    HD3  ARG  99           HD3      ARG  99  -0.479 -28.595 -17.314
  252    HE   ARG  99           HE       ARG  99  -1.152 -26.137 -16.069
  253   HH11  ARG  99          HH11      ARG  99  -0.464 -27.234 -19.331
  254   HH12  ARG  99          HH12      ARG  99  -1.443 -25.990 -20.055
  255   HH21  ARG  99          HH21      ARG  99  -2.382 -24.567 -17.061
  256   HH22  ARG  99          HH22      ARG  99  -2.509 -24.532 -18.795
  257    H    ILE 100           H        ILE 100   0.683 -28.155 -12.185
  258    HA   ILE 100           HA       ILE 100  -0.714 -30.270 -10.761
  259    HB   ILE 100           HB       ILE 100  -0.670 -27.279 -10.339
  260   HG12  ILE 100          HG12      ILE 100   0.678 -29.682  -8.994
  261   HG13  ILE 100          HG13      ILE 100   1.468 -28.415  -9.928
  262   HG21  ILE 100          HG21      ILE 100  -1.795 -27.707  -8.196
  263   HG22  ILE 100          HG22      ILE 100  -2.825 -28.228  -9.504
  264   HG23  ILE 100          HG23      ILE 100  -1.919 -29.439  -8.566
  265   HD11  ILE 100          HD11      ILE 100   0.736 -26.757  -8.156
  266   HD12  ILE 100          HD12      ILE 100   0.217 -28.160  -7.178
  267   HD13  ILE 100          HD13      ILE 100   1.911 -27.992  -7.644
  268    HA   PRO 101           HA       PRO 101  -4.465 -29.945 -13.253
  269    HB2  PRO 101           HB2      PRO 101  -5.891 -31.250 -10.979
  270    HB3  PRO 101           HB3      PRO 101  -5.759 -31.771 -12.680
  271    HG2  PRO 101           HG2      PRO 101  -4.389 -33.002 -10.635
  272    HG3  PRO 101           HG3      PRO 101  -3.709 -32.844 -12.291
  273    HD2  PRO 101           HD2      PRO 101  -3.104 -31.205  -9.833
  274    HD3  PRO 101           HD3      PRO 101  -2.013 -31.825 -11.108
  275    H    ALA 102           H        ALA 102  -6.192 -28.534 -13.409
  276    HA   ALA 102           HA       ALA 102  -6.435 -26.362 -11.675
  277    HB1  ALA 102           HB1      ALA 102  -8.385 -25.788 -12.966
  278    HB2  ALA 102           HB2      ALA 102  -7.106 -26.405 -14.037
  279    HB3  ALA 102           HB3      ALA 102  -8.494 -27.446 -13.615
  280    H    ASP 103           H        ASP 103  -8.119 -29.472 -11.520
  281    HA   ASP 103           HA       ASP 103 -10.103 -28.980  -9.678
  282    HB2  ASP 103           HB2      ASP 103  -9.798 -31.144 -10.729
  283    HB3  ASP 103           HB3      ASP 103  -8.201 -31.329 -10.010
  284    H    VAL 104           H        VAL 104  -6.613 -29.496  -9.071
  285    HA   VAL 104           HA       VAL 104  -6.903 -29.387  -6.211
  286    HB   VAL 104           HB       VAL 104  -4.278 -29.133  -7.620
  287   HG11  VAL 104          HG11      VAL 104  -5.102 -30.425  -4.987
  288   HG12  VAL 104          HG12      VAL 104  -3.450 -30.399  -5.657
  289   HG13  VAL 104          HG13      VAL 104  -4.236 -28.886  -5.184
  290   HG21  VAL 104          HG21      VAL 104  -4.080 -31.638  -7.559
  291   HG22  VAL 104          HG22      VAL 104  -5.813 -31.725  -7.177
  292   HG23  VAL 104          HG23      VAL 104  -5.267 -31.066  -8.728
  293    H    ILE 105           H        ILE 105  -5.856 -27.135  -8.751
  294    HA   ILE 105           HA       ILE 105  -5.057 -24.973  -7.013
  295    HB   ILE 105           HB       ILE 105  -6.125 -25.069  -9.869
  296   HG12  ILE 105          HG12      ILE 105  -3.293 -24.316  -9.101
  297   HG13  ILE 105          HG13      ILE 105  -3.718 -26.013  -8.957
  298   HG21  ILE 105          HG21      ILE 105  -6.575 -22.818  -9.070
  299   HG22  ILE 105          HG22      ILE 105  -4.956 -22.703  -8.330
  300   HG23  ILE 105          HG23      ILE 105  -5.145 -22.758 -10.096
  301   HD11  ILE 105          HD11      ILE 105  -4.076 -24.413 -11.519
  302   HD12  ILE 105          HD12      ILE 105  -2.696 -25.472 -11.134
  303   HD13  ILE 105          HD13      ILE 105  -4.321 -26.161 -11.273
  304    H    ASP 106           H        ASP 106  -8.271 -25.728  -8.514
  305    HA   ASP 106           HA       ASP 106  -9.697 -23.726  -7.187
  306    HB2  ASP 106           HB2      ASP 106 -10.543 -24.991  -9.104
  307    HB3  ASP 106           HB3      ASP 106 -10.617 -26.462  -8.130
  308    H    ALA 107           H        ALA 107  -9.124 -27.158  -6.146
  309    HA   ALA 107           HA       ALA 107 -10.440 -27.112  -3.743
  310    HB1  ALA 107           HB1      ALA 107  -8.966 -28.986  -3.144
  311    HB2  ALA 107           HB2      ALA 107  -9.428 -29.096  -4.840
  312    HB3  ALA 107           HB3      ALA 107  -7.805 -28.520  -4.408
  313    H    TYR 108           H        TYR 108  -7.048 -26.091  -4.334
  314    HA   TYR 108           HA       TYR 108  -6.363 -25.283  -1.705
  315    HB2  TYR 108           HB2      TYR 108  -4.698 -25.615  -3.381
  316    HB3  TYR 108           HB3      TYR 108  -5.441 -24.468  -4.477
  317    HD1  TYR 108           HD1      TYR 108  -3.443 -24.818  -1.391
  318    HD2  TYR 108           HD2      TYR 108  -5.033 -22.087  -4.321
  319    HE1  TYR 108           HE1      TYR 108  -1.865 -23.055  -0.598
  320    HE2  TYR 108           HE2      TYR 108  -3.468 -20.322  -3.522
  321    HH   TYR 108           HH       TYR 108  -1.783 -19.777  -2.040
  322    H    HIS 109           H        HIS 109  -7.847 -23.338  -4.384
  323    HA   HIS 109           HA       HIS 109  -8.071 -20.944  -2.766
  324    HB2  HIS 109           HB2      HIS 109  -9.434 -21.835  -5.333
  325    HB3  HIS 109           HB3      HIS 109  -9.823 -20.312  -4.531
  326    HD1  HIS 109           HD1      HIS 109  -7.427 -18.732  -4.012
  327    HD2  HIS 109           HD2      HIS 109  -7.568 -21.569  -7.128
  328    HE1  HIS 109           HE1      HIS 109  -5.536 -18.107  -5.648
  329    HE2  HIS 109           HE2      HIS 109  -5.638 -19.830  -7.558
  330    H    ALA 110           H        ALA 110 -10.404 -23.634  -3.286
  331    HA   ALA 110           HA       ALA 110 -12.635 -22.497  -2.052
  332    HB1  ALA 110           HB1      ALA 110 -13.365 -24.814  -1.694
  333    HB2  ALA 110           HB2      ALA 110 -12.602 -24.645  -3.285
  334    HB3  ALA 110           HB3      ALA 110 -11.707 -25.403  -1.943
  335    H    ALA 111           H        ALA 111  -9.868 -24.099  -0.428
  336    HA   ALA 111           HA       ALA 111 -10.796 -24.316   2.138
  337    HB1  ALA 111           HB1      ALA 111  -8.004 -23.532   1.216
  338    HB2  ALA 111           HB2      ALA 111  -8.407 -24.336   2.743
  339    HB3  ALA 111           HB3      ALA 111  -8.651 -25.194   1.208
  340    H    THR 112           H        THR 112  -9.611 -21.395   0.552
  341    HA   THR 112           HA       THR 112 -10.039 -19.764   3.035
  342    HB   THR 112           HB       THR 112  -8.734 -18.010   1.898
  343    HG1  THR 112           HG1      THR 112  -7.607 -18.560   0.022
  344   HG21  THR 112          HG21      THR 112  -7.254 -20.675   2.009
  345   HG22  THR 112          HG22      THR 112  -6.545 -19.050   2.128
  346   HG23  THR 112          HG23      THR 112  -7.611 -19.637   3.411
  347    H    LEU 113           H        LEU 113 -11.341 -20.203  -0.209
  348    HA   LEU 113           HA       LEU 113 -12.730 -17.671  -0.236
  349    HB2  LEU 113           HB2      LEU 113 -11.746 -18.710  -2.215
  350    HB3  LEU 113           HB3      LEU 113 -12.761 -20.141  -1.999
  351    HG   LEU 113           HG       LEU 113 -14.765 -18.820  -2.446
  352   HD11  LEU 113          HD11      LEU 113 -14.551 -16.538  -3.451
  353   HD12  LEU 113          HD12      LEU 113 -14.045 -16.559  -1.764
  354   HD13  LEU 113          HD13      LEU 113 -12.820 -16.542  -3.050
  355   HD21  LEU 113          HD21      LEU 113 -12.608 -18.563  -4.582
  356   HD22  LEU 113          HD22      LEU 113 -13.606 -20.003  -4.266
  357   HD23  LEU 113          HD23      LEU 113 -14.363 -18.518  -4.863
  358    H    GLU 114           H        GLU 114 -13.686 -21.009   0.564
  359    HA   GLU 114           HA       GLU 114 -16.525 -20.387   0.443
  360    HB2  GLU 114           HB2      GLU 114 -14.926 -22.803   0.789
  361    HB3  GLU 114           HB3      GLU 114 -16.259 -22.785   1.922
  362    HG2  GLU 114           HG2      GLU 114 -16.646 -22.213  -1.043
  363    HG3  GLU 114           HG3      GLU 114 -16.642 -23.843  -0.379
  364    H    HIS 115           H        HIS 115 -18.049 -20.807   2.139
  365    HA   HIS 115           HA       HIS 115 -17.679 -18.940   4.303
  366    HB2  HIS 115           HB2      HIS 115 -19.931 -20.924   3.742
  367    HB3  HIS 115           HB3      HIS 115 -20.018 -19.587   4.886
  368    HD1  HIS 115           HD1      HIS 115 -19.835 -20.190   1.067
  369    HD2  HIS 115           HD2      HIS 115 -20.575 -17.170   3.944
  370    HE1  HIS 115           HE1      HIS 115 -20.811 -18.166  -0.217
  371    HE2  HIS 115           HE2      HIS 115 -21.246 -16.336   1.543
  372    H    HIS 116           H        HIS 116 -17.741 -19.249   6.522
  373    HA   HIS 116           HA       HIS 116 -17.059 -20.116   8.516
  374    HB2  HIS 116           HB2      HIS 116 -18.719 -22.510   7.666
  375    HB3  HIS 116           HB3      HIS 116 -18.397 -21.967   9.310
  376    HD1  HIS 116           HD1      HIS 116 -21.172 -21.911   7.077
  377    HD2  HIS 116           HD2      HIS 116 -19.224 -19.051   9.502
  378    HE1  HIS 116           HE1      HIS 116 -22.864 -20.009   7.461
  379    HE2  HIS 116           HE2      HIS 116 -21.674 -18.276   8.950
  380    H    HIS 117           H        HIS 117 -15.033 -20.544   6.569
  381    HA   HIS 117           HA       HIS 117 -14.011 -23.265   6.839
  382    HB2  HIS 117           HB2      HIS 117 -12.206 -22.546   5.423
  383    HB3  HIS 117           HB3      HIS 117 -13.733 -21.977   4.778
  384    HD1  HIS 117           HD1      HIS 117 -13.846 -19.415   4.250
  385    HD2  HIS 117           HD2      HIS 117 -10.593 -20.608   6.670
  386    HE1  HIS 117           HE1      HIS 117 -12.348 -17.331   4.548
  387    HE2  HIS 117           HE2      HIS 117 -10.370 -18.069   6.031
  388    H    HIS 118           H        HIS 118 -13.565 -20.458   8.791
  389    HA   HIS 118           HA       HIS 118 -11.022 -21.398   9.979
  390    HB2  HIS 118           HB2      HIS 118 -11.227 -19.261  11.335
  391    HB3  HIS 118           HB3      HIS 118 -11.001 -19.097   9.607
  392    HD1  HIS 118           HD1      HIS 118 -13.589 -18.330  12.325
  393    HD2  HIS 118           HD2      HIS 118 -12.935 -17.950   8.160
  394    HE1  HIS 118           HE1      HIS 118 -15.405 -16.743  11.443
  395    HE2  HIS 118           HE2      HIS 118 -15.001 -16.502   8.906
  396    H    HIS 119           H        HIS 119 -10.729 -21.956  12.130
  397    HA   HIS 119           HA       HIS 119 -12.747 -23.781  13.046
  398    HB2  HIS 119           HB2      HIS 119 -10.294 -24.177  13.093
  399    HB3  HIS 119           HB3      HIS 119 -10.117 -22.942  14.342
  400    HD1  HIS 119           HD1      HIS 119 -10.111 -23.947  16.758
  401    HD2  HIS 119           HD2      HIS 119 -12.133 -26.291  13.875
  402    HE1  HIS 119           HE1      HIS 119 -10.882 -26.089  17.964
  403    HE2  HIS 119           HE2      HIS 119 -12.111 -27.512  16.203
  404    H    HIS 120           H        HIS 120 -11.920 -20.568  14.179
  405    HA   HIS 120           HA       HIS 120 -14.072 -20.706  16.250
  406    HB2  HIS 120           HB2      HIS 120 -11.696 -20.644  17.161
  407    HB3  HIS 120           HB3      HIS 120 -11.537 -19.042  16.450
  408    HD1  HIS 120           HD1      HIS 120 -14.630 -18.211  17.407
  409    HD2  HIS 120           HD2      HIS 120 -11.411 -19.747  19.660
  410    HE1  HIS 120           HE1      HIS 120 -15.051 -17.497  19.878
  411    HE2  HIS 120           HE2      HIS 120 -13.072 -18.442  21.230
  Start of MODEL   14
    1    H1   SER  66           H1       SER  66  14.687   1.893  -0.950
    2    H2   SER  66           H2       SER  66  14.346   3.376  -0.349
    3    H3   SER  66           H3       SER  66  13.820   2.963  -1.845
    4    HA   SER  66           HA       SER  66  15.717   4.445  -1.996
    5    HB2  SER  66           HB2      SER  66  17.943   3.586  -1.234
    6    HB3  SER  66           HB3      SER  66  16.819   3.908   0.091
    7    HG   SER  66           HG       SER  66  17.891   1.875   0.317
    8    H    GLY  67           H        GLY  67  17.481   4.168  -3.609
    9    HA2  GLY  67           HA2      GLY  67  18.363   3.300  -5.565
   10    HA3  GLY  67           HA3      GLY  67  17.713   1.719  -5.160
   11    H    SER  68           H        SER  68  17.455   1.784  -7.564
   12    HA   SER  68           HA       SER  68  14.701   2.546  -8.320
   13    HB2  SER  68           HB2      SER  68  15.435   3.629 -10.396
   14    HB3  SER  68           HB3      SER  68  16.011   4.499  -8.970
   15    HG   SER  68           HG       SER  68  17.664   4.266 -10.553
   16    H    GLY  69           H        GLY  69  14.031   1.613 -10.407
   17    HA2  GLY  69           HA2      GLY  69  15.500  -0.420 -11.779
   18    HA3  GLY  69           HA3      GLY  69  14.439  -1.173 -10.583
   19    H    ARG  70           H        ARG  70  13.983  -1.887 -13.058
   20    HA   ARG  70           HA       ARG  70  11.453  -0.537 -13.923
   21    HB2  ARG  70           HB2      ARG  70  13.702  -1.549 -15.730
   22    HB3  ARG  70           HB3      ARG  70  12.131  -1.023 -16.302
   23    HG2  ARG  70           HG2      ARG  70  14.200   0.732 -14.911
   24    HG3  ARG  70           HG3      ARG  70  13.871   0.693 -16.635
   25    HD2  ARG  70           HD2      ARG  70  11.893   1.574 -14.491
   26    HD3  ARG  70           HD3      ARG  70  12.860   2.642 -15.510
   27    HE   ARG  70           HE       ARG  70  11.505   1.051 -17.334
   28   HH11  ARG  70          HH11      ARG  70  10.493   3.289 -14.832
   29   HH12  ARG  70          HH12      ARG  70   9.009   3.684 -15.657
   30   HH21  ARG  70          HH21      ARG  70   9.589   1.582 -18.324
   31   HH22  ARG  70          HH22      ARG  70   8.521   2.742 -17.592
   32    H    GLY  71           H        GLY  71  10.003  -1.788 -15.126
   33    HA2  GLY  71           HA2      GLY  71   8.706  -3.682 -15.480
   34    HA3  GLY  71           HA3      GLY  71  10.139  -4.676 -15.234
   35    H    ARG  72           H        ARG  72   9.173  -6.184 -14.005
   36    HA   ARG  72           HA       ARG  72   8.664  -5.640 -11.160
   37    HB2  ARG  72           HB2      ARG  72   6.467  -6.706 -11.104
   38    HB3  ARG  72           HB3      ARG  72   6.420  -5.271 -12.116
   39    HG2  ARG  72           HG2      ARG  72   6.330  -6.548 -14.142
   40    HG3  ARG  72           HG3      ARG  72   6.797  -8.044 -13.328
   41    HD2  ARG  72           HD2      ARG  72   4.684  -8.039 -12.041
   42    HD3  ARG  72           HD3      ARG  72   4.206  -6.536 -12.832
   43    HE   ARG  72           HE       ARG  72   3.637  -7.689 -14.747
   44   HH11  ARG  72          HH11      ARG  72   5.498  -9.984 -12.784
   45   HH12  ARG  72          HH12      ARG  72   4.978 -11.321 -13.772
   46   HH21  ARG  72          HH21      ARG  72   3.095  -9.451 -15.947
   47   HH22  ARG  72          HH22      ARG  72   3.700 -11.024 -15.529
   48    H    GLY  73           H        GLY  73   8.229  -7.656  -9.924
   49    HA2  GLY  73           HA2      GLY  73   9.972  -9.888 -10.685
   50    HA3  GLY  73           HA3      GLY  73   9.004  -9.748  -9.222
   51    H    ALA  74           H        ALA  74   9.075 -12.149 -10.307
   52    HA   ALA  74           HA       ALA  74   6.304 -12.661 -11.162
   53    HB1  ALA  74           HB1      ALA  74   8.715 -13.655 -12.754
   54    HB2  ALA  74           HB2      ALA  74   7.018 -14.094 -13.050
   55    HB3  ALA  74           HB3      ALA  74   7.555 -12.423 -13.297
   56    H    ILE  75           H        ILE  75   5.714 -14.947 -10.976
   57    HA   ILE  75           HA       ILE  75   6.878 -16.215  -8.612
   58    HB   ILE  75           HB       ILE  75   4.684 -17.138 -10.498
   59   HG12  ILE  75          HG12      ILE  75   4.358 -16.071  -7.660
   60   HG13  ILE  75          HG13      ILE  75   4.286 -15.010  -9.059
   61   HG21  ILE  75          HG21      ILE  75   5.671 -19.098  -9.365
   62   HG22  ILE  75          HG22      ILE  75   5.529 -18.287  -7.788
   63   HG23  ILE  75          HG23      ILE  75   4.089 -18.781  -8.703
   64   HD11  ILE  75          HD11      ILE  75   2.043 -15.616  -8.390
   65   HD12  ILE  75          HD12      ILE  75   2.395 -16.274  -9.999
   66   HD13  ILE  75          HD13      ILE  75   2.394 -17.340  -8.580
   67    H    ASP  76           H        ASP  76   8.373 -17.799  -8.556
   68    HA   ASP  76           HA       ASP  76   9.296 -19.096 -11.080
   69    HB2  ASP  76           HB2      ASP  76  11.028 -18.260  -9.607
   70    HB3  ASP  76           HB3      ASP  76  10.398 -19.198  -8.257
   71    H    ARG  77           H        ARG  77   8.714 -20.414  -7.815
   72    HA   ARG  77           HA       ARG  77   6.628 -22.278  -8.842
   73    HB2  ARG  77           HB2      ARG  77   7.837 -24.193  -8.068
   74    HB3  ARG  77           HB3      ARG  77   8.921 -23.218  -9.064
   75    HG2  ARG  77           HG2      ARG  77   9.861 -22.233  -6.881
   76    HG3  ARG  77           HG3      ARG  77   8.956 -23.503  -6.034
   77    HD2  ARG  77           HD2      ARG  77  10.146 -25.221  -7.373
   78    HD3  ARG  77           HD3      ARG  77  11.045 -23.962  -8.212
   79    HE   ARG  77           HE       ARG  77  11.468 -24.958  -5.486
   80   HH11  ARG  77          HH11      ARG  77  12.240 -22.260  -7.644
   81   HH12  ARG  77          HH12      ARG  77  13.688 -21.884  -6.746
   82   HH21  ARG  77          HH21      ARG  77  13.289 -24.355  -4.388
   83   HH22  ARG  77          HH22      ARG  77  14.240 -23.006  -4.936
   84    H    GLU  78           H        GLU  78   7.122 -20.036  -6.537
   85    HA   GLU  78           HA       GLU  78   6.736 -21.356  -4.067
   86    HB2  GLU  78           HB2      GLU  78   6.106 -18.522  -4.967
   87    HB3  GLU  78           HB3      GLU  78   5.957 -19.063  -3.290
   88    HG2  GLU  78           HG2      GLU  78   8.352 -19.740  -3.293
   89    HG3  GLU  78           HG3      GLU  78   8.520 -19.128  -4.940
   90    H    GLN  79           H        GLN  79   4.174 -19.939  -6.181
   91    HA   GLN  79           HA       GLN  79   2.049 -20.686  -4.340
   92    HB2  GLN  79           HB2      GLN  79   1.914 -20.009  -7.307
   93    HB3  GLN  79           HB3      GLN  79   0.532 -20.146  -6.221
   94    HG2  GLN  79           HG2      GLN  79   2.774 -18.084  -6.014
   95    HG3  GLN  79           HG3      GLN  79   1.133 -17.797  -6.583
   96   HE21  GLN  79          HE22      GLN  79  -0.686 -18.054  -4.977
   97   HE22  GLN  79          HE21      GLN  79  -0.311 -17.759  -3.285
   98    H    SER  80           H        SER  80   3.437 -22.262  -7.234
   99    HA   SER  80           HA       SER  80   1.705 -24.516  -7.321
  100    HB2  SER  80           HB2      SER  80   4.633 -24.207  -8.122
  101    HB3  SER  80           HB3      SER  80   3.594 -25.583  -8.570
  102    HG   SER  80           HG       SER  80   3.636 -23.928 -10.204
  103    H    ALA  81           H        ALA  81   4.818 -24.079  -5.539
  104    HA   ALA  81           HA       ALA  81   4.814 -26.588  -4.259
  105    HB1  ALA  81           HB1      ALA  81   6.775 -25.111  -4.449
  106    HB2  ALA  81           HB2      ALA  81   6.007 -23.932  -3.366
  107    HB3  ALA  81           HB3      ALA  81   6.456 -25.536  -2.753
  108    H    ALA  82           H        ALA  82   3.334 -23.463  -3.201
  109    HA   ALA  82           HA       ALA  82   2.366 -24.411  -0.696
  110    HB1  ALA  82           HB1      ALA  82   2.503 -22.023  -1.339
  111    HB2  ALA  82           HB2      ALA  82   1.188 -22.265  -2.512
  112    HB3  ALA  82           HB3      ALA  82   0.881 -22.477  -0.781
  113    H    ILE  83           H        ILE  83   0.770 -24.467  -3.933
  114    HA   ILE  83           HA       ILE  83  -1.642 -25.733  -3.038
  115    HB   ILE  83           HB       ILE  83  -0.305 -25.727  -5.767
  116   HG12  ILE  83          HG12      ILE  83  -2.784 -24.178  -4.957
  117   HG13  ILE  83          HG13      ILE  83  -1.196 -23.504  -4.645
  118   HG21  ILE  83          HG21      ILE  83  -2.647 -26.333  -6.599
  119   HG22  ILE  83          HG22      ILE  83  -1.829 -27.630  -5.733
  120   HG23  ILE  83          HG23      ILE  83  -3.090 -26.671  -4.923
  121   HD11  ILE  83          HD11      ILE  83  -2.290 -24.261  -7.380
  122   HD12  ILE  83          HD12      ILE  83  -2.047 -22.631  -6.739
  123   HD13  ILE  83          HD13      ILE  83  -0.646 -23.667  -7.071
  124    H    ARG  84           H        ARG  84   1.407 -27.163  -4.310
  125    HA   ARG  84           HA       ARG  84   0.574 -29.917  -4.063
  126    HB2  ARG  84           HB2      ARG  84   3.279 -28.519  -4.224
  127    HB3  ARG  84           HB3      ARG  84   3.175 -30.266  -3.937
  128    HG2  ARG  84           HG2      ARG  84   1.902 -30.615  -5.953
  129    HG3  ARG  84           HG3      ARG  84   1.794 -28.880  -6.276
  130    HD2  ARG  84           HD2      ARG  84   4.154 -28.736  -6.734
  131    HD3  ARG  84           HD3      ARG  84   4.433 -30.392  -6.154
  132    HE   ARG  84           HE       ARG  84   2.946 -31.196  -7.999
  133   HH11  ARG  84          HH11      ARG  84   5.063 -28.469  -8.578
  134   HH12  ARG  84          HH12      ARG  84   4.871 -28.597 -10.302
  135   HH21  ARG  84          HH21      ARG  84   2.585 -31.169 -10.170
  136   HH22  ARG  84          HH22      ARG  84   3.543 -30.120 -11.175
  137    H    GLU  85           H        GLU  85   2.435 -27.914  -1.702
  138    HA   GLU  85           HA       GLU  85   2.477 -29.922   0.253
  139    HB2  GLU  85           HB2      GLU  85   3.924 -27.864   0.136
  140    HB3  GLU  85           HB3      GLU  85   2.562 -26.976   0.840
  141    HG2  GLU  85           HG2      GLU  85   4.030 -27.666   2.638
  142    HG3  GLU  85           HG3      GLU  85   2.556 -28.640   2.710
  143    H    TRP  86           H        TRP  86   0.029 -27.303  -0.177
  144    HA   TRP  86           HA       TRP  86  -1.658 -28.027   1.899
  145    HB2  TRP  86           HB2      TRP  86  -1.994 -26.026   0.580
  146    HB3  TRP  86           HB3      TRP  86  -2.298 -26.977  -0.874
  147    HD1  TRP  86           HD1      TRP  86  -3.947 -25.773   2.313
  148    HE1  TRP  86           HE1      TRP  86  -6.436 -26.384   2.339
  149    HE3  TRP  86           HE3      TRP  86  -4.147 -28.572  -1.981
  150    HZ2  TRP  86           HZ2      TRP  86  -8.206 -28.156   0.888
  151    HZ3  TRP  86           HZ3      TRP  86  -6.223 -29.806  -2.568
  152    HH2  TRP  86           HH2      TRP  86  -8.231 -29.649  -1.106
  153    H    ALA  87           H        ALA  87  -1.604 -29.388  -1.452
  154    HA   ALA  87           HA       ALA  87  -3.746 -31.212  -1.011
  155    HB1  ALA  87           HB1      ALA  87  -1.415 -31.341  -2.981
  156    HB2  ALA  87           HB2      ALA  87  -2.934 -32.248  -3.117
  157    HB3  ALA  87           HB3      ALA  87  -2.944 -30.476  -3.230
  158    H    ARG  88           H        ARG  88  -0.218 -31.657  -0.593
  159    HA   ARG  88           HA       ARG  88  -0.231 -34.425   0.199
  160    HB2  ARG  88           HB2      ARG  88   1.597 -32.049   0.672
  161    HB3  ARG  88           HB3      ARG  88   1.946 -33.601   1.427
  162    HG2  ARG  88           HG2      ARG  88   2.375 -34.688  -0.577
  163    HG3  ARG  88           HG3      ARG  88   1.427 -33.556  -1.545
  164    HD2  ARG  88           HD2      ARG  88   3.927 -33.418  -1.871
  165    HD3  ARG  88           HD3      ARG  88   3.093 -31.912  -1.544
  166    HE   ARG  88           HE       ARG  88   3.929 -31.894   0.738
  167   HH11  ARG  88          HH11      ARG  88   5.544 -34.425  -1.088
  168   HH12  ARG  88          HH12      ARG  88   7.017 -34.219  -0.180
  169   HH21  ARG  88          HH21      ARG  88   5.812 -31.510   1.607
  170   HH22  ARG  88          HH22      ARG  88   7.146 -32.638   1.406
  171    H    ARG  89           H        ARG  89  -0.580 -31.448   2.153
  172    HA   ARG  89           HA       ARG  89  -0.926 -32.836   4.686
  173    HB2  ARG  89           HB2      ARG  89  -1.209 -30.021   3.651
  174    HB3  ARG  89           HB3      ARG  89  -2.113 -30.425   5.095
  175    HG2  ARG  89           HG2      ARG  89   0.034 -29.486   5.697
  176    HG3  ARG  89           HG3      ARG  89  -0.143 -31.145   6.272
  177    HD2  ARG  89           HD2      ARG  89   1.290 -31.904   4.332
  178    HD3  ARG  89           HD3      ARG  89   1.572 -30.200   3.944
  179    HE   ARG  89           HE       ARG  89   2.162 -30.428   6.658
  180   HH11  ARG  89          HH11      ARG  89   3.659 -31.692   3.742
  181   HH12  ARG  89          HH12      ARG  89   4.983 -32.390   4.642
  182   HH21  ARG  89          HH21      ARG  89   3.972 -31.150   7.683
  183   HH22  ARG  89          HH22      ARG  89   5.220 -31.966   6.789
  184    H    ASN  90           H        ASN  90  -3.232 -31.983   2.174
  185    HA   ASN  90           HA       ASN  90  -5.511 -32.892   3.846
  186    HB2  ASN  90           HB2      ASN  90  -5.302 -31.527   1.143
  187    HB3  ASN  90           HB3      ASN  90  -6.820 -32.177   1.764
  188   HD21  ASN  90          HD22      ASN  90  -4.331 -29.731   2.337
  189   HD22  ASN  90          HD21      ASN  90  -5.315 -28.786   3.453
  190    H    GLY  91           H        GLY  91  -3.295 -34.543   1.947
  191    HA2  GLY  91           HA2      GLY  91  -3.246 -36.717   1.221
  192    HA3  GLY  91           HA3      GLY  91  -4.843 -36.986   1.931
  193    H    HIS  92           H        HIS  92  -4.390 -34.441  -0.461
  194    HA   HIS  92           HA       HIS  92  -6.309 -35.822  -2.268
  195    HB2  HIS  92           HB2      HIS  92  -6.703 -33.474  -1.410
  196    HB3  HIS  92           HB3      HIS  92  -5.342 -32.937  -2.383
  197    HD1  HIS  92           HD1      HIS  92  -8.961 -34.149  -2.707
  198    HD2  HIS  92           HD2      HIS  92  -5.735 -32.819  -5.087
  199    HE1  HIS  92           HE1      HIS  92  -9.928 -33.674  -5.050
  200    HE2  HIS  92           HE2      HIS  92  -7.977 -32.865  -6.509
  201    H    ASN  93           H        ASN  93  -5.921 -36.187  -4.475
  202    HA   ASN  93           HA       ASN  93  -3.246 -36.970  -5.147
  203    HB2  ASN  93           HB2      ASN  93  -5.355 -38.057  -5.942
  204    HB3  ASN  93           HB3      ASN  93  -5.695 -36.639  -6.939
  205   HD21  ASN  93          HD22      ASN  93  -5.743 -38.478  -8.603
  206   HD22  ASN  93          HD21      ASN  93  -4.204 -38.866  -9.356
  207    H    VAL  94           H        VAL  94  -1.625 -35.943  -6.264
  208    HA   VAL  94           HA       VAL  94  -2.134 -33.620  -7.947
  209    HB   VAL  94           HB       VAL  94  -1.967 -32.670  -5.634
  210   HG11  VAL  94          HG11      VAL  94   0.187 -32.448  -4.531
  211   HG12  VAL  94          HG12      VAL  94  -0.220 -34.159  -4.694
  212   HG13  VAL  94          HG13      VAL  94   0.983 -33.419  -5.778
  213   HG21  VAL  94          HG21      VAL  94  -0.605 -30.790  -6.239
  214   HG22  VAL  94          HG22      VAL  94   0.238 -31.721  -7.496
  215   HG23  VAL  94          HG23      VAL  94  -1.496 -31.337  -7.662
  216    H    SER  95           H        SER  95  -0.409 -33.126  -9.395
  217    HA   SER  95           HA       SER  95   1.321 -35.355 -10.072
  218    HB2  SER  95           HB2      SER  95   2.051 -33.836 -11.889
  219    HB3  SER  95           HB3      SER  95   0.283 -33.962 -11.780
  220    HG   SER  95           HG       SER  95   0.821 -31.807 -11.963
  221    H    THR  96           H        THR  96   3.669 -35.277 -10.197
  222    HA   THR  96           HA       THR  96   4.874 -33.861  -7.899
  223    HB   THR  96           HB       THR  96   6.833 -35.334  -8.421
  224    HG1  THR  96           HG1      THR  96   6.392 -37.046  -9.900
  225   HG21  THR  96          HG21      THR  96   5.077 -36.020  -6.785
  226   HG22  THR  96          HG22      THR  96   4.173 -36.807  -8.099
  227   HG23  THR  96          HG23      THR  96   5.785 -37.404  -7.635
  228    H    ARG  97           H        ARG  97   5.780 -34.288 -11.333
  229    HA   ARG  97           HA       ARG  97   7.455 -31.793 -11.184
  230    HB2  ARG  97           HB2      ARG  97   7.670 -34.236 -12.991
  231    HB3  ARG  97           HB3      ARG  97   8.764 -32.860 -13.002
  232    HG2  ARG  97           HG2      ARG  97   8.378 -34.837 -10.716
  233    HG3  ARG  97           HG3      ARG  97   9.744 -34.767 -11.818
  234    HD2  ARG  97           HD2      ARG  97   8.982 -32.622  -9.791
  235    HD3  ARG  97           HD3      ARG  97  10.281 -33.812  -9.623
  236    HE   ARG  97           HE       ARG  97  10.831 -32.504 -12.024
  237   HH11  ARG  97          HH11      ARG  97  10.644 -31.516  -8.661
  238   HH12  ARG  97          HH12      ARG  97  11.769 -30.207  -8.891
  239   HH21  ARG  97          HH21      ARG  97  12.246 -30.806 -12.244
  240   HH22  ARG  97          HH22      ARG  97  12.662 -29.827 -10.867
  241    H    GLY  98           H        GLY  98   4.759 -33.085 -12.962
  242    HA2  GLY  98           HA2      GLY  98   5.012 -31.316 -15.278
  243    HA3  GLY  98           HA3      GLY  98   3.653 -32.360 -14.867
  244    H    ARG  99           H        ARG  99   2.480 -30.455 -15.731
  245    HA   ARG  99           HA       ARG  99   2.108 -28.082 -14.076
  246    HB2  ARG  99           HB2      ARG  99   1.645 -28.212 -16.526
  247    HB3  ARG  99           HB3      ARG  99   0.299 -29.308 -16.210
  248    HG2  ARG  99           HG2      ARG  99  -0.864 -27.521 -14.941
  249    HG3  ARG  99           HG3      ARG  99   0.532 -26.439 -15.175
  250    HD2  ARG  99           HD2      ARG  99   0.188 -26.555 -17.627
  251    HD3  ARG  99           HD3      ARG  99  -1.197 -27.644 -17.380
  252    HE   ARG  99           HE       ARG  99  -1.646 -25.291 -15.853
  253   HH11  ARG  99          HH11      ARG  99  -1.521 -26.154 -19.247
  254   HH12  ARG  99          HH12      ARG  99  -2.599 -24.868 -19.715
  255   HH21  ARG  99          HH21      ARG  99  -3.011 -23.657 -16.518
  256   HH22  ARG  99          HH22      ARG  99  -3.426 -23.503 -18.201
  257    H    ILE 100           H        ILE 100   0.479 -27.653 -12.557
  258    HA   ILE 100           HA       ILE 100  -0.469 -29.934 -11.027
  259    HB   ILE 100           HB       ILE 100  -0.875 -26.962 -10.686
  260   HG12  ILE 100          HG12      ILE 100   0.795 -29.087  -9.246
  261   HG13  ILE 100          HG13      ILE 100   1.415 -27.848 -10.336
  262   HG21  ILE 100          HG21      ILE 100  -2.844 -28.177  -9.708
  263   HG22  ILE 100          HG22      ILE 100  -1.716 -29.172  -8.747
  264   HG23  ILE 100          HG23      ILE 100  -1.849 -27.422  -8.492
  265   HD11  ILE 100          HD11      ILE 100   1.884 -27.160  -8.111
  266   HD12  ILE 100          HD12      ILE 100   0.590 -26.097  -8.716
  267   HD13  ILE 100          HD13      ILE 100   0.220 -27.426  -7.580
  268    HA   PRO 101           HA       PRO 101  -4.358 -30.349 -13.235
  269    HB2  PRO 101           HB2      PRO 101  -5.512 -31.680 -10.849
  270    HB3  PRO 101           HB3      PRO 101  -5.279 -32.323 -12.493
  271    HG2  PRO 101           HG2      PRO 101  -3.741 -33.108 -10.348
  272    HG3  PRO 101           HG3      PRO 101  -3.105 -33.024 -12.022
  273    HD2  PRO 101           HD2      PRO 101  -2.775 -31.043  -9.771
  274    HD3  PRO 101           HD3      PRO 101  -1.584 -31.627 -10.973
  275    H    ALA 102           H        ALA 102  -6.223 -29.129 -13.430
  276    HA   ALA 102           HA       ALA 102  -6.446 -26.836 -11.880
  277    HB1  ALA 102           HB1      ALA 102  -8.554 -28.044 -13.686
  278    HB2  ALA 102           HB2      ALA 102  -8.428 -26.345 -13.150
  279    HB3  ALA 102           HB3      ALA 102  -7.175 -27.033 -14.206
  280    H    ASP 103           H        ASP 103  -8.208 -29.908 -11.377
  281    HA   ASP 103           HA       ASP 103 -10.082 -28.894  -9.589
  282    HB2  ASP 103           HB2      ASP 103 -10.519 -31.098  -8.883
  283    HB3  ASP 103           HB3      ASP 103 -10.154 -31.162 -10.601
  284    H    VAL 104           H        VAL 104  -6.652 -29.669  -9.023
  285    HA   VAL 104           HA       VAL 104  -6.864 -29.450  -6.163
  286    HB   VAL 104           HB       VAL 104  -4.271 -29.095  -7.597
  287   HG11  VAL 104          HG11      VAL 104  -4.300 -28.873  -5.149
  288   HG12  VAL 104          HG12      VAL 104  -5.036 -30.479  -4.993
  289   HG13  VAL 104          HG13      VAL 104  -3.385 -30.304  -5.633
  290   HG21  VAL 104          HG21      VAL 104  -3.945 -31.593  -7.552
  291   HG22  VAL 104          HG22      VAL 104  -5.678 -31.762  -7.207
  292   HG23  VAL 104          HG23      VAL 104  -5.129 -31.053  -8.735
  293    H    ILE 105           H        ILE 105  -5.963 -27.291  -8.836
  294    HA   ILE 105           HA       ILE 105  -5.230 -24.994  -7.245
  295    HB   ILE 105           HB       ILE 105  -6.284 -25.376 -10.078
  296   HG12  ILE 105          HG12      ILE 105  -3.566 -24.251  -9.379
  297   HG13  ILE 105          HG13      ILE 105  -3.810 -25.961  -9.059
  298   HG21  ILE 105          HG21      ILE 105  -7.005 -23.139  -9.492
  299   HG22  ILE 105          HG22      ILE 105  -5.417 -22.770  -8.758
  300   HG23  ILE 105          HG23      ILE 105  -5.578 -23.012 -10.514
  301   HD11  ILE 105          HD11      ILE 105  -2.841 -25.529 -11.299
  302   HD12  ILE 105          HD12      ILE 105  -4.373 -26.424 -11.334
  303   HD13  ILE 105          HD13      ILE 105  -4.341 -24.693 -11.766
  304    H    ASP 106           H        ASP 106  -8.417 -25.955  -8.673
  305    HA   ASP 106           HA       ASP 106  -9.935 -23.965  -7.453
  306    HB2  ASP 106           HB2      ASP 106 -10.716 -25.411  -9.277
  307    HB3  ASP 106           HB3      ASP 106 -10.714 -26.803  -8.194
  308    H    ALA 107           H        ALA 107  -9.199 -27.288  -6.193
  309    HA   ALA 107           HA       ALA 107 -10.504 -27.147  -3.788
  310    HB1  ALA 107           HB1      ALA 107  -9.475 -29.176  -4.741
  311    HB2  ALA 107           HB2      ALA 107  -7.848 -28.518  -4.435
  312    HB3  ALA 107           HB3      ALA 107  -8.941 -28.911  -3.087
  313    H    TYR 108           H        TYR 108  -7.150 -26.058  -4.474
  314    HA   TYR 108           HA       TYR 108  -6.522 -25.127  -1.856
  315    HB2  TYR 108           HB2      TYR 108  -4.875 -25.560  -3.619
  316    HB3  TYR 108           HB3      TYR 108  -5.523 -24.248  -4.593
  317    HD1  TYR 108           HD1      TYR 108  -3.714 -25.078  -1.462
  318    HD2  TYR 108           HD2      TYR 108  -4.903 -21.942  -4.171
  319    HE1  TYR 108           HE1      TYR 108  -2.080 -23.528  -0.381
  320    HE2  TYR 108           HE2      TYR 108  -3.293 -20.391  -3.080
  321    HH   TYR 108           HH       TYR 108  -1.704 -20.114  -1.423
  322    H    HIS 109           H        HIS 109  -7.873 -23.308  -4.698
  323    HA   HIS 109           HA       HIS 109  -8.209 -20.850  -3.262
  324    HB2  HIS 109           HB2      HIS 109  -9.561 -21.975  -5.735
  325    HB3  HIS 109           HB3      HIS 109 -10.016 -20.416  -5.046
  326    HD1  HIS 109           HD1      HIS 109  -7.711 -18.693  -4.652
  327    HD2  HIS 109           HD2      HIS 109  -7.725 -21.734  -7.573
  328    HE1  HIS 109           HE1      HIS 109  -5.883 -18.067  -6.358
  329    HE2  HIS 109           HE2      HIS 109  -5.898 -19.923  -8.139
  330    H    ALA 110           H        ALA 110 -10.494 -23.635  -3.537
  331    HA   ALA 110           HA       ALA 110 -12.589 -22.430  -2.099
  332    HB1  ALA 110           HB1      ALA 110 -11.770 -25.364  -2.222
  333    HB2  ALA 110           HB2      ALA 110 -13.356 -24.741  -1.720
  334    HB3  ALA 110           HB3      ALA 110 -12.805 -24.512  -3.392
  335    H    ALA 111           H        ALA 111  -9.730 -24.266  -0.851
  336    HA   ALA 111           HA       ALA 111 -10.442 -24.120   1.846
  337    HB1  ALA 111           HB1      ALA 111  -8.119 -24.776   2.247
  338    HB2  ALA 111           HB2      ALA 111  -8.813 -25.685   0.892
  339    HB3  ALA 111           HB3      ALA 111  -7.686 -24.345   0.578
  340    H    THR 112           H        THR 112  -8.453 -21.846  -0.135
  341    HA   THR 112           HA       THR 112  -7.811 -20.173   2.156
  342    HB   THR 112           HB       THR 112  -6.848 -18.613   0.536
  343    HG1  THR 112           HG1      THR 112  -6.820 -19.157  -1.629
  344   HG21  THR 112          HG21      THR 112  -5.045 -20.049  -0.260
  345   HG22  THR 112          HG22      THR 112  -5.502 -20.513   1.390
  346   HG23  THR 112          HG23      THR 112  -6.021 -21.501   0.010
  347    H    LEU 113           H        LEU 113 -10.275 -19.855  -0.454
  348    HA   LEU 113           HA       LEU 113 -11.178 -17.276   0.519
  349    HB2  LEU 113           HB2      LEU 113 -11.205 -17.939  -1.855
  350    HB3  LEU 113           HB3      LEU 113 -12.281 -19.291  -1.478
  351    HG   LEU 113           HG       LEU 113 -14.049 -17.764  -0.817
  352   HD11  LEU 113          HD11      LEU 113 -12.157 -15.546  -1.734
  353   HD12  LEU 113          HD12      LEU 113 -13.889 -15.332  -1.385
  354   HD13  LEU 113          HD13      LEU 113 -12.782 -15.776  -0.087
  355   HD21  LEU 113          HD21      LEU 113 -13.914 -18.556  -3.135
  356   HD22  LEU 113          HD22      LEU 113 -14.595 -16.925  -3.065
  357   HD23  LEU 113          HD23      LEU 113 -12.907 -17.156  -3.569
  358    H    GLU 114           H        GLU 114 -12.162 -20.631   0.982
  359    HA   GLU 114           HA       GLU 114 -13.818 -21.663   2.141
  360    HB2  GLU 114           HB2      GLU 114 -12.066 -20.989   3.733
  361    HB3  GLU 114           HB3      GLU 114 -13.034 -19.586   4.210
  362    HG2  GLU 114           HG2      GLU 114 -14.846 -21.090   4.987
  363    HG3  GLU 114           HG3      GLU 114 -13.967 -22.484   4.373
  364    H    HIS 115           H        HIS 115 -15.525 -21.013   0.657
  365    HA   HIS 115           HA       HIS 115 -17.046 -18.714   0.761
  366    HB2  HIS 115           HB2      HIS 115 -17.092 -20.445  -1.011
  367    HB3  HIS 115           HB3      HIS 115 -17.967 -21.541   0.049
  368    HD1  HIS 115           HD1      HIS 115 -18.517 -18.098  -1.683
  369    HD2  HIS 115           HD2      HIS 115 -20.596 -21.391  -0.036
  370    HE1  HIS 115           HE1      HIS 115 -21.012 -17.730  -2.218
  371    HE2  HIS 115           HE2      HIS 115 -22.270 -19.740  -1.208
  372    H    HIS 116           H        HIS 116 -17.395 -21.397   3.003
  373    HA   HIS 116           HA       HIS 116 -19.937 -20.443   4.124
  374    HB2  HIS 116           HB2      HIS 116 -19.832 -22.369   5.551
  375    HB3  HIS 116           HB3      HIS 116 -19.454 -22.835   3.907
  376    HD1  HIS 116           HD1      HIS 116 -17.679 -22.334   7.317
  377    HD2  HIS 116           HD2      HIS 116 -17.181 -24.119   3.517
  378    HE1  HIS 116           HE1      HIS 116 -15.558 -23.794   7.466
  379    HE2  HIS 116           HE2      HIS 116 -15.270 -24.880   5.156
  380    H    HIS 117           H        HIS 117 -16.913 -19.094   4.561
  381    HA   HIS 117           HA       HIS 117 -16.938 -18.818   7.443
  382    HB2  HIS 117           HB2      HIS 117 -15.036 -17.529   7.246
  383    HB3  HIS 117           HB3      HIS 117 -14.922 -18.638   5.892
  384    HD1  HIS 117           HD1      HIS 117 -14.861 -17.506   3.463
  385    HD2  HIS 117           HD2      HIS 117 -15.466 -14.895   6.728
  386    HE1  HIS 117           HE1      HIS 117 -14.583 -15.112   2.541
  387    HE2  HIS 117           HE2      HIS 117 -14.952 -13.526   4.543
  388    H    HIS 118           H        HIS 118 -18.417 -16.892   4.914
  389    HA   HIS 118           HA       HIS 118 -19.259 -14.772   6.828
  390    HB2  HIS 118           HB2      HIS 118 -18.277 -14.096   4.658
  391    HB3  HIS 118           HB3      HIS 118 -19.551 -14.959   3.798
  392    HD1  HIS 118           HD1      HIS 118 -21.713 -13.531   3.305
  393    HD2  HIS 118           HD2      HIS 118 -19.202 -11.985   6.338
  394    HE1  HIS 118           HE1      HIS 118 -22.723 -11.265   4.000
  395    HE2  HIS 118           HE2      HIS 118 -21.173 -10.326   5.841
  396    H    HIS 119           H        HIS 119 -21.406 -14.274   7.259
  397    HA   HIS 119           HA       HIS 119 -23.502 -16.302   6.576
  398    HB2  HIS 119           HB2      HIS 119 -22.971 -15.223   9.375
  399    HB3  HIS 119           HB3      HIS 119 -24.133 -16.470   8.921
  400    HD1  HIS 119           HD1      HIS 119 -20.945 -16.331  10.555
  401    HD2  HIS 119           HD2      HIS 119 -22.567 -18.608   7.387
  402    HE1  HIS 119           HE1      HIS 119 -19.419 -18.388  10.282
  403    HE2  HIS 119           HE2      HIS 119 -20.376 -19.737   8.302
  404    H    HIS 120           H        HIS 120 -25.692 -15.613   7.047
  405    HA   HIS 120           HA       HIS 120 -26.231 -12.868   6.203
  406    HB2  HIS 120           HB2      HIS 120 -27.528 -14.931   5.504
  407    HB3  HIS 120           HB3      HIS 120 -28.207 -14.989   7.132
  408    HD1  HIS 120           HD1      HIS 120 -28.560 -11.633   7.109
  409    HD2  HIS 120           HD2      HIS 120 -29.957 -14.577   4.426
  410    HE1  HIS 120           HE1      HIS 120 -30.627 -10.611   5.904
  411    HE2  HIS 120           HE2      HIS 120 -31.462 -12.423   4.267
  Start of MODEL   15
    1    H1   SER  66           H1       SER  66  13.946  -5.472  21.335
    2    H2   SER  66           H2       SER  66  14.507  -6.713  20.417
    3    H3   SER  66           H3       SER  66  15.527  -5.544  20.929
    4    HA   SER  66           HA       SER  66  14.439  -3.866  19.648
    5    HB2  SER  66           HB2      SER  66  15.325  -6.209  17.932
    6    HB3  SER  66           HB3      SER  66  15.214  -4.505  17.444
    7    HG   SER  66           HG       SER  66  17.340  -5.060  18.091
    8    H    GLY  67           H        GLY  67  13.217  -7.005  18.213
    9    HA2  GLY  67           HA2      GLY  67  10.457  -6.395  18.566
   10    HA3  GLY  67           HA3      GLY  67  10.962  -5.845  16.965
   11    H    SER  68           H        SER  68   9.050  -7.672  17.001
   12    HA   SER  68           HA       SER  68  10.268 -10.061  15.776
   13    HB2  SER  68           HB2      SER  68  10.001 -10.549  18.249
   14    HB3  SER  68           HB3      SER  68   8.250 -10.365  18.034
   15    HG   SER  68           HG       SER  68   9.008 -12.570  17.860
   16    H    GLY  69           H        GLY  69   8.629 -11.436  14.723
   17    HA2  GLY  69           HA2      GLY  69   6.765 -11.836  13.412
   18    HA3  GLY  69           HA3      GLY  69   5.942 -10.498  14.209
   19    H    ARG  70           H        ARG  70   5.073 -10.376  12.003
   20    HA   ARG  70           HA       ARG  70   4.753  -9.427   9.972
   21    HB2  ARG  70           HB2      ARG  70   6.647  -7.287  11.009
   22    HB3  ARG  70           HB3      ARG  70   5.505  -7.112   9.674
   23    HG2  ARG  70           HG2      ARG  70   3.615  -7.575  11.221
   24    HG3  ARG  70           HG3      ARG  70   4.745  -7.655  12.577
   25    HD2  ARG  70           HD2      ARG  70   4.310  -5.238  10.775
   26    HD3  ARG  70           HD3      ARG  70   3.593  -5.441  12.365
   27    HE   ARG  70           HE       ARG  70   6.352  -4.690  11.726
   28   HH11  ARG  70          HH11      ARG  70   4.333  -5.920  14.326
   29   HH12  ARG  70          HH12      ARG  70   5.474  -5.445  15.554
   30   HH21  ARG  70          HH21      ARG  70   7.749  -4.110  13.344
   31   HH22  ARG  70          HH22      ARG  70   7.345  -4.425  15.007
   32    H    GLY  71           H        GLY  71   7.173 -11.259  10.188
   33    HA2  GLY  71           HA2      GLY  71   8.877 -10.564   7.936
   34    HA3  GLY  71           HA3      GLY  71   8.741 -12.146   8.704
   35    H    ARG  72           H        ARG  72   8.764 -11.222   5.833
   36    HA   ARG  72           HA       ARG  72   6.282 -12.569   4.823
   37    HB2  ARG  72           HB2      ARG  72   7.510  -9.992   3.750
   38    HB3  ARG  72           HB3      ARG  72   6.134 -10.851   3.050
   39    HG2  ARG  72           HG2      ARG  72   4.830 -10.477   5.141
   40    HG3  ARG  72           HG3      ARG  72   6.195  -9.604   5.832
   41    HD2  ARG  72           HD2      ARG  72   4.556  -8.785   3.424
   42    HD3  ARG  72           HD3      ARG  72   4.524  -8.038   5.015
   43    HE   ARG  72           HE       ARG  72   6.347  -7.486   2.869
   44   HH11  ARG  72          HH11      ARG  72   6.496  -7.626   6.408
   45   HH12  ARG  72          HH12      ARG  72   7.669  -6.352   6.458
   46   HH21  ARG  72          HH21      ARG  72   7.896  -5.951   3.061
   47   HH22  ARG  72          HH22      ARG  72   8.467  -5.454   4.627
   48    H    GLY  73           H        GLY  73   6.483 -13.830   3.043
   49    HA2  GLY  73           HA2      GLY  73   9.133 -14.780   2.279
   50    HA3  GLY  73           HA3      GLY  73   7.582 -15.341   1.665
   51    H    ALA  74           H        ALA  74   6.813 -12.548   0.814
   52    HA   ALA  74           HA       ALA  74   6.542 -11.677  -1.262
   53    HB1  ALA  74           HB1      ALA  74   8.494 -10.385  -0.456
   54    HB2  ALA  74           HB2      ALA  74   9.585 -11.545  -1.244
   55    HB3  ALA  74           HB3      ALA  74   8.481 -10.553  -2.220
   56    H    ILE  75           H        ILE  75   5.972 -14.165  -1.340
   57    HA   ILE  75           HA       ILE  75   7.603 -15.658  -3.182
   58    HB   ILE  75           HB       ILE  75   4.905 -16.455  -2.022
   59   HG12  ILE  75          HG12      ILE  75   6.404 -15.920  -0.151
   60   HG13  ILE  75          HG13      ILE  75   6.034 -17.621  -0.233
   61   HG21  ILE  75          HG21      ILE  75   7.197 -18.058  -3.215
   62   HG22  ILE  75          HG22      ILE  75   5.861 -18.780  -2.292
   63   HG23  ILE  75          HG23      ILE  75   5.520 -17.950  -3.818
   64   HD11  ILE  75          HD11      ILE  75   8.410 -17.187   0.343
   65   HD12  ILE  75          HD12      ILE  75   8.251 -18.148  -1.128
   66   HD13  ILE  75          HD13      ILE  75   8.655 -16.421  -1.237
   67    H    ASP  76           H        ASP  76   7.156 -16.353  -5.240
   68    HA   ASP  76           HA       ASP  76   4.585 -15.593  -6.543
   69    HB2  ASP  76           HB2      ASP  76   6.106 -13.725  -6.990
   70    HB3  ASP  76           HB3      ASP  76   7.307 -14.832  -7.649
   71    H    ARG  77           H        ARG  77   7.762 -17.118  -7.353
   72    HA   ARG  77           HA       ARG  77   6.609 -18.975  -9.230
   73    HB2  ARG  77           HB2      ARG  77   9.312 -18.892  -7.823
   74    HB3  ARG  77           HB3      ARG  77   8.906 -20.027  -9.115
   75    HG2  ARG  77           HG2      ARG  77   8.450 -18.133 -10.658
   76    HG3  ARG  77           HG3      ARG  77   8.911 -16.985  -9.387
   77    HD2  ARG  77           HD2      ARG  77  11.173 -17.993  -9.301
   78    HD3  ARG  77           HD3      ARG  77  10.711 -19.137 -10.576
   79    HE   ARG  77           HE       ARG  77  10.191 -16.505 -11.518
   80   HH11  ARG  77          HH11      ARG  77  13.017 -18.439 -10.760
   81   HH12  ARG  77          HH12      ARG  77  14.022 -17.582 -11.892
   82   HH21  ARG  77          HH21      ARG  77  11.528 -15.452 -12.944
   83   HH22  ARG  77          HH22      ARG  77  13.192 -15.925 -13.097
   84    H    GLU  78           H        GLU  78   7.352 -19.299  -5.815
   85    HA   GLU  78           HA       GLU  78   6.936 -22.206  -5.828
   86    HB2  GLU  78           HB2      GLU  78   7.625 -20.249  -3.621
   87    HB3  GLU  78           HB3      GLU  78   7.475 -22.001  -3.396
   88    HG2  GLU  78           HG2      GLU  78   9.248 -22.358  -5.113
   89    HG3  GLU  78           HG3      GLU  78   9.447 -20.610  -5.260
   90    H    GLN  79           H        GLN  79   4.639 -19.872  -5.978
   91    HA   GLN  79           HA       GLN  79   2.745 -20.609  -3.955
   92    HB2  GLN  79           HB2      GLN  79   2.358 -19.600  -6.805
   93    HB3  GLN  79           HB3      GLN  79   1.053 -19.765  -5.622
   94    HG2  GLN  79           HG2      GLN  79   2.146 -18.161  -4.115
   95    HG3  GLN  79           HG3      GLN  79   3.494 -17.976  -5.238
   96   HE21  GLN  79          HE22      GLN  79   2.946 -17.146  -7.482
   97   HE22  GLN  79          HE21      GLN  79   1.597 -16.012  -7.608
   98    H    SER  80           H        SER  80   3.413 -22.074  -7.170
   99    HA   SER  80           HA       SER  80   1.371 -24.071  -7.084
  100    HB2  SER  80           HB2      SER  80   4.116 -24.159  -8.406
  101    HB3  SER  80           HB3      SER  80   2.756 -25.242  -8.759
  102    HG   SER  80           HG       SER  80   2.880 -23.454 -10.235
  103    H    ALA  81           H        ALA  81   4.807 -24.229  -5.946
  104    HA   ALA  81           HA       ALA  81   4.684 -26.851  -4.957
  105    HB1  ALA  81           HB1      ALA  81   6.704 -26.226  -3.692
  106    HB2  ALA  81           HB2      ALA  81   6.773 -25.613  -5.357
  107    HB3  ALA  81           HB3      ALA  81   6.394 -24.509  -4.014
  108    H    ALA  82           H        ALA  82   3.834 -23.751  -3.336
  109    HA   ALA  82           HA       ALA  82   3.175 -24.881  -0.800
  110    HB1  ALA  82           HB1      ALA  82   1.975 -22.788  -0.423
  111    HB2  ALA  82           HB2      ALA  82   3.528 -22.470  -1.221
  112    HB3  ALA  82           HB3      ALA  82   2.015 -22.411  -2.154
  113    H    ILE  83           H        ILE  83   1.126 -24.489  -3.744
  114    HA   ILE  83           HA       ILE  83  -1.266 -25.569  -2.534
  115    HB   ILE  83           HB       ILE  83  -0.393 -25.296  -5.434
  116   HG12  ILE  83          HG12      ILE  83  -2.449 -23.815  -3.735
  117   HG13  ILE  83          HG13      ILE  83  -0.844 -23.210  -4.070
  118   HG21  ILE  83          HG21      ILE  83  -3.106 -26.197  -4.350
  119   HG22  ILE  83          HG22      ILE  83  -2.761 -25.793  -6.041
  120   HG23  ILE  83          HG23      ILE  83  -1.987 -27.185  -5.317
  121   HD11  ILE  83          HD11      ILE  83  -1.402 -23.224  -6.539
  122   HD12  ILE  83          HD12      ILE  83  -3.089 -23.577  -6.079
  123   HD13  ILE  83          HD13      ILE  83  -2.326 -22.078  -5.547
  124    H    ARG  84           H        ARG  84   1.391 -27.137  -4.371
  125    HA   ARG  84           HA       ARG  84   0.288 -29.803  -4.185
  126    HB2  ARG  84           HB2      ARG  84   1.961 -29.190  -5.815
  127    HB3  ARG  84           HB3      ARG  84   3.156 -28.838  -4.572
  128    HG2  ARG  84           HG2      ARG  84   3.694 -31.047  -4.274
  129    HG3  ARG  84           HG3      ARG  84   2.023 -31.598  -4.449
  130    HD2  ARG  84           HD2      ARG  84   3.443 -32.462  -6.256
  131    HD3  ARG  84           HD3      ARG  84   2.106 -31.455  -6.837
  132    HE   ARG  84           HE       ARG  84   4.633 -30.000  -6.517
  133   HH11  ARG  84          HH11      ARG  84   2.933 -32.101  -8.784
  134   HH12  ARG  84          HH12      ARG  84   3.626 -31.258 -10.168
  135   HH21  ARG  84          HH21      ARG  84   5.523 -29.081  -8.400
  136   HH22  ARG  84          HH22      ARG  84   5.031 -29.716  -9.955
  137    H    GLU  85           H        GLU  85   2.618 -28.129  -2.002
  138    HA   GLU  85           HA       GLU  85   2.807 -30.176  -0.127
  139    HB2  GLU  85           HB2      GLU  85   4.166 -28.028  -0.248
  140    HB3  GLU  85           HB3      GLU  85   2.800 -27.211   0.525
  141    HG2  GLU  85           HG2      GLU  85   3.049 -29.114   2.342
  142    HG3  GLU  85           HG3      GLU  85   4.629 -29.375   1.621
  143    H    TRP  86           H        TRP  86   0.429 -27.421  -0.133
  144    HA   TRP  86           HA       TRP  86  -1.072 -28.148   2.071
  145    HB2  TRP  86           HB2      TRP  86  -1.386 -26.036   0.970
  146    HB3  TRP  86           HB3      TRP  86  -1.854 -26.815  -0.534
  147    HD1  TRP  86           HD1      TRP  86  -3.222 -25.967   2.924
  148    HE1  TRP  86           HE1      TRP  86  -5.778 -26.191   2.928
  149    HE3  TRP  86           HE3      TRP  86  -3.884 -27.912  -1.780
  150    HZ2  TRP  86           HZ2      TRP  86  -7.828 -27.199   1.176
  151    HZ3  TRP  86           HZ3      TRP  86  -6.168 -28.441  -2.600
  152    HH2  TRP  86           HH2      TRP  86  -8.140 -28.113  -1.126
  153    H    ALA  87           H        ALA  87  -1.528 -29.261  -1.320
  154    HA   ALA  87           HA       ALA  87  -3.770 -30.933  -0.810
  155    HB1  ALA  87           HB1      ALA  87  -3.105 -30.175  -3.045
  156    HB2  ALA  87           HB2      ALA  87  -1.585 -31.085  -2.940
  157    HB3  ALA  87           HB3      ALA  87  -3.133 -31.953  -3.000
  158    H    ARG  88           H        ARG  88  -0.254 -31.743  -0.776
  159    HA   ARG  88           HA       ARG  88  -0.588 -34.521  -0.042
  160    HB2  ARG  88           HB2      ARG  88   1.718 -32.545   0.288
  161    HB3  ARG  88           HB3      ARG  88   1.824 -34.243   0.769
  162    HG2  ARG  88           HG2      ARG  88   1.343 -34.978  -1.536
  163    HG3  ARG  88           HG3      ARG  88   1.144 -33.306  -2.055
  164    HD2  ARG  88           HD2      ARG  88   3.334 -34.021  -2.718
  165    HD3  ARG  88           HD3      ARG  88   3.507 -32.843  -1.402
  166    HE   ARG  88           HE       ARG  88   3.438 -35.606  -0.458
  167   HH11  ARG  88          HH11      ARG  88   5.678 -33.278  -1.836
  168   HH12  ARG  88          HH12      ARG  88   7.060 -34.064  -1.124
  169   HH21  ARG  88          HH21      ARG  88   5.242 -36.525   0.445
  170   HH22  ARG  88          HH22      ARG  88   6.816 -35.864   0.121
  171    H    ARG  89           H        ARG  89  -0.151 -31.625   1.996
  172    HA   ARG  89           HA       ARG  89  -0.182 -32.992   4.535
  173    HB2  ARG  89           HB2      ARG  89  -0.736 -30.119   3.689
  174    HB3  ARG  89           HB3      ARG  89  -0.805 -30.637   5.377
  175    HG2  ARG  89           HG2      ARG  89   1.523 -31.337   5.358
  176    HG3  ARG  89           HG3      ARG  89   1.646 -31.083   3.619
  177    HD2  ARG  89           HD2      ARG  89   2.725 -29.258   4.730
  178    HD3  ARG  89           HD3      ARG  89   1.263 -28.656   3.928
  179    HE   ARG  89           HE       ARG  89   0.619 -29.305   6.630
  180   HH11  ARG  89          HH11      ARG  89   2.634 -26.927   4.971
  181   HH12  ARG  89          HH12      ARG  89   2.374 -25.739   6.224
  182   HH21  ARG  89          HH21      ARG  89   0.365 -27.728   8.182
  183   HH22  ARG  89          HH22      ARG  89   1.141 -26.185   7.989
  184    H    ASN  90           H        ASN  90  -2.841 -31.911   2.503
  185    HA   ASN  90           HA       ASN  90  -4.817 -32.743   4.573
  186    HB2  ASN  90           HB2      ASN  90  -5.090 -31.197   1.971
  187    HB3  ASN  90           HB3      ASN  90  -6.460 -31.736   2.940
  188   HD21  ASN  90          HD22      ASN  90  -3.717 -29.515   2.890
  189   HD22  ASN  90          HD21      ASN  90  -4.288 -28.561   4.259
  190    H    GLY  91           H        GLY  91  -3.099 -34.478   2.401
  191    HA2  GLY  91           HA2      GLY  91  -3.345 -36.603   1.599
  192    HA3  GLY  91           HA3      GLY  91  -4.848 -36.736   2.517
  193    H    HIS  92           H        HIS  92  -4.519 -34.236   0.057
  194    HA   HIS  92           HA       HIS  92  -6.763 -35.408  -1.490
  195    HB2  HIS  92           HB2      HIS  92  -5.268 -32.772  -1.840
  196    HB3  HIS  92           HB3      HIS  92  -6.741 -33.240  -2.681
  197    HD1  HIS  92           HD1      HIS  92  -8.135 -34.349   0.207
  198    HD2  HIS  92           HD2      HIS  92  -6.511 -30.598  -0.856
  199    HE1  HIS  92           HE1      HIS  92  -9.299 -32.606   1.696
  200    HE2  HIS  92           HE2      HIS  92  -8.308 -30.318   1.040
  201    H    ASN  93           H        ASN  93  -6.716 -35.690  -3.782
  202    HA   ASN  93           HA       ASN  93  -4.376 -37.056  -4.766
  203    HB2  ASN  93           HB2      ASN  93  -6.718 -37.629  -5.363
  204    HB3  ASN  93           HB3      ASN  93  -6.876 -36.092  -6.227
  205   HD21  ASN  93          HD22      ASN  93  -7.494 -37.826  -7.929
  206   HD22  ASN  93          HD21      ASN  93  -6.161 -38.408  -8.916
  207    H    VAL  94           H        VAL  94  -2.591 -36.212  -5.642
  208    HA   VAL  94           HA       VAL  94  -2.649 -33.915  -7.449
  209    HB   VAL  94           HB       VAL  94  -2.467 -32.795  -5.275
  210   HG11  VAL  94          HG11      VAL  94  -1.317 -34.520  -3.931
  211   HG12  VAL  94          HG12      VAL  94   0.171 -34.266  -4.871
  212   HG13  VAL  94          HG13      VAL  94  -0.485 -32.963  -3.863
  213   HG21  VAL  94          HG21      VAL  94  -1.364 -31.849  -7.287
  214   HG22  VAL  94          HG22      VAL  94  -0.600 -31.374  -5.768
  215   HG23  VAL  94          HG23      VAL  94   0.158 -32.618  -6.784
  216    H    SER  95           H        SER  95  -1.098 -33.983  -8.969
  217    HA   SER  95           HA       SER  95   0.533 -36.303  -9.346
  218    HB2  SER  95           HB2      SER  95   0.663 -33.546 -10.628
  219    HB3  SER  95           HB3      SER  95   1.453 -35.018 -11.248
  220    HG   SER  95           HG       SER  95  -0.561 -34.688 -12.284
  221    H    THR  96           H        THR  96   2.515 -36.789  -8.495
  222    HA   THR  96           HA       THR  96   3.809 -34.963  -6.652
  223    HB   THR  96           HB       THR  96   5.473 -36.828  -6.421
  224    HG1  THR  96           HG1      THR  96   4.972 -38.759  -7.523
  225   HG21  THR  96          HG21      THR  96   2.553 -37.713  -6.265
  226   HG22  THR  96          HG22      THR  96   3.928 -38.416  -5.385
  227   HG23  THR  96          HG23      THR  96   3.409 -36.758  -5.034
  228    H    ARG  97           H        ARG  97   4.319 -35.671 -10.006
  229    HA   ARG  97           HA       ARG  97   6.696 -33.838 -10.104
  230    HB2  ARG  97           HB2      ARG  97   6.188 -36.341 -11.778
  231    HB3  ARG  97           HB3      ARG  97   7.486 -35.171 -12.057
  232    HG2  ARG  97           HG2      ARG  97   8.417 -35.658  -9.805
  233    HG3  ARG  97           HG3      ARG  97   7.155 -36.884  -9.558
  234    HD2  ARG  97           HD2      ARG  97   7.959 -38.123 -11.537
  235    HD3  ARG  97           HD3      ARG  97   9.231 -36.904 -11.786
  236    HE   ARG  97           HE       ARG  97   9.459 -37.876  -9.124
  237   HH11  ARG  97          HH11      ARG  97   9.954 -39.133 -12.360
  238   HH12  ARG  97          HH12      ARG  97  11.163 -40.271 -11.834
  239   HH21  ARG  97          HH21      ARG  97  11.010 -39.352  -8.516
  240   HH22  ARG  97          HH22      ARG  97  11.739 -40.391  -9.706
  241    H    GLY  98           H        GLY  98   6.924 -32.678 -12.134
  242    HA2  GLY  98           HA2      GLY  98   6.168 -31.376 -13.891
  243    HA3  GLY  98           HA3      GLY  98   4.898 -32.569 -14.142
  244    H    ARG  99           H        ARG  99   3.453 -30.921 -14.716
  245    HA   ARG  99           HA       ARG  99   2.767 -28.658 -13.021
  246    HB2  ARG  99           HB2      ARG  99   1.525 -29.936 -15.496
  247    HB3  ARG  99           HB3      ARG  99   0.718 -28.643 -14.635
  248    HG2  ARG  99           HG2      ARG  99   1.821 -27.687 -16.470
  249    HG3  ARG  99           HG3      ARG  99   2.623 -27.114 -15.020
  250    HD2  ARG  99           HD2      ARG  99   3.710 -29.452 -16.636
  251    HD3  ARG  99           HD3      ARG  99   4.002 -27.779 -17.120
  252    HE   ARG  99           HE       ARG  99   4.757 -27.847 -14.443
  253   HH11  ARG  99          HH21      ARG  99   5.880 -29.396 -17.379
  254   HH12  ARG  99          HH22      ARG  99   7.520 -29.514 -16.808
  255   HH21  ARG  99          HH11      ARG  99   6.880 -28.014 -13.775
  256   HH22  ARG  99          HH12      ARG  99   8.063 -28.740 -14.816
  257    H    ILE 100           H        ILE 100   0.641 -28.228 -12.183
  258    HA   ILE 100           HA       ILE 100  -0.342 -30.508 -10.548
  259    HB   ILE 100           HB       ILE 100  -0.605 -27.513 -10.204
  260   HG12  ILE 100          HG12      ILE 100   1.001 -29.633  -8.694
  261   HG13  ILE 100          HG13      ILE 100   1.665 -28.431  -9.804
  262   HG21  ILE 100          HG21      ILE 100  -1.475 -29.639  -8.185
  263   HG22  ILE 100          HG22      ILE 100  -1.681 -27.885  -8.073
  264   HG23  ILE 100          HG23      ILE 100  -2.610 -28.794  -9.250
  265   HD11  ILE 100          HD11      ILE 100   0.788 -26.615  -8.285
  266   HD12  ILE 100          HD12      ILE 100   0.405 -27.892  -7.102
  267   HD13  ILE 100          HD13      ILE 100   2.082 -27.636  -7.628
  268    HA   PRO 101           HA       PRO 101  -4.253 -30.550 -12.850
  269    HB2  PRO 101           HB2      PRO 101  -5.903 -31.665 -10.927
  270    HB3  PRO 101           HB3      PRO 101  -4.706 -32.611 -11.874
  271    HG2  PRO 101           HG2      PRO 101  -4.354 -31.359  -9.127
  272    HG3  PRO 101           HG3      PRO 101  -4.034 -33.065  -9.602
  273    HD2  PRO 101           HD2      PRO 101  -2.094 -31.258  -9.448
  274    HD3  PRO 101           HD3      PRO 101  -2.112 -32.389 -10.841
  275    H    ALA 102           H        ALA 102  -5.704 -28.903 -13.192
  276    HA   ALA 102           HA       ALA 102  -5.924 -26.706 -11.483
  277    HB1  ALA 102           HB1      ALA 102  -7.871 -27.596 -13.624
  278    HB2  ALA 102           HB2      ALA 102  -7.687 -25.960 -12.945
  279    HB3  ALA 102           HB3      ALA 102  -6.364 -26.675 -13.894
  280    H    ASP 103           H        ASP 103  -7.846 -29.672 -11.428
  281    HA   ASP 103           HA       ASP 103  -9.995 -28.823  -9.901
  282    HB2  ASP 103           HB2      ASP 103  -9.833 -30.997 -11.024
  283    HB3  ASP 103           HB3      ASP 103  -8.567 -31.502  -9.904
  284    H    VAL 104           H        VAL 104  -6.728 -29.825  -8.791
  285    HA   VAL 104           HA       VAL 104  -7.508 -29.553  -6.016
  286    HB   VAL 104           HB       VAL 104  -5.814 -31.243  -6.941
  287   HG11  VAL 104          HG11      VAL 104  -3.499 -30.682  -6.865
  288   HG12  VAL 104          HG12      VAL 104  -4.274 -29.514  -7.929
  289   HG13  VAL 104          HG13      VAL 104  -3.827 -29.031  -6.280
  290   HG21  VAL 104          HG21      VAL 104  -5.212 -29.738  -4.373
  291   HG22  VAL 104          HG22      VAL 104  -6.453 -30.998  -4.574
  292   HG23  VAL 104          HG23      VAL 104  -4.746 -31.411  -4.775
  293    H    ILE 105           H        ILE 105  -5.922 -27.502  -8.394
  294    HA   ILE 105           HA       ILE 105  -5.196 -25.361  -6.586
  295    HB   ILE 105           HB       ILE 105  -5.860 -25.502  -9.551
  296   HG12  ILE 105          HG12      ILE 105  -3.153 -24.787  -8.376
  297   HG13  ILE 105          HG13      ILE 105  -3.651 -26.472  -8.298
  298   HG21  ILE 105          HG21      ILE 105  -6.388 -23.233  -8.938
  299   HG22  ILE 105          HG22      ILE 105  -4.915 -23.091  -7.941
  300   HG23  ILE 105          HG23      ILE 105  -4.801 -23.214  -9.708
  301   HD11  ILE 105          HD11      ILE 105  -3.626 -24.907 -10.899
  302   HD12  ILE 105          HD12      ILE 105  -2.307 -25.939 -10.316
  303   HD13  ILE 105          HD13      ILE 105  -3.894 -26.653 -10.647
  304    H    ASP 106           H        ASP 106  -8.221 -25.988  -8.488
  305    HA   ASP 106           HA       ASP 106  -9.681 -23.857  -7.450
  306    HB2  ASP 106           HB2      ASP 106 -10.347 -25.180  -9.401
  307    HB3  ASP 106           HB3      ASP 106 -10.647 -26.582  -8.370
  308    H    ALA 107           H        ALA 107  -9.452 -27.246  -6.154
  309    HA   ALA 107           HA       ALA 107 -11.021 -26.883  -3.914
  310    HB1  ALA 107           HB1      ALA 107  -8.519 -28.602  -4.155
  311    HB2  ALA 107           HB2      ALA 107  -9.840 -28.823  -2.991
  312    HB3  ALA 107           HB3      ALA 107 -10.142 -29.058  -4.722
  313    H    TYR 108           H        TYR 108  -7.511 -26.125  -4.256
  314    HA   TYR 108           HA       TYR 108  -7.071 -25.199  -1.599
  315    HB2  TYR 108           HB2      TYR 108  -5.216 -25.644  -3.037
  316    HB3  TYR 108           HB3      TYR 108  -5.780 -24.529  -4.260
  317    HD1  TYR 108           HD2      TYR 108  -4.311 -24.744  -0.851
  318    HD2  TYR 108           HD1      TYR 108  -5.303 -22.174  -4.174
  319    HE1  TYR 108           HE2      TYR 108  -2.911 -22.934   0.133
  320    HE2  TYR 108           HE1      TYR 108  -3.897 -20.367  -3.189
  321    HH   TYR 108           HH       TYR 108  -2.127 -20.780  -0.097
  322    H    HIS 109           H        HIS 109  -8.080 -23.321  -4.534
  323    HA   HIS 109           HA       HIS 109  -8.419 -20.863  -3.090
  324    HB2  HIS 109           HB2      HIS 109  -9.564 -21.848  -5.721
  325    HB3  HIS 109           HB3      HIS 109  -9.905 -20.242  -5.075
  326    HD1  HIS 109           HD1      HIS 109  -7.408 -18.851  -4.371
  327    HD2  HIS 109           HD2      HIS 109  -7.546 -21.837  -7.347
  328    HE1  HIS 109           HE1      HIS 109  -5.331 -18.486  -5.853
  329    HE2  HIS 109           HE2      HIS 109  -5.430 -20.294  -7.685
  330    H    ALA 110           H        ALA 110 -10.805 -23.502  -3.667
  331    HA   ALA 110           HA       ALA 110 -12.968 -22.230  -2.421
  332    HB1  ALA 110           HB1      ALA 110 -13.878 -24.503  -2.169
  333    HB2  ALA 110           HB2      ALA 110 -13.114 -24.315  -3.762
  334    HB3  ALA 110           HB3      ALA 110 -12.273 -25.197  -2.464
  335    H    ALA 111           H        ALA 111 -10.312 -24.154  -0.914
  336    HA   ALA 111           HA       ALA 111 -11.286 -23.992   1.702
  337    HB1  ALA 111           HB1      ALA 111  -9.054 -24.773   2.327
  338    HB2  ALA 111           HB2      ALA 111  -9.657 -25.641   0.903
  339    HB3  ALA 111           HB3      ALA 111  -8.435 -24.361   0.718
  340    H    THR 112           H        THR 112  -8.977 -21.824  -0.038
  341    HA   THR 112           HA       THR 112  -8.486 -20.214   2.333
  342    HB   THR 112           HB       THR 112  -7.224 -18.726   0.831
  343    HG1  THR 112           HG1      THR 112  -6.982 -19.350  -1.327
  344   HG21  THR 112          HG21      THR 112  -6.131 -20.722   1.822
  345   HG22  THR 112          HG22      THR 112  -6.566 -21.667   0.382
  346   HG23  THR 112          HG23      THR 112  -5.455 -20.292   0.240
  347    H    LEU 113           H        LEU 113 -10.546 -19.707  -0.548
  348    HA   LEU 113           HA       LEU 113 -11.396 -17.044   0.385
  349    HB2  LEU 113           HB2      LEU 113 -12.433 -18.739  -1.919
  350    HB3  LEU 113           HB3      LEU 113 -12.720 -17.017  -1.674
  351    HG   LEU 113           HG       LEU 113 -10.008 -18.292  -2.207
  352   HD11  LEU 113          HD11      LEU 113 -10.188 -17.249  -4.433
  353   HD12  LEU 113          HD12      LEU 113 -11.511 -18.393  -4.154
  354   HD13  LEU 113          HD13      LEU 113 -11.811 -16.641  -4.032
  355   HD21  LEU 113          HD21      LEU 113 -10.818 -15.358  -2.059
  356   HD22  LEU 113          HD22      LEU 113  -9.732 -16.213  -0.936
  357   HD23  LEU 113          HD23      LEU 113  -9.237 -15.954  -2.610
  358    H    GLU 114           H        GLU 114 -12.487 -20.260   0.749
  359    HA   GLU 114           HA       GLU 114 -14.374 -21.264   1.527
  360    HB2  GLU 114           HB2      GLU 114 -14.739 -20.826   3.825
  361    HB3  GLU 114           HB3      GLU 114 -13.028 -20.683   3.400
  362    HG2  GLU 114           HG2      GLU 114 -13.202 -18.213   3.493
  363    HG3  GLU 114           HG3      GLU 114 -14.918 -18.352   3.895
  364    H    HIS 115           H        HIS 115 -15.261 -19.875  -0.546
  365    HA   HIS 115           HA       HIS 115 -17.303 -18.009  -0.206
  366    HB2  HIS 115           HB2      HIS 115 -16.250 -18.681  -2.354
  367    HB3  HIS 115           HB3      HIS 115 -17.139 -20.199  -2.337
  368    HD1  HIS 115           HD1      HIS 115 -19.555 -20.068  -3.436
  369    HD2  HIS 115           HD2      HIS 115 -17.769 -16.344  -2.536
  370    HE1  HIS 115           HE1      HIS 115 -21.072 -18.264  -4.465
  371    HE2  HIS 115           HE2      HIS 115 -19.967 -15.995  -3.929
  372    H    HIS 116           H        HIS 116 -17.671 -21.531   0.081
  373    HA   HIS 116           HA       HIS 116 -20.499 -21.652   0.416
  374    HB2  HIS 116           HB2      HIS 116 -20.111 -23.833   1.419
  375    HB3  HIS 116           HB3      HIS 116 -19.099 -23.614   0.007
  376    HD1  HIS 116           HD1      HIS 116 -18.839 -23.986   3.823
  377    HD2  HIS 116           HD2      HIS 116 -16.438 -23.739   0.349
  378    HE1  HIS 116           HE1      HIS 116 -16.450 -24.603   4.544
  379    HE2  HIS 116           HE2      HIS 116 -14.993 -24.463   2.425
  380    H    HIS 117           H        HIS 117 -18.068 -20.617   2.744
  381    HA   HIS 117           HA       HIS 117 -20.077 -20.422   4.940
  382    HB2  HIS 117           HB2      HIS 117 -17.860 -21.368   5.427
  383    HB3  HIS 117           HB3      HIS 117 -17.075 -19.894   4.861
  384    HD1  HIS 117           HD1      HIS 117 -16.069 -18.966   7.058
  385    HD2  HIS 117           HD2      HIS 117 -20.107 -20.194   7.367
  386    HE1  HIS 117           HE1      HIS 117 -16.880 -18.259   9.411
  387    HE2  HIS 117           HE2      HIS 117 -19.336 -19.014   9.585
  388    H    HIS 118           H        HIS 118 -18.039 -18.223   2.929
  389    HA   HIS 118           HA       HIS 118 -19.057 -15.819   4.165
  390    HB2  HIS 118           HB2      HIS 118 -17.620 -16.326   1.529
  391    HB3  HIS 118           HB3      HIS 118 -18.107 -14.720   2.054
  392    HD1  HIS 118           HD1      HIS 118 -15.000 -16.331   1.945
  393    HD2  HIS 118           HD2      HIS 118 -17.283 -14.514   5.019
  394    HE1  HIS 118           HE1      HIS 118 -13.338 -15.545   3.740
  395    HE2  HIS 118           HE2      HIS 118 -14.732 -14.476   5.621
  396    H    HIS 119           H        HIS 119 -20.312 -17.635   1.372
  397    HA   HIS 119           HA       HIS 119 -22.279 -15.541   0.718
  398    HB2  HIS 119           HB2      HIS 119 -21.159 -16.927  -1.020
  399    HB3  HIS 119           HB3      HIS 119 -21.929 -18.370  -0.363
  400    HD1  HIS 119           HD1      HIS 119 -22.963 -15.035  -2.085
  401    HD2  HIS 119           HD2      HIS 119 -24.347 -18.941  -1.231
  402    HE1  HIS 119           HE1      HIS 119 -25.207 -15.308  -3.324
  403    HE2  HIS 119           HE2      HIS 119 -26.044 -17.685  -2.798
  404    H    HIS 120           H        HIS 120 -24.557 -15.818   0.773
  405    HA   HIS 120           HA       HIS 120 -25.762 -17.972   2.394
  406    HB2  HIS 120           HB2      HIS 120 -25.231 -16.166   4.015
  407    HB3  HIS 120           HB3      HIS 120 -26.125 -15.011   3.034
  408    HD1  HIS 120           HD1      HIS 120 -26.755 -18.075   5.299
  409    HD2  HIS 120           HD2      HIS 120 -28.779 -14.985   3.254
  410    HE1  HIS 120           HE1      HIS 120 -29.193 -18.133   6.132
  411    HE2  HIS 120           HE2      HIS 120 -30.423 -16.238   4.884
  Start of MODEL   16
    1    H1   SER  66           H1       SER  66  17.962 -19.512 -27.777
    2    H2   SER  66           H2       SER  66  17.970 -20.497 -29.078
    3    H3   SER  66           H3       SER  66  18.421 -18.931 -29.237
    4    HA   SER  66           HA       SER  66  16.236 -19.219 -30.157
    5    HB2  SER  66           HB2      SER  66  15.446 -20.205 -27.384
    6    HB3  SER  66           HB3      SER  66  14.370 -19.984 -28.776
    7    HG   SER  66           HG       SER  66  15.087 -22.166 -28.576
    8    H    GLY  67           H        GLY  67  14.491 -17.634 -29.927
    9    HA2  GLY  67           HA2      GLY  67  13.520 -15.662 -29.324
   10    HA3  GLY  67           HA3      GLY  67  14.060 -16.002 -27.679
   11    H    SER  68           H        SER  68  16.434 -15.486 -30.232
   12    HA   SER  68           HA       SER  68  18.247 -14.144 -30.285
   13    HB2  SER  68           HB2      SER  68  16.298 -11.910 -29.656
   14    HB3  SER  68           HB3      SER  68  17.902 -11.743 -30.390
   15    HG   SER  68           HG       SER  68  16.256 -11.783 -31.986
   16    H    GLY  69           H        GLY  69  17.649 -15.357 -27.627
   17    HA2  GLY  69           HA2      GLY  69  18.706 -15.450 -25.597
   18    HA3  GLY  69           HA3      GLY  69  19.782 -14.160 -26.124
   19    H    ARG  70           H        ARG  70  16.392 -13.368 -26.183
   20    HA   ARG  70           HA       ARG  70  16.815 -11.225 -24.259
   21    HB2  ARG  70           HB2      ARG  70  14.341 -12.143 -25.775
   22    HB3  ARG  70           HB3      ARG  70  14.420 -10.680 -24.785
   23    HG2  ARG  70           HG2      ARG  70  16.163  -9.716 -26.187
   24    HG3  ARG  70           HG3      ARG  70  16.258 -11.172 -27.182
   25    HD2  ARG  70           HD2      ARG  70  13.779  -9.438 -26.902
   26    HD3  ARG  70           HD3      ARG  70  14.961  -9.318 -28.222
   27    HE   ARG  70           HE       ARG  70  14.169 -12.019 -28.123
   28   HH11  ARG  70          HH11      ARG  70  12.610  -8.955 -28.858
   29   HH12  ARG  70          HH12      ARG  70  11.415  -9.698 -29.883
   30   HH21  ARG  70          HH21      ARG  70  12.580 -12.905 -29.415
   31   HH22  ARG  70          HH22      ARG  70  11.414 -11.885 -30.206
   32    H    GLY  71           H        GLY  71  15.937 -10.804 -22.335
   33    HA2  GLY  71           HA2      GLY  71  15.414 -13.016 -20.554
   34    HA3  GLY  71           HA3      GLY  71  15.334 -11.305 -20.152
   35    H    ARG  72           H        ARG  72  13.596 -13.779 -19.749
   36    HA   ARG  72           HA       ARG  72  10.943 -12.459 -20.211
   37    HB2  ARG  72           HB2      ARG  72  11.571 -15.418 -20.587
   38    HB3  ARG  72           HB3      ARG  72   9.951 -14.716 -20.577
   39    HG2  ARG  72           HG2      ARG  72  10.556 -13.298 -22.544
   40    HG3  ARG  72           HG3      ARG  72  12.137 -14.092 -22.617
   41    HD2  ARG  72           HD2      ARG  72   9.451 -15.497 -22.857
   42    HD3  ARG  72           HD3      ARG  72  10.477 -15.026 -24.223
   43    HE   ARG  72           HE       ARG  72  12.148 -16.559 -22.624
   44   HH11  ARG  72          HH11      ARG  72   9.124 -17.215 -24.277
   45   HH12  ARG  72          HH12      ARG  72   9.468 -18.913 -24.429
   46   HH21  ARG  72          HH21      ARG  72  12.509 -18.747 -22.820
   47   HH22  ARG  72          HH22      ARG  72  11.348 -19.753 -23.630
   48    H    GLY  73           H        GLY  73   9.369 -12.825 -18.659
   49    HA2  GLY  73           HA2      GLY  73  10.317 -13.158 -15.933
   50    HA3  GLY  73           HA3      GLY  73   8.657 -12.855 -16.441
   51    H    ALA  74           H        ALA  74   9.675 -14.683 -14.394
   52    HA   ALA  74           HA       ALA  74   8.144 -17.087 -15.133
   53    HB1  ALA  74           HB1      ALA  74  10.457 -17.655 -15.829
   54    HB2  ALA  74           HB2      ALA  74  11.050 -17.241 -14.204
   55    HB3  ALA  74           HB3      ALA  74   9.960 -18.620 -14.426
   56    H    ILE  75           H        ILE  75   7.533 -18.380 -13.344
   57    HA   ILE  75           HA       ILE  75   7.311 -16.889 -10.783
   58    HB   ILE  75           HB       ILE  75   5.839 -19.283 -11.912
   59   HG12  ILE  75          HG12      ILE  75   3.817 -17.884 -11.484
   60   HG13  ILE  75          HG13      ILE  75   4.840 -16.548 -10.970
   61   HG21  ILE  75          HG21      ILE  75   4.483 -19.318  -9.838
   62   HG22  ILE  75          HG22      ILE  75   6.144 -19.783  -9.540
   63   HG23  ILE  75          HG23      ILE  75   5.596 -18.148  -9.093
   64   HD11  ILE  75          HD11      ILE  75   3.881 -16.380 -13.288
   65   HD12  ILE  75          HD12      ILE  75   5.638 -16.229 -13.241
   66   HD13  ILE  75          HD13      ILE  75   4.889 -17.756 -13.769
   67    H    ASP  76           H        ASP  76   8.284 -17.553  -8.923
   68    HA   ASP  76           HA       ASP  76  10.540 -19.391  -9.239
   69    HB2  ASP  76           HB2      ASP  76  10.720 -17.089  -8.310
   70    HB3  ASP  76           HB3      ASP  76   9.798 -17.610  -6.898
   71    H    ARG  77           H        ARG  77   8.246 -20.806  -9.326
   72    HA   ARG  77           HA       ARG  77   6.784 -22.306  -8.493
   73    HB2  ARG  77           HB2      ARG  77   7.746 -24.327  -7.703
   74    HB3  ARG  77           HB3      ARG  77   8.770 -23.614  -8.938
   75    HG2  ARG  77           HG2      ARG  77  10.397 -22.897  -7.247
   76    HG3  ARG  77           HG3      ARG  77   9.307 -23.382  -5.942
   77    HD2  ARG  77           HD2      ARG  77  10.991 -25.064  -6.168
   78    HD3  ARG  77           HD3      ARG  77   9.452 -25.738  -6.728
   79    HE   ARG  77           HE       ARG  77  10.901 -24.634  -8.955
   80   HH11  ARG  77          HH21      ARG  77  11.108 -27.405  -6.824
   81   HH12  ARG  77          HH22      ARG  77  11.942 -28.375  -8.011
   82   HH21  ARG  77          HH11      ARG  77  11.961 -25.922 -10.423
   83   HH22  ARG  77          HH12      ARG  77  12.422 -27.541  -9.992
   84    H    GLU  78           H        GLU  78   7.092 -19.970  -6.588
   85    HA   GLU  78           HA       GLU  78   6.738 -20.931  -3.942
   86    HB2  GLU  78           HB2      GLU  78   6.038 -18.336  -5.331
   87    HB3  GLU  78           HB3      GLU  78   5.600 -18.597  -3.641
   88    HG2  GLU  78           HG2      GLU  78   8.445 -18.958  -4.637
   89    HG3  GLU  78           HG3      GLU  78   7.816 -17.402  -4.107
   90    H    GLN  79           H        GLN  79   4.160 -19.828  -6.215
   91    HA   GLN  79           HA       GLN  79   2.055 -20.595  -4.414
   92    HB2  GLN  79           HB2      GLN  79   0.528 -20.132  -6.221
   93    HB3  GLN  79           HB3      GLN  79   1.733 -18.857  -6.056
   94    HG2  GLN  79           HG2      GLN  79   2.947 -19.786  -8.046
   95    HG3  GLN  79           HG3      GLN  79   1.697 -21.026  -8.205
   96   HE21  GLN  79          HE22      GLN  79   2.190 -17.435  -8.273
   97   HE22  GLN  79          HE21      GLN  79   0.807 -17.164  -9.321
   98    H    SER  80           H        SER  80   3.574 -22.357  -7.138
   99    HA   SER  80           HA       SER  80   1.711 -24.549  -7.101
  100    HB2  SER  80           HB2      SER  80   3.503 -25.744  -8.386
  101    HB3  SER  80           HB3      SER  80   2.970 -24.197  -9.074
  102    HG   SER  80           HG       SER  80   5.280 -24.443  -9.034
  103    H    ALA  81           H        ALA  81   4.952 -24.155  -5.495
  104    HA   ALA  81           HA       ALA  81   4.876 -26.596  -4.126
  105    HB1  ALA  81           HB1      ALA  81   6.512 -25.553  -2.600
  106    HB2  ALA  81           HB2      ALA  81   6.879 -25.187  -4.296
  107    HB3  ALA  81           HB3      ALA  81   6.113 -23.952  -3.258
  108    H    ALA  82           H        ALA  82   3.432 -23.436  -3.127
  109    HA   ALA  82           HA       ALA  82   2.494 -24.326  -0.585
  110    HB1  ALA  82           HB1      ALA  82   1.362 -22.182  -2.435
  111    HB2  ALA  82           HB2      ALA  82   1.018 -22.361  -0.706
  112    HB3  ALA  82           HB3      ALA  82   2.657 -21.955  -1.239
  113    H    ILE  83           H        ILE  83   0.817 -24.325  -3.774
  114    HA   ILE  83           HA       ILE  83  -1.612 -25.543  -2.860
  115    HB   ILE  83           HB       ILE  83  -0.295 -25.560  -5.597
  116   HG12  ILE  83          HG12      ILE  83  -2.703 -23.928  -4.735
  117   HG13  ILE  83          HG13      ILE  83  -1.087 -23.309  -4.458
  118   HG21  ILE  83          HG21      ILE  83  -1.953 -27.415  -5.448
  119   HG22  ILE  83          HG22      ILE  83  -3.162 -26.291  -4.806
  120   HG23  ILE  83          HG23      ILE  83  -2.576 -26.126  -6.470
  121   HD11  ILE  83          HD11      ILE  83  -0.630 -23.510  -6.925
  122   HD12  ILE  83          HD12      ILE  83  -2.332 -23.969  -7.156
  123   HD13  ILE  83          HD13      ILE  83  -1.931 -22.375  -6.508
  124    H    ARG  84           H        ARG  84   1.374 -27.032  -4.233
  125    HA   ARG  84           HA       ARG  84   0.529 -29.754  -4.078
  126    HB2  ARG  84           HB2      ARG  84   2.596 -28.872  -5.279
  127    HB3  ARG  84           HB3      ARG  84   3.351 -28.625  -3.714
  128    HG2  ARG  84           HG2      ARG  84   2.652 -31.302  -3.506
  129    HG3  ARG  84           HG3      ARG  84   2.831 -31.136  -5.251
  130    HD2  ARG  84           HD2      ARG  84   4.946 -31.821  -4.414
  131    HD3  ARG  84           HD3      ARG  84   5.113 -30.109  -4.831
  132    HE   ARG  84           HE       ARG  84   4.384 -30.650  -2.011
  133   HH11  ARG  84          HH11      ARG  84   7.141 -30.267  -4.144
  134   HH12  ARG  84          HH12      ARG  84   8.221 -29.926  -2.826
  135   HH21  ARG  84          HH21      ARG  84   5.822 -30.244  -0.360
  136   HH22  ARG  84          HH22      ARG  84   7.488 -29.905  -0.751
  137    H    GLU  85           H        GLU  85   2.429 -27.865  -1.640
  138    HA   GLU  85           HA       GLU  85   2.488 -29.971   0.203
  139    HB2  GLU  85           HB2      GLU  85   4.010 -27.970   0.083
  140    HB3  GLU  85           HB3      GLU  85   2.719 -27.055   0.886
  141    HG2  GLU  85           HG2      GLU  85   4.187 -27.809   2.601
  142    HG3  GLU  85           HG3      GLU  85   2.739 -28.818   2.691
  143    H    TRP  86           H        TRP  86   0.099 -27.269   0.019
  144    HA   TRP  86           HA       TRP  86  -1.476 -28.053   2.176
  145    HB2  TRP  86           HB2      TRP  86  -1.887 -25.974   1.058
  146    HB3  TRP  86           HB3      TRP  86  -2.187 -26.780  -0.481
  147    HD1  TRP  86           HD1      TRP  86  -3.827 -26.169   2.926
  148    HE1  TRP  86           HE1      TRP  86  -6.341 -26.674   2.788
  149    HE3  TRP  86           HE3      TRP  86  -4.039 -27.947  -1.881
  150    HZ2  TRP  86           HZ2      TRP  86  -8.169 -27.875   0.909
  151    HZ3  TRP  86           HZ3      TRP  86  -6.196 -28.721  -2.832
  152    HH2  TRP  86           HH2      TRP  86  -8.254 -28.722  -1.435
  153    H    ALA  87           H        ALA  87  -1.710 -29.163  -1.256
  154    HA   ALA  87           HA       ALA  87  -3.838 -30.994  -0.842
  155    HB1  ALA  87           HB1      ALA  87  -3.194 -30.158  -3.034
  156    HB2  ALA  87           HB2      ALA  87  -1.592 -30.896  -2.912
  157    HB3  ALA  87           HB3      ALA  87  -3.030 -31.926  -3.048
  158    H    ARG  88           H        ARG  88  -0.305 -31.546  -0.731
  159    HA   ARG  88           HA       ARG  88  -0.341 -34.346  -0.247
  160    HB2  ARG  88           HB2      ARG  88   1.581 -32.875  -1.008
  161    HB3  ARG  88           HB3      ARG  88   1.768 -32.324   0.660
  162    HG2  ARG  88           HG2      ARG  88   2.222 -34.708   1.340
  163    HG3  ARG  88           HG3      ARG  88   2.008 -35.195  -0.353
  164    HD2  ARG  88           HD2      ARG  88   4.340 -35.020  -0.130
  165    HD3  ARG  88           HD3      ARG  88   3.888 -33.524  -0.921
  166    HE   ARG  88           HE       ARG  88   4.460 -32.288   1.013
  167   HH11  ARG  88          HH11      ARG  88   4.825 -35.722   1.718
  168   HH12  ARG  88          HH12      ARG  88   5.732 -35.406   3.170
  169   HH21  ARG  88          HH21      ARG  88   5.475 -31.974   2.923
  170   HH22  ARG  88          HH22      ARG  88   6.125 -33.333   3.817
  171    H    ARG  89           H        ARG  89  -0.278 -31.643   2.113
  172    HA   ARG  89           HA       ARG  89  -0.313 -33.420   4.435
  173    HB2  ARG  89           HB2      ARG  89  -0.760 -30.418   4.151
  174    HB3  ARG  89           HB3      ARG  89  -0.707 -31.280   5.696
  175    HG2  ARG  89           HG2      ARG  89   1.583 -32.117   5.161
  176    HG3  ARG  89           HG3      ARG  89   1.559 -31.181   3.662
  177    HD2  ARG  89           HD2      ARG  89   1.200 -29.097   5.047
  178    HD3  ARG  89           HD3      ARG  89   1.432 -30.101   6.498
  179    HE   ARG  89           HE       ARG  89   3.582 -30.301   4.481
  180   HH11  ARG  89          HH11      ARG  89   2.678 -28.508   7.376
  181   HH12  ARG  89          HH12      ARG  89   4.313 -27.952   7.600
  182   HH21  ARG  89          HH21      ARG  89   5.475 -29.540   4.745
  183   HH22  ARG  89          HH22      ARG  89   5.920 -28.555   6.138
  184    H    ASN  90           H        ASN  90  -2.864 -32.098   2.458
  185    HA   ASN  90           HA       ASN  90  -4.937 -33.095   4.345
  186    HB2  ASN  90           HB2      ASN  90  -5.074 -31.504   1.757
  187    HB3  ASN  90           HB3      ASN  90  -6.493 -32.188   2.540
  188   HD21  ASN  90          HD22      ASN  90  -3.974 -29.748   2.874
  189   HD22  ASN  90          HD21      ASN  90  -4.760 -28.913   4.219
  190    H    GLY  91           H        GLY  91  -2.940 -34.699   2.313
  191    HA2  GLY  91           HA2      GLY  91  -2.987 -36.866   1.582
  192    HA3  GLY  91           HA3      GLY  91  -4.594 -37.048   2.286
  193    H    HIS  92           H        HIS  92  -4.213 -34.526  -0.108
  194    HA   HIS  92           HA       HIS  92  -6.028 -35.948  -1.970
  195    HB2  HIS  92           HB2      HIS  92  -4.845 -33.147  -2.134
  196    HB3  HIS  92           HB3      HIS  92  -6.154 -33.786  -3.123
  197    HD1  HIS  92           HD1      HIS  92  -7.682 -35.050  -0.348
  198    HD2  HIS  92           HD2      HIS  92  -6.439 -31.126  -1.317
  199    HE1  HIS  92           HE1      HIS  92  -9.138 -33.461   1.051
  200    HE2  HIS  92           HE2      HIS  92  -8.386 -31.073   0.448
  201    H    ASN  93           H        ASN  93  -5.559 -36.302  -4.192
  202    HA   ASN  93           HA       ASN  93  -2.908 -37.314  -4.683
  203    HB2  ASN  93           HB2      ASN  93  -4.993 -38.314  -5.558
  204    HB3  ASN  93           HB3      ASN  93  -5.252 -36.901  -6.584
  205   HD21  ASN  93          HD22      ASN  93  -5.310 -38.860  -8.157
  206   HD22  ASN  93          HD21      ASN  93  -3.765 -39.261  -8.892
  207    H    VAL  94           H        VAL  94  -1.148 -36.174  -5.236
  208    HA   VAL  94           HA       VAL  94  -1.238 -34.206  -7.388
  209    HB   VAL  94           HB       VAL  94  -1.689 -32.842  -5.356
  210   HG11  VAL  94          HG11      VAL  94   0.074 -32.353  -3.740
  211   HG12  VAL  94          HG12      VAL  94  -0.345 -34.071  -3.684
  212   HG13  VAL  94          HG13      VAL  94   1.145 -33.541  -4.491
  213   HG21  VAL  94          HG21      VAL  94  -0.183 -31.059  -5.892
  214   HG22  VAL  94          HG22      VAL  94   0.994 -32.174  -6.616
  215   HG23  VAL  94          HG23      VAL  94  -0.592 -31.910  -7.386
  216    H    SER  95           H        SER  95   0.760 -33.983  -8.472
  217    HA   SER  95           HA       SER  95   2.619 -36.198  -8.121
  218    HB2  SER  95           HB2      SER  95   1.986 -35.314 -10.351
  219    HB3  SER  95           HB3      SER  95   2.816 -33.797  -9.961
  220    HG   SER  95           HG       SER  95   3.887 -36.374 -10.439
  221    H    THR  96           H        THR  96   4.855 -36.090  -7.739
  222    HA   THR  96           HA       THR  96   5.839 -33.955  -5.944
  223    HB   THR  96           HB       THR  96   7.882 -35.389  -5.854
  224    HG1  THR  96           HG1      THR  96   7.728 -37.456  -6.802
  225   HG21  THR  96          HG21      THR  96   5.298 -36.907  -5.274
  226   HG22  THR  96          HG22      THR  96   6.897 -37.206  -4.552
  227   HG23  THR  96          HG23      THR  96   6.044 -35.694  -4.210
  228    H    ARG  97           H        ARG  97   5.917 -34.655  -9.327
  229    HA   ARG  97           HA       ARG  97   7.986 -32.535  -9.787
  230    HB2  ARG  97           HB2      ARG  97   9.218 -33.940 -11.339
  231    HB3  ARG  97           HB3      ARG  97   9.186 -34.654  -9.731
  232    HG2  ARG  97           HG2      ARG  97   7.389 -36.236 -10.473
  233    HG3  ARG  97           HG3      ARG  97   7.459 -35.523 -12.099
  234    HD2  ARG  97           HD2      ARG  97   9.840 -36.176 -12.286
  235    HD3  ARG  97           HD3      ARG  97   9.769 -36.884 -10.656
  236    HE   ARG  97           HE       ARG  97   7.698 -38.056 -12.213
  237   HH11  ARG  97          HH11      ARG  97  11.203 -38.127 -12.139
  238   HH12  ARG  97          HH12      ARG  97  11.279 -39.718 -12.854
  239   HH21  ARG  97          HH21      ARG  97   7.862 -40.083 -13.100
  240   HH22  ARG  97          HH22      ARG  97   9.424 -40.800 -13.370
  241    H    GLY  98           H        GLY  98   5.168 -34.192 -11.053
  242    HA2  GLY  98           HA2      GLY  98   5.169 -32.794 -13.636
  243    HA3  GLY  98           HA3      GLY  98   3.923 -33.846 -12.979
  244    H    ARG  99           H        ARG  99   2.790 -31.948 -14.152
  245    HA   ARG  99           HA       ARG  99   2.403 -29.464 -12.650
  246    HB2  ARG  99           HB2      ARG  99   0.844 -30.715 -14.954
  247    HB3  ARG  99           HB3      ARG  99   0.526 -29.113 -14.281
  248    HG2  ARG  99           HG2      ARG  99   2.844 -28.401 -14.842
  249    HG3  ARG  99           HG3      ARG  99   3.144 -29.973 -15.596
  250    HD2  ARG  99           HD2      ARG  99   0.992 -27.986 -16.446
  251    HD3  ARG  99           HD3      ARG  99   2.551 -28.156 -17.233
  252    HE   ARG  99           HE       ARG  99   0.226 -29.935 -17.448
  253   HH11  ARG  99          HH11      ARG  99   3.670 -29.738 -18.107
  254   HH12  ARG  99          HH12      ARG  99   3.604 -31.016 -19.289
  255   HH21  ARG  99          HH21      ARG  99   0.219 -31.556 -18.956
  256   HH22  ARG  99          HH22      ARG  99   1.694 -32.014 -19.758
  257    H    ILE 100           H        ILE 100   0.453 -28.760 -11.682
  258    HA   ILE 100           HA       ILE 100  -0.817 -30.828 -10.011
  259    HB   ILE 100           HB       ILE 100  -1.047 -27.815  -9.884
  260   HG12  ILE 100          HG12      ILE 100   0.653 -29.860  -8.379
  261   HG13  ILE 100          HG13      ILE 100   1.220 -28.545  -9.406
  262   HG21  ILE 100          HG21      ILE 100  -2.097 -28.189  -7.693
  263   HG22  ILE 100          HG22      ILE 100  -3.050 -28.970  -8.925
  264   HG23  ILE 100          HG23      ILE 100  -1.976 -29.944  -7.889
  265   HD11  ILE 100          HD11      ILE 100   1.604 -27.868  -7.185
  266   HD12  ILE 100          HD12      ILE 100   0.222 -26.913  -7.756
  267   HD13  ILE 100          HD13      ILE 100  -0.034 -28.310  -6.669
  268    HA   PRO 101           HA       PRO 101  -4.471 -30.893 -12.667
  269    HB2  PRO 101           HB2      PRO 101  -5.990 -31.788 -10.249
  270    HB3  PRO 101           HB3      PRO 101  -5.854 -32.567 -11.849
  271    HG2  PRO 101           HG2      PRO 101  -4.539 -33.547  -9.662
  272    HG3  PRO 101           HG3      PRO 101  -3.779 -33.557 -11.292
  273    HD2  PRO 101           HD2      PRO 101  -3.346 -31.597  -9.027
  274    HD3  PRO 101           HD3      PRO 101  -2.150 -32.393 -10.094
  275    H    ALA 102           H        ALA 102  -6.034 -29.374 -13.184
  276    HA   ALA 102           HA       ALA 102  -6.240 -27.002 -11.735
  277    HB1  ALA 102           HB1      ALA 102  -6.664 -27.242 -14.140
  278    HB2  ALA 102           HB2      ALA 102  -8.189 -28.098 -13.778
  279    HB3  ALA 102           HB3      ALA 102  -7.972 -26.397 -13.288
  280    H    ASP 103           H        ASP 103  -8.325 -29.881 -11.521
  281    HA   ASP 103           HA       ASP 103 -10.341 -28.855  -9.928
  282    HB2  ASP 103           HB2      ASP 103 -10.319 -31.088 -10.974
  283    HB3  ASP 103           HB3      ASP 103  -9.062 -31.611  -9.851
  284    H    VAL 104           H        VAL 104  -7.059 -29.899  -8.981
  285    HA   VAL 104           HA       VAL 104  -7.535 -29.605  -6.146
  286    HB   VAL 104           HB       VAL 104  -4.931 -29.961  -7.600
  287   HG11  VAL 104          HG11      VAL 104  -4.064 -30.803  -5.439
  288   HG12  VAL 104          HG12      VAL 104  -4.542 -29.108  -5.338
  289   HG13  VAL 104          HG13      VAL 104  -5.604 -30.370  -4.666
  290   HG21  VAL 104          HG21      VAL 104  -6.680 -32.056  -6.237
  291   HG22  VAL 104          HG22      VAL 104  -6.433 -31.911  -7.985
  292   HG23  VAL 104          HG23      VAL 104  -5.076 -32.344  -6.951
  293    H    ILE 105           H        ILE 105  -6.030 -27.633  -8.737
  294    HA   ILE 105           HA       ILE 105  -5.211 -25.441  -7.059
  295    HB   ILE 105           HB       ILE 105  -6.074 -25.644  -9.968
  296   HG12  ILE 105          HG12      ILE 105  -3.292 -24.931  -8.996
  297   HG13  ILE 105          HG13      ILE 105  -3.793 -26.602  -8.814
  298   HG21  ILE 105          HG21      ILE 105  -4.964 -23.206  -8.504
  299   HG22  ILE 105          HG22      ILE 105  -5.026 -23.381 -10.274
  300   HG23  ILE 105          HG23      ILE 105  -6.527 -23.342  -9.343
  301   HD11  ILE 105          HD11      ILE 105  -2.565 -26.181 -10.920
  302   HD12  ILE 105          HD12      ILE 105  -4.183 -26.866 -11.144
  303   HD13  ILE 105          HD13      ILE 105  -3.889 -25.137 -11.471
  304    H    ASP 106           H        ASP 106  -8.371 -26.031  -8.734
  305    HA   ASP 106           HA       ASP 106  -9.727 -23.875  -7.612
  306    HB2  ASP 106           HB2      ASP 106 -10.536 -25.211  -9.506
  307    HB3  ASP 106           HB3      ASP 106 -10.808 -26.586  -8.437
  308    H    ALA 107           H        ALA 107  -9.442 -27.249  -6.323
  309    HA   ALA 107           HA       ALA 107 -10.881 -26.952  -4.005
  310    HB1  ALA 107           HB1      ALA 107  -9.622 -28.892  -3.208
  311    HB2  ALA 107           HB2      ALA 107  -9.945 -29.080  -4.931
  312    HB3  ALA 107           HB3      ALA 107  -8.329 -28.594  -4.389
  313    H    TYR 108           H        TYR 108  -7.412 -26.156  -4.493
  314    HA   TYR 108           HA       TYR 108  -6.885 -25.186  -1.850
  315    HB2  TYR 108           HB2      TYR 108  -5.139 -25.822  -3.408
  316    HB3  TYR 108           HB3      TYR 108  -5.608 -24.572  -4.543
  317    HD1  TYR 108           HD1      TYR 108  -3.891 -25.280  -1.368
  318    HD2  TYR 108           HD2      TYR 108  -5.052 -22.206  -4.153
  319    HE1  TYR 108           HE1      TYR 108  -2.206 -23.741  -0.368
  320    HE2  TYR 108           HE2      TYR 108  -3.389 -20.659  -3.144
  321    HH   TYR 108           HH       TYR 108  -1.745 -20.389  -1.547
  322    H    HIS 109           H        HIS 109  -7.938 -23.396  -4.834
  323    HA   HIS 109           HA       HIS 109  -8.117 -20.819  -3.575
  324    HB2  HIS 109           HB2      HIS 109  -9.718 -21.976  -5.901
  325    HB3  HIS 109           HB3      HIS 109  -9.712 -20.285  -5.424
  326    HD1  HIS 109           HD1      HIS 109  -8.735 -21.225  -8.308
  327    HD2  HIS 109           HD2      HIS 109  -6.355 -20.244  -4.959
  328    HE1  HIS 109           HE1      HIS 109  -6.438 -20.494  -9.229
  329    HE2  HIS 109           HE2      HIS 109  -4.999 -19.908  -7.176
  330    H    ALA 110           H        ALA 110 -10.588 -23.449  -3.713
  331    HA   ALA 110           HA       ALA 110 -12.563 -21.975  -2.271
  332    HB1  ALA 110           HB1      ALA 110 -13.569 -24.177  -1.847
  333    HB2  ALA 110           HB2      ALA 110 -13.052 -24.029  -3.539
  334    HB3  ALA 110           HB3      ALA 110 -12.085 -24.985  -2.396
  335    H    ALA 111           H        ALA 111 -10.119 -24.358  -1.001
  336    HA   ALA 111           HA       ALA 111 -10.828 -24.106   1.649
  337    HB1  ALA 111           HB1      ALA 111  -8.106 -24.721   0.429
  338    HB2  ALA 111           HB2      ALA 111  -8.620 -25.150   2.078
  339    HB3  ALA 111           HB3      ALA 111  -9.432 -25.883   0.677
  340    H    THR 112           H        THR 112  -8.564 -22.115  -0.183
  341    HA   THR 112           HA       THR 112  -7.627 -20.626   2.166
  342    HB   THR 112           HB       THR 112  -6.325 -19.283   0.534
  343    HG1  THR 112           HG1      THR 112  -7.154 -21.194  -1.360
  344   HG21  THR 112          HG21      THR 112  -5.363 -21.296   1.563
  345   HG22  THR 112          HG22      THR 112  -6.002 -22.306   0.253
  346   HG23  THR 112          HG23      THR 112  -4.776 -21.060  -0.086
  347    H    LEU 113           H        LEU 113 -10.376 -20.176   0.166
  348    HA   LEU 113           HA       LEU 113 -10.603 -17.303   1.048
  349    HB2  LEU 113           HB2      LEU 113 -11.753 -18.612  -1.443
  350    HB3  LEU 113           HB3      LEU 113 -11.924 -16.924  -0.988
  351    HG   LEU 113           HG       LEU 113  -9.279 -18.275  -1.660
  352   HD11  LEU 113          HD11      LEU 113 -10.790 -18.103  -3.611
  353   HD12  LEU 113          HD12      LEU 113 -10.992 -16.364  -3.309
  354   HD13  LEU 113          HD13      LEU 113  -9.399 -17.016  -3.765
  355   HD21  LEU 113          HD21      LEU 113  -8.402 -15.959  -1.809
  356   HD22  LEU 113          HD22      LEU 113  -9.963 -15.324  -1.258
  357   HD23  LEU 113          HD23      LEU 113  -8.964 -16.321  -0.177
  358    H    GLU 114           H        GLU 114 -12.460 -20.255   0.433
  359    HA   GLU 114           HA       GLU 114 -14.888 -19.054   1.584
  360    HB2  GLU 114           HB2      GLU 114 -14.387 -21.670   0.142
  361    HB3  GLU 114           HB3      GLU 114 -15.950 -21.239   0.805
  362    HG2  GLU 114           HG2      GLU 114 -14.536 -19.412  -1.166
  363    HG3  GLU 114           HG3      GLU 114 -15.511 -20.776  -1.678
  364    H    HIS 115           H        HIS 115 -12.378 -20.382   3.111
  365    HA   HIS 115           HA       HIS 115 -13.395 -22.176   5.018
  366    HB2  HIS 115           HB2      HIS 115 -11.610 -21.157   6.532
  367    HB3  HIS 115           HB3      HIS 115 -11.084 -21.772   4.982
  368    HD1  HIS 115           HD1      HIS 115 -12.547 -18.192   5.351
  369    HD2  HIS 115           HD2      HIS 115  -8.947 -20.300   4.688
  370    HE1  HIS 115           HE1      HIS 115 -10.792 -16.432   4.652
  371    HE2  HIS 115           HE2      HIS 115  -8.605 -17.731   4.233
  372    H    HIS 116           H        HIS 116 -14.648 -22.093   6.773
  373    HA   HIS 116           HA       HIS 116 -16.254 -21.460   8.227
  374    HB2  HIS 116           HB2      HIS 116 -14.707 -18.868   8.552
  375    HB3  HIS 116           HB3      HIS 116 -15.733 -19.661   9.738
  376    HD1  HIS 116           HD1      HIS 116 -14.704 -22.329  10.383
  377    HD2  HIS 116           HD2      HIS 116 -12.179 -19.273   8.910
  378    HE1  HIS 116           HE1      HIS 116 -12.302 -23.005  11.008
  379    HE2  HIS 116           HE2      HIS 116 -10.770 -21.139  10.114
  380    H    HIS 117           H        HIS 117 -16.825 -20.617   5.375
  381    HA   HIS 117           HA       HIS 117 -18.872 -18.480   5.883
  382    HB2  HIS 117           HB2      HIS 117 -17.829 -19.661   3.285
  383    HB3  HIS 117           HB3      HIS 117 -19.048 -18.406   3.408
  384    HD1  HIS 117           HD1      HIS 117 -16.677 -17.612   1.746
  385    HD2  HIS 117           HD2      HIS 117 -16.909 -17.088   5.942
  386    HE1  HIS 117           HE1      HIS 117 -15.010 -15.742   2.351
  387    HE2  HIS 117           HE2      HIS 117 -15.173 -15.424   4.905
  388    H    HIS 118           H        HIS 118 -18.924 -21.777   6.167
  389    HA   HIS 118           HA       HIS 118 -21.219 -22.463   4.572
  390    HB2  HIS 118           HB2      HIS 118 -19.421 -24.030   5.255
  391    HB3  HIS 118           HB3      HIS 118 -19.963 -23.933   6.931
  392    HD1  HIS 118           HD1      HIS 118 -21.312 -25.139   3.488
  393    HD2  HIS 118           HD2      HIS 118 -21.826 -25.649   7.653
  394    HE1  HIS 118           HE1      HIS 118 -22.980 -27.079   3.787
  395    HE2  HIS 118           HE2      HIS 118 -23.280 -27.387   6.328
  396    H    HIS 119           H        HIS 119 -21.025 -21.206   7.841
  397    HA   HIS 119           HA       HIS 119 -23.653 -22.028   8.728
  398    HB2  HIS 119           HB2      HIS 119 -23.262 -20.532  10.621
  399    HB3  HIS 119           HB3      HIS 119 -21.845 -21.515  10.304
  400    HD1  HIS 119           HD1      HIS 119 -23.056 -17.841   9.830
  401    HD2  HIS 119           HD2      HIS 119 -19.566 -20.247   9.855
  402    HE1  HIS 119           HE1      HIS 119 -21.052 -16.232   9.688
  403    HE2  HIS 119           HE2      HIS 119 -18.929 -17.710   9.664
  404    H    HIS 120           H        HIS 120 -25.395 -20.573   9.348
  405    HA   HIS 120           HA       HIS 120 -26.341 -18.808   7.254
  406    HB2  HIS 120           HB2      HIS 120 -27.718 -20.240   8.857
  407    HB3  HIS 120           HB3      HIS 120 -27.351 -19.061  10.114
  408    HD1  HIS 120           HD1      HIS 120 -27.807 -16.515   8.008
  409    HD2  HIS 120           HD2      HIS 120 -30.343 -19.759   8.933
  410    HE1  HIS 120           HE1      HIS 120 -30.233 -15.734   7.461
  411    HE2  HIS 120           HE2      HIS 120 -31.761 -17.731   8.037
  Start of MODEL   17
    1    H1   SER  66           H1       SER  66  10.508  -6.988 -30.160
    2    H2   SER  66           H2       SER  66   9.728  -5.661 -30.730
    3    H3   SER  66           H3       SER  66  11.141  -6.135 -31.409
    4    HA   SER  66           HA       SER  66  12.352  -5.686 -29.388
    5    HB2  SER  66           HB2      SER  66  10.762  -3.272 -30.362
    6    HB3  SER  66           HB3      SER  66  12.320  -3.250 -29.514
    7    HG   SER  66           HG       SER  66  12.588  -3.099 -31.797
    8    H    GLY  67           H        GLY  67  12.408  -4.781 -27.259
    9    HA2  GLY  67           HA2      GLY  67  11.623  -4.244 -25.157
   10    HA3  GLY  67           HA3      GLY  67  10.012  -4.004 -25.812
   11    H    SER  68           H        SER  68   9.639  -4.982 -23.605
   12    HA   SER  68           HA       SER  68   9.324  -7.952 -23.739
   13    HB2  SER  68           HB2      SER  68  10.374  -6.363 -21.361
   14    HB3  SER  68           HB3      SER  68   9.975  -8.090 -21.354
   15    HG   SER  68           HG       SER  68  12.234  -7.700 -21.685
   16    H    GLY  69           H        GLY  69   7.680  -8.829 -22.366
   17    HA2  GLY  69           HA2      GLY  69   5.275  -7.249 -22.096
   18    HA3  GLY  69           HA3      GLY  69   5.524  -8.899 -21.530
   19    H    ARG  70           H        ARG  70   4.018  -7.105 -20.088
   20    HA   ARG  70           HA       ARG  70   5.555  -5.806 -17.987
   21    HB2  ARG  70           HB2      ARG  70   3.437  -5.178 -17.025
   22    HB3  ARG  70           HB3      ARG  70   3.407  -4.896 -18.761
   23    HG2  ARG  70           HG2      ARG  70   2.107  -7.024 -19.066
   24    HG3  ARG  70           HG3      ARG  70   2.102  -7.251 -17.306
   25    HD2  ARG  70           HD2      ARG  70   0.915  -5.101 -17.029
   26    HD3  ARG  70           HD3      ARG  70   0.917  -4.875 -18.791
   27    HE   ARG  70           HE       ARG  70  -0.251  -7.406 -18.214
   28   HH11  ARG  70          HH11      ARG  70  -1.096  -4.024 -17.801
   29   HH12  ARG  70          HH12      ARG  70  -2.805  -4.352 -17.861
   30   HH21  ARG  70          HH21      ARG  70  -2.448  -7.752 -18.277
   31   HH22  ARG  70          HH22      ARG  70  -3.544  -6.410 -18.130
   32    H    GLY  71           H        GLY  71   5.695  -6.166 -15.847
   33    HA2  GLY  71           HA2      GLY  71   6.168  -7.432 -13.971
   34    HA3  GLY  71           HA3      GLY  71   4.826  -8.476 -14.432
   35    H    ARG  72           H        ARG  72   5.786 -10.361 -13.928
   36    HA   ARG  72           HA       ARG  72   8.415 -11.223 -15.032
   37    HB2  ARG  72           HB2      ARG  72   6.333 -12.597 -13.276
   38    HB3  ARG  72           HB3      ARG  72   7.801 -13.379 -13.869
   39    HG2  ARG  72           HG2      ARG  72   9.212 -11.803 -12.661
   40    HG3  ARG  72           HG3      ARG  72   7.795 -10.883 -12.122
   41    HD2  ARG  72           HD2      ARG  72   8.638 -12.427 -10.346
   42    HD3  ARG  72           HD3      ARG  72   6.979 -12.753 -10.822
   43    HE   ARG  72           HE       ARG  72   7.590 -14.762 -11.857
   44   HH11  ARG  72          HH11      ARG  72  10.515 -13.228 -10.655
   45   HH12  ARG  72          HH12      ARG  72  11.473 -14.659 -10.911
   46   HH21  ARG  72          HH21      ARG  72   8.885 -16.509 -12.234
   47   HH22  ARG  72          HH22      ARG  72  10.571 -16.463 -11.807
   48    H    GLY  73           H        GLY  73   4.998 -11.897 -15.614
   49    HA2  GLY  73           HA2      GLY  73   3.941 -12.985 -17.374
   50    HA3  GLY  73           HA3      GLY  73   5.500 -13.328 -18.123
   51    H    ALA  74           H        ALA  74   5.915 -14.458 -15.048
   52    HA   ALA  74           HA       ALA  74   4.403 -16.957 -15.160
   53    HB1  ALA  74           HB1      ALA  74   7.456 -16.927 -15.361
   54    HB2  ALA  74           HB2      ALA  74   6.455 -18.375 -15.113
   55    HB3  ALA  74           HB3      ALA  74   6.334 -17.463 -16.628
   56    H    ILE  75           H        ILE  75   4.401 -18.086 -13.170
   57    HA   ILE  75           HA       ILE  75   4.705 -16.434 -10.822
   58    HB   ILE  75           HB       ILE  75   3.994 -19.373 -11.162
   59   HG12  ILE  75          HG12      ILE  75   2.259 -16.918 -10.578
   60   HG13  ILE  75          HG13      ILE  75   2.407 -17.695 -12.150
   61   HG21  ILE  75          HG21      ILE  75   4.877 -19.044  -8.871
   62   HG22  ILE  75          HG22      ILE  75   3.772 -17.669  -8.631
   63   HG23  ILE  75          HG23      ILE  75   3.154 -19.323  -8.837
   64   HD11  ILE  75          HD11      ILE  75   0.366 -18.443 -11.213
   65   HD12  ILE  75          HD12      ILE  75   1.487 -19.815 -11.147
   66   HD13  ILE  75          HD13      ILE  75   1.123 -18.882  -9.672
   67    H    ASP  76           H        ASP  76   6.167 -16.525  -9.136
   68    HA   ASP  76           HA       ASP  76   8.821 -17.603  -9.730
   69    HB2  ASP  76           HB2      ASP  76   8.389 -15.301  -8.856
   70    HB3  ASP  76           HB3      ASP  76   7.845 -16.010  -7.340
   71    H    ARG  77           H        ARG  77   7.380 -19.722  -9.617
   72    HA   ARG  77           HA       ARG  77   6.698 -21.662  -8.755
   73    HB2  ARG  77           HB2      ARG  77   8.435 -23.060  -7.929
   74    HB3  ARG  77           HB3      ARG  77   9.067 -21.984  -9.166
   75    HG2  ARG  77           HG2      ARG  77  10.154 -20.585  -7.487
   76    HG3  ARG  77           HG3      ARG  77   9.420 -21.512  -6.170
   77    HD2  ARG  77           HD2      ARG  77  11.346 -22.632  -8.251
   78    HD3  ARG  77           HD3      ARG  77  11.835 -22.069  -6.662
   79    HE   ARG  77           HE       ARG  77  10.471 -24.573  -7.326
   80   HH11  ARG  77          HH11      ARG  77  11.271 -22.446  -4.648
   81   HH12  ARG  77          HH12      ARG  77  11.068 -23.707  -3.466
   82   HH21  ARG  77          HH21      ARG  77  10.216 -26.126  -5.765
   83   HH22  ARG  77          HH22      ARG  77  10.478 -25.742  -4.090
   84    H    GLU  78           H        GLU  78   6.685 -19.361  -6.407
   85    HA   GLU  78           HA       GLU  78   6.290 -20.543  -3.986
   86    HB2  GLU  78           HB2      GLU  78   6.191 -18.128  -4.453
   87    HB3  GLU  78           HB3      GLU  78   4.642 -18.326  -5.261
   88    HG2  GLU  78           HG2      GLU  78   3.740 -19.204  -3.000
   89    HG3  GLU  78           HG3      GLU  78   5.259 -18.646  -2.298
   90    H    GLN  79           H        GLN  79   3.553 -20.088  -6.314
   91    HA   GLN  79           HA       GLN  79   1.714 -21.574  -4.647
   92    HB2  GLN  79           HB2      GLN  79   1.510 -20.745  -7.568
   93    HB3  GLN  79           HB3      GLN  79   0.182 -21.378  -6.598
   94    HG2  GLN  79           HG2      GLN  79   1.715 -18.788  -6.034
   95    HG3  GLN  79           HG3      GLN  79   0.127 -18.901  -6.765
   96   HE21  GLN  79          HE22      GLN  79   1.427 -17.956  -3.903
   97   HE22  GLN  79          HE21      GLN  79   0.170 -18.566  -2.837
   98    H    SER  80           H        SER  80   3.721 -22.500  -7.427
   99    HA   SER  80           HA       SER  80   2.761 -25.137  -7.806
  100    HB2  SER  80           HB2      SER  80   5.604 -24.147  -8.246
  101    HB3  SER  80           HB3      SER  80   4.782 -25.488  -9.070
  102    HG   SER  80           HG       SER  80   4.719 -23.628 -10.386
  103    H    ALA  81           H        ALA  81   4.699 -23.916  -5.190
  104    HA   ALA  81           HA       ALA  81   5.224 -26.634  -4.229
  105    HB1  ALA  81           HB1      ALA  81   6.297 -23.945  -3.285
  106    HB2  ALA  81           HB2      ALA  81   6.770 -25.532  -2.643
  107    HB3  ALA  81           HB3      ALA  81   7.151 -25.102  -4.326
  108    H    ALA  82           H        ALA  82   3.712 -23.546  -3.119
  109    HA   ALA  82           HA       ALA  82   2.851 -24.520  -0.623
  110    HB1  ALA  82           HB1      ALA  82   1.655 -22.312  -2.355
  111    HB2  ALA  82           HB2      ALA  82   1.416 -22.522  -0.607
  112    HB3  ALA  82           HB3      ALA  82   3.029 -22.145  -1.237
  113    H    ILE  83           H        ILE  83   1.009 -24.508  -3.736
  114    HA   ILE  83           HA       ILE  83  -1.395 -25.635  -2.551
  115    HB   ILE  83           HB       ILE  83  -0.493 -25.555  -5.454
  116   HG12  ILE  83          HG12      ILE  83  -2.304 -23.693  -3.858
  117   HG13  ILE  83          HG13      ILE  83  -0.693 -23.300  -4.426
  118   HG21  ILE  83          HG21      ILE  83  -2.887 -25.943  -5.996
  119   HG22  ILE  83          HG22      ILE  83  -2.245 -27.287  -5.078
  120   HG23  ILE  83          HG23      ILE  83  -3.256 -26.075  -4.264
  121   HD11  ILE  83          HD11      ILE  83  -2.225 -22.244  -5.902
  122   HD12  ILE  83          HD12      ILE  83  -1.491 -23.595  -6.800
  123   HD13  ILE  83          HD13      ILE  83  -3.149 -23.728  -6.153
  124    H    ARG  84           H        ARG  84   1.495 -27.036  -4.063
  125    HA   ARG  84           HA       ARG  84   0.571 -29.791  -4.037
  126    HB2  ARG  84           HB2      ARG  84   2.231 -29.220  -5.570
  127    HB3  ARG  84           HB3      ARG  84   3.259 -28.420  -4.381
  128    HG2  ARG  84           HG2      ARG  84   4.179 -30.387  -3.604
  129    HG3  ARG  84           HG3      ARG  84   2.761 -31.365  -4.001
  130    HD2  ARG  84           HD2      ARG  84   4.844 -31.769  -5.427
  131    HD3  ARG  84           HD3      ARG  84   3.290 -31.543  -6.235
  132    HE   ARG  84           HE       ARG  84   4.912 -29.091  -5.976
  133   HH11  ARG  84          HH11      ARG  84   4.278 -31.826  -8.081
  134   HH12  ARG  84          HH12      ARG  84   4.534 -30.876  -9.534
  135   HH21  ARG  84          HH21      ARG  84   5.123 -27.941  -7.830
  136   HH22  ARG  84          HH22      ARG  84   5.196 -28.768  -9.376
  137    H    GLU  85           H        GLU  85   2.629 -27.960  -1.696
  138    HA   GLU  85           HA       GLU  85   2.778 -30.029   0.160
  139    HB2  GLU  85           HB2      GLU  85   4.081 -27.864   0.152
  140    HB3  GLU  85           HB3      GLU  85   2.658 -27.076   0.863
  141    HG2  GLU  85           HG2      GLU  85   2.752 -28.809   2.718
  142    HG3  GLU  85           HG3      GLU  85   4.254 -29.413   2.028
  143    H    TRP  86           H        TRP  86   0.299 -27.387  -0.004
  144    HA   TRP  86           HA       TRP  86  -1.355 -28.146   2.063
  145    HB2  TRP  86           HB2      TRP  86  -1.590 -26.089   0.819
  146    HB3  TRP  86           HB3      TRP  86  -1.981 -26.955  -0.652
  147    HD1  TRP  86           HD1      TRP  86  -3.510 -25.787   2.613
  148    HE1  TRP  86           HE1      TRP  86  -6.069 -25.958   2.489
  149    HE3  TRP  86           HE3      TRP  86  -3.948 -28.295  -1.843
  150    HZ2  TRP  86           HZ2      TRP  86  -8.043 -27.137   0.743
  151    HZ3  TRP  86           HZ3      TRP  86  -6.192 -28.962  -2.687
  152    HH2  TRP  86           HH2      TRP  86  -8.233 -28.410  -1.387
  153    H    ALA  87           H        ALA  87  -1.506 -29.332  -1.329
  154    HA   ALA  87           HA       ALA  87  -3.626 -31.187  -0.952
  155    HB1  ALA  87           HB1      ALA  87  -2.878 -30.335  -3.136
  156    HB2  ALA  87           HB2      ALA  87  -1.319 -31.160  -2.955
  157    HB3  ALA  87           HB3      ALA  87  -2.803 -32.113  -3.119
  158    H    ARG  88           H        ARG  88  -0.066 -31.677  -0.683
  159    HA   ARG  88           HA       ARG  88  -0.194 -34.494  -0.118
  160    HB2  ARG  88           HB2      ARG  88   1.799 -33.208  -0.929
  161    HB3  ARG  88           HB3      ARG  88   1.946 -32.460   0.668
  162    HG2  ARG  88           HG2      ARG  88   2.337 -34.690   1.683
  163    HG3  ARG  88           HG3      ARG  88   2.091 -35.463   0.106
  164    HD2  ARG  88           HD2      ARG  88   4.035 -34.223  -0.800
  165    HD3  ARG  88           HD3      ARG  88   4.312 -33.470   0.773
  166    HE   ARG  88           HE       ARG  88   4.851 -36.261  -0.033
  167   HH11  ARG  88          HH11      ARG  88   4.731 -34.095   2.733
  168   HH12  ARG  88          HH12      ARG  88   5.691 -35.166   3.713
  169   HH21  ARG  88          HH21      ARG  88   6.066 -37.567   1.285
  170   HH22  ARG  88          HH22      ARG  88   6.430 -37.073   2.910
  171    H    ARG  89           H        ARG  89  -0.267 -31.676   2.050
  172    HA   ARG  89           HA       ARG  89  -0.309 -33.132   4.551
  173    HB2  ARG  89           HB2      ARG  89  -1.279 -30.362   3.734
  174    HB3  ARG  89           HB3      ARG  89  -1.407 -30.967   5.385
  175    HG2  ARG  89           HG2      ARG  89   1.016 -31.234   5.555
  176    HG3  ARG  89           HG3      ARG  89   1.235 -30.733   3.873
  177    HD2  ARG  89           HD2      ARG  89   0.209 -28.529   4.393
  178    HD3  ARG  89           HD3      ARG  89  -0.008 -29.007   6.073
  179    HE   ARG  89           HE       ARG  89   2.458 -28.111   4.756
  180   HH11  ARG  89          HH11      ARG  89   1.365 -29.835   7.637
  181   HH12  ARG  89          HH12      ARG  89   2.843 -29.450   8.476
  182   HH21  ARG  89          HH21      ARG  89   4.169 -27.697   5.801
  183   HH22  ARG  89          HH22      ARG  89   4.445 -28.250   7.454
  184    H    ASN  90           H        ASN  90  -2.973 -32.051   2.423
  185    HA   ASN  90           HA       ASN  90  -4.915 -33.257   4.295
  186    HB2  ASN  90           HB2      ASN  90  -6.539 -31.867   3.359
  187    HB3  ASN  90           HB3      ASN  90  -5.086 -30.894   3.551
  188   HD21  ASN  90          HD22      ASN  90  -6.215 -29.446   2.068
  189   HD22  ASN  90          HD21      ASN  90  -6.069 -29.736   0.351
  190    H    GLY  91           H        GLY  91  -3.357 -34.464   1.599
  191    HA2  GLY  91           HA2      GLY  91  -3.575 -36.687   0.937
  192    HA3  GLY  91           HA3      GLY  91  -5.207 -36.758   1.587
  193    H    HIS  92           H        HIS  92  -4.563 -34.097  -0.599
  194    HA   HIS  92           HA       HIS  92  -6.220 -35.357  -2.726
  195    HB2  HIS  92           HB2      HIS  92  -5.044 -32.586  -2.389
  196    HB3  HIS  92           HB3      HIS  92  -5.670 -33.138  -3.939
  197    HD1  HIS  92           HD1      HIS  92  -6.920 -32.430  -0.378
  198    HD2  HIS  92           HD2      HIS  92  -8.307 -33.262  -4.278
  199    HE1  HIS  92           HE1      HIS  92  -9.488 -32.048  -0.340
  200    HE2  HIS  92           HE2      HIS  92 -10.311 -32.554  -2.730
  201    H    ASN  93           H        ASN  93  -5.523 -35.989  -4.741
  202    HA   ASN  93           HA       ASN  93  -2.835 -37.017  -4.911
  203    HB2  ASN  93           HB2      ASN  93  -4.870 -38.105  -5.860
  204    HB3  ASN  93           HB3      ASN  93  -5.005 -36.801  -7.040
  205   HD21  ASN  93          HD22      ASN  93  -4.938 -38.827  -8.469
  206   HD22  ASN  93          HD21      ASN  93  -3.342 -39.350  -8.977
  207    H    VAL  94           H        VAL  94  -1.021 -36.133  -5.754
  208    HA   VAL  94           HA       VAL  94  -1.085 -34.087  -7.830
  209    HB   VAL  94           HB       VAL  94  -1.370 -32.772  -5.734
  210   HG11  VAL  94          HG11      VAL  94   1.448 -33.647  -4.984
  211   HG12  VAL  94          HG12      VAL  94   0.428 -32.465  -4.144
  212   HG13  VAL  94          HG13      VAL  94  -0.041 -34.169  -4.170
  213   HG21  VAL  94          HG21      VAL  94   0.289 -31.088  -6.219
  214   HG22  VAL  94          HG22      VAL  94   1.288 -32.251  -7.111
  215   HG23  VAL  94          HG23      VAL  94  -0.313 -31.787  -7.727
  216    H    SER  95           H        SER  95   0.843 -33.986  -9.030
  217    HA   SER  95           HA       SER  95   2.592 -36.290  -8.845
  218    HB2  SER  95           HB2      SER  95   2.019 -35.257 -11.014
  219    HB3  SER  95           HB3      SER  95   2.840 -33.765 -10.520
  220    HG   SER  95           HG       SER  95   3.936 -36.273 -11.208
  221    H    THR  96           H        THR  96   4.774 -36.426  -8.312
  222    HA   THR  96           HA       THR  96   5.879 -34.494  -6.408
  223    HB   THR  96           HB       THR  96   7.835 -36.062  -6.431
  224    HG1  THR  96           HG1      THR  96   7.555 -38.017  -7.559
  225   HG21  THR  96          HG21      THR  96   5.953 -36.374  -4.836
  226   HG22  THR  96          HG22      THR  96   5.135 -37.431  -6.014
  227   HG23  THR  96          HG23      THR  96   6.694 -37.914  -5.307
  228    H    ARG  97           H        ARG  97   5.995 -34.808  -9.840
  229    HA   ARG  97           HA       ARG  97   8.234 -32.818  -9.987
  230    HB2  ARG  97           HB2      ARG  97   9.007 -35.210 -10.303
  231    HB3  ARG  97           HB3      ARG  97   7.957 -35.329 -11.703
  232    HG2  ARG  97           HG2      ARG  97  10.274 -34.955 -12.357
  233    HG3  ARG  97           HG3      ARG  97   9.262 -33.621 -12.886
  234    HD2  ARG  97           HD2      ARG  97  11.419 -32.808 -12.018
  235    HD3  ARG  97           HD3      ARG  97  10.087 -32.206 -11.053
  236    HE   ARG  97           HE       ARG  97  10.794 -33.451  -9.218
  237   HH11  ARG  97          HH11      ARG  97  12.741 -34.460 -11.960
  238   HH12  ARG  97          HH12      ARG  97  13.859 -35.342 -10.954
  239   HH21  ARG  97          HH21      ARG  97  12.259 -34.586  -8.005
  240   HH22  ARG  97          HH22      ARG  97  13.588 -35.407  -8.772
  241    H    GLY  98           H        GLY  98   5.347 -34.102 -11.557
  242    HA2  GLY  98           HA2      GLY  98   5.407 -32.268 -13.825
  243    HA3  GLY  98           HA3      GLY  98   4.102 -33.345 -13.346
  244    H    ARG  99           H        ARG  99   2.925 -31.382 -14.136
  245    HA   ARG  99           HA       ARG  99   2.727 -29.030 -12.393
  246    HB2  ARG  99           HB2      ARG  99   1.019 -30.005 -14.729
  247    HB3  ARG  99           HB3      ARG  99   0.784 -28.467 -13.895
  248    HG2  ARG  99           HG2      ARG  99   3.094 -27.775 -14.486
  249    HG3  ARG  99           HG3      ARG  99   3.318 -29.273 -15.399
  250    HD2  ARG  99           HD2      ARG  99   1.171 -27.188 -15.964
  251    HD3  ARG  99           HD3      ARG  99   2.731 -27.287 -16.799
  252    HE   ARG  99           HE       ARG  99   1.581 -29.827 -17.077
  253   HH11  ARG  99          HH11      ARG  99   0.749 -26.591 -18.140
  254   HH12  ARG  99          HH12      ARG  99  -0.131 -27.172 -19.528
  255   HH21  ARG  99          HH21      ARG  99   0.435 -30.502 -18.862
  256   HH22  ARG  99          HH22      ARG  99  -0.290 -29.329 -19.923
  257    H    ILE 100           H        ILE 100   0.724 -28.335 -11.413
  258    HA   ILE 100           HA       ILE 100  -0.501 -30.449  -9.761
  259    HB   ILE 100           HB       ILE 100  -0.839 -27.451  -9.642
  260   HG12  ILE 100          HG12      ILE 100   0.926 -29.390  -8.084
  261   HG13  ILE 100          HG13      ILE 100   1.462 -28.095  -9.151
  262   HG21  ILE 100          HG21      ILE 100  -2.799 -28.705  -8.677
  263   HG22  ILE 100          HG22      ILE 100  -1.675 -29.601  -7.622
  264   HG23  ILE 100          HG23      ILE 100  -1.896 -27.847  -7.462
  265   HD11  ILE 100          HD11      ILE 100   0.377 -26.441  -7.589
  266   HD12  ILE 100          HD12      ILE 100   0.135 -27.802  -6.454
  267   HD13  ILE 100          HD13      ILE 100   1.772 -27.328  -6.939
  268    HA   PRO 101           HA       PRO 101  -4.113 -30.576 -12.479
  269    HB2  PRO 101           HB2      PRO 101  -5.674 -31.561 -10.130
  270    HB3  PRO 101           HB3      PRO 101  -5.441 -32.320 -11.730
  271    HG2  PRO 101           HG2      PRO 101  -4.182 -33.273  -9.504
  272    HG3  PRO 101           HG3      PRO 101  -3.367 -33.245 -11.105
  273    HD2  PRO 101           HD2      PRO 101  -3.092 -31.274  -8.815
  274    HD3  PRO 101           HD3      PRO 101  -1.822 -32.031  -9.829
  275    H    ALA 102           H        ALA 102  -5.671 -29.059 -13.012
  276    HA   ALA 102           HA       ALA 102  -5.964 -26.730 -11.511
  277    HB1  ALA 102           HB1      ALA 102  -6.302 -26.909 -13.928
  278    HB2  ALA 102           HB2      ALA 102  -7.829 -27.796 -13.639
  279    HB3  ALA 102           HB3      ALA 102  -7.655 -26.106 -13.096
  280    H    ASP 103           H        ASP 103  -8.063 -29.622 -11.473
  281    HA   ASP 103           HA       ASP 103 -10.138 -28.647  -9.934
  282    HB2  ASP 103           HB2      ASP 103 -10.089 -30.846 -11.036
  283    HB3  ASP 103           HB3      ASP 103  -8.858 -31.404  -9.898
  284    H    VAL 104           H        VAL 104  -6.903 -29.692  -8.876
  285    HA   VAL 104           HA       VAL 104  -7.515 -29.504  -6.060
  286    HB   VAL 104           HB       VAL 104  -4.839 -29.804  -7.389
  287   HG11  VAL 104          HG11      VAL 104  -4.582 -29.062  -5.061
  288   HG12  VAL 104          HG12      VAL 104  -5.665 -30.367  -4.520
  289   HG13  VAL 104          HG13      VAL 104  -4.081 -30.743  -5.242
  290   HG21  VAL 104          HG21      VAL 104  -5.026 -32.214  -6.854
  291   HG22  VAL 104          HG22      VAL 104  -6.667 -31.949  -6.216
  292   HG23  VAL 104          HG23      VAL 104  -6.326 -31.731  -7.938
  293    H    ILE 105           H        ILE 105  -5.921 -27.440  -8.514
  294    HA   ILE 105           HA       ILE 105  -5.177 -25.302  -6.728
  295    HB   ILE 105           HB       ILE 105  -5.890 -25.444  -9.682
  296   HG12  ILE 105          HG12      ILE 105  -3.171 -24.711  -8.540
  297   HG13  ILE 105          HG13      ILE 105  -3.661 -26.396  -8.447
  298   HG21  ILE 105          HG21      ILE 105  -4.849 -23.153  -9.878
  299   HG22  ILE 105          HG22      ILE 105  -6.416 -23.174  -9.075
  300   HG23  ILE 105          HG23      ILE 105  -4.925 -23.017  -8.108
  301   HD11  ILE 105          HD11      ILE 105  -3.691 -24.839 -11.056
  302   HD12  ILE 105          HD12      ILE 105  -2.349 -25.854 -10.496
  303   HD13  ILE 105          HD13      ILE 105  -3.936 -26.588 -10.794
  304    H    ASP 106           H        ASP 106  -8.246 -25.864  -8.567
  305    HA   ASP 106           HA       ASP 106  -9.666 -23.744  -7.432
  306    HB2  ASP 106           HB2      ASP 106 -10.588 -26.423  -8.513
  307    HB3  ASP 106           HB3      ASP 106 -11.703 -25.172  -7.968
  308    H    ALA 107           H        ALA 107  -9.421 -27.156  -6.231
  309    HA   ALA 107           HA       ALA 107 -10.970 -26.908  -3.975
  310    HB1  ALA 107           HB1      ALA 107  -8.391 -28.528  -4.309
  311    HB2  ALA 107           HB2      ALA 107  -9.696 -28.859  -3.153
  312    HB3  ALA 107           HB3      ALA 107 -10.001 -29.014  -4.885
  313    H    TYR 108           H        TYR 108  -7.484 -26.124  -4.280
  314    HA   TYR 108           HA       TYR 108  -7.039 -25.215  -1.611
  315    HB2  TYR 108           HB2      TYR 108  -5.192 -25.711  -2.999
  316    HB3  TYR 108           HB3      TYR 108  -5.732 -24.647  -4.285
  317    HD1  TYR 108           HD1      TYR 108  -4.253 -24.730  -0.872
  318    HD2  TYR 108           HD2      TYR 108  -5.229 -22.290  -4.298
  319    HE1  TYR 108           HE1      TYR 108  -2.840 -22.886   0.035
  320    HE2  TYR 108           HE2      TYR 108  -3.807 -20.460  -3.398
  321    HH   TYR 108           HH       TYR 108  -2.425 -19.766  -1.694
  322    H    HIS 109           H        HIS 109  -7.951 -23.295  -4.563
  323    HA   HIS 109           HA       HIS 109  -8.209 -20.838  -3.120
  324    HB2  HIS 109           HB2      HIS 109  -9.436 -21.752  -5.740
  325    HB3  HIS 109           HB3      HIS 109  -9.722 -20.155  -5.049
  326    HD1  HIS 109           HD1      HIS 109  -7.227 -18.790  -4.408
  327    HD2  HIS 109           HD2      HIS 109  -7.433 -21.759  -7.399
  328    HE1  HIS 109           HE1      HIS 109  -5.173 -18.433  -5.921
  329    HE2  HIS 109           HE2      HIS 109  -5.308 -20.228  -7.759
  330    H    ALA 110           H        ALA 110 -10.691 -23.406  -3.642
  331    HA   ALA 110           HA       ALA 110 -12.819 -21.979  -2.450
  332    HB1  ALA 110           HB1      ALA 110 -12.267 -24.976  -2.450
  333    HB2  ALA 110           HB2      ALA 110 -13.824 -24.201  -2.102
  334    HB3  ALA 110           HB3      ALA 110 -13.112 -24.065  -3.723
  335    H    ALA 111           H        ALA 111 -10.343 -24.124  -0.895
  336    HA   ALA 111           HA       ALA 111 -11.288 -23.856   1.707
  337    HB1  ALA 111           HB1      ALA 111  -9.761 -25.605   0.911
  338    HB2  ALA 111           HB2      ALA 111  -8.467 -24.396   0.707
  339    HB3  ALA 111           HB3      ALA 111  -9.093 -24.773   2.328
  340    H    THR 112           H        THR 112  -8.901 -21.821  -0.060
  341    HA   THR 112           HA       THR 112  -8.347 -20.171   2.284
  342    HB   THR 112           HB       THR 112  -7.103 -18.707   0.784
  343    HG1  THR 112           HG1      THR 112  -6.902 -19.246  -1.374
  344   HG21  THR 112          HG21      THR 112  -6.005 -20.705   1.740
  345   HG22  THR 112          HG22      THR 112  -6.457 -21.646   0.302
  346   HG23  THR 112          HG23      THR 112  -5.347 -20.268   0.159
  347    H    LEU 113           H        LEU 113 -10.641 -19.805  -0.452
  348    HA   LEU 113           HA       LEU 113 -11.275 -17.079   0.312
  349    HB2  LEU 113           HB2      LEU 113 -11.168 -17.798  -2.027
  350    HB3  LEU 113           HB3      LEU 113 -12.415 -19.014  -1.734
  351    HG   LEU 113           HG       LEU 113 -14.065 -17.293  -1.280
  352   HD11  LEU 113          HD11      LEU 113 -13.583 -14.906  -1.876
  353   HD12  LEU 113          HD12      LEU 113 -12.670 -15.434  -0.459
  354   HD13  LEU 113          HD13      LEU 113 -11.862 -15.316  -2.038
  355   HD21  LEU 113          HD21      LEU 113 -13.778 -18.167  -3.559
  356   HD22  LEU 113          HD22      LEU 113 -14.301 -16.477  -3.589
  357   HD23  LEU 113          HD23      LEU 113 -12.596 -16.882  -3.913
  358    H    GLU 114           H        GLU 114 -13.052 -20.197   0.469
  359    HA   GLU 114           HA       GLU 114 -15.372 -18.827   1.647
  360    HB2  GLU 114           HB2      GLU 114 -14.925 -21.715   0.850
  361    HB3  GLU 114           HB3      GLU 114 -16.375 -21.159   1.659
  362    HG2  GLU 114           HG2      GLU 114 -15.348 -20.125  -1.019
  363    HG3  GLU 114           HG3      GLU 114 -16.664 -21.277  -0.799
  364    H    HIS 115           H        HIS 115 -15.867 -18.569   3.641
  365    HA   HIS 115           HA       HIS 115 -14.999 -20.463   5.762
  366    HB2  HIS 115           HB2      HIS 115 -14.674 -17.427   5.952
  367    HB3  HIS 115           HB3      HIS 115 -14.313 -18.590   7.226
  368    HD1  HIS 115           HD1      HIS 115 -12.174 -20.346   6.589
  369    HD2  HIS 115           HD2      HIS 115 -12.791 -16.919   4.194
  370    HE1  HIS 115           HE1      HIS 115 -10.037 -20.045   5.176
  371    HE2  HIS 115           HE2      HIS 115 -10.431 -17.963   3.707
  372    H    HIS 116           H        HIS 116 -16.322 -20.443   7.616
  373    HA   HIS 116           HA       HIS 116 -18.372 -20.677   8.576
  374    HB2  HIS 116           HB2      HIS 116 -19.196 -18.612   9.530
  375    HB3  HIS 116           HB3      HIS 116 -17.448 -18.691   9.559
  376    HD1  HIS 116           HD1      HIS 116 -20.185 -16.978   7.397
  377    HD2  HIS 116           HD2      HIS 116 -16.191 -16.573   8.700
  378    HE1  HIS 116           HE1      HIS 116 -19.372 -14.666   6.557
  379    HE2  HIS 116           HE2      HIS 116 -16.934 -14.437   7.357
  380    H    HIS 117           H        HIS 117 -18.764 -21.386   5.989
  381    HA   HIS 117           HA       HIS 117 -21.660 -20.743   5.606
  382    HB2  HIS 117           HB2      HIS 117 -19.560 -21.062   3.412
  383    HB3  HIS 117           HB3      HIS 117 -21.296 -21.025   3.124
  384    HD1  HIS 117           HD1      HIS 117 -19.000 -18.818   2.113
  385    HD2  HIS 117           HD2      HIS 117 -22.065 -18.488   5.017
  386    HE1  HIS 117           HE1      HIS 117 -19.536 -16.323   2.332
  387    HE2  HIS 117           HE2      HIS 117 -21.421 -16.126   4.081
  388    H    HIS 118           H        HIS 118 -22.936 -22.436   4.747
  389    HA   HIS 118           HA       HIS 118 -21.859 -25.177   5.351
  390    HB2  HIS 118           HB2      HIS 118 -24.587 -24.036   6.058
  391    HB3  HIS 118           HB3      HIS 118 -23.976 -25.632   6.484
  392    HD1  HIS 118           HD1      HIS 118 -21.648 -25.523   8.154
  393    HD2  HIS 118           HD2      HIS 118 -24.207 -22.174   7.853
  394    HE1  HIS 118           HE1      HIS 118 -21.137 -24.036  10.195
  395    HE2  HIS 118           HE2      HIS 118 -22.706 -21.996  10.007
  396    H    HIS 119           H        HIS 119 -22.519 -23.719   2.667
  397    HA   HIS 119           HA       HIS 119 -23.779 -26.084   1.382
  398    HB2  HIS 119           HB2      HIS 119 -25.536 -24.293   1.959
  399    HB3  HIS 119           HB3      HIS 119 -24.752 -23.254   0.783
  400    HD1  HIS 119           HD1      HIS 119 -24.974 -24.134  -1.881
  401    HD2  HIS 119           HD2      HIS 119 -27.125 -26.217   1.123
  402    HE1  HIS 119           HE1      HIS 119 -26.805 -25.489  -3.085
  403    HE2  HIS 119           HE2      HIS 119 -28.089 -26.776  -1.253
  404    H    HIS 120           H        HIS 120 -23.319 -26.274  -0.865
  405    HA   HIS 120           HA       HIS 120 -20.818 -25.084  -1.802
  406    HB2  HIS 120           HB2      HIS 120 -21.139 -26.459  -3.773
  407    HB3  HIS 120           HB3      HIS 120 -21.357 -27.406  -2.316
  408    HD1  HIS 120           HD1      HIS 120 -23.488 -25.819  -5.139
  409    HD2  HIS 120           HD2      HIS 120 -23.610 -28.760  -2.113
  410    HE1  HIS 120           HE1      HIS 120 -25.642 -27.182  -5.538
  411    HE2  HIS 120           HE2      HIS 120 -25.719 -28.962  -3.670
  Start of MODEL   18
    1    H1   SER  66           H1       SER  66   2.465 -19.743  19.866
    2    H2   SER  66           H2       SER  66   1.030 -19.852  20.639
    3    H3   SER  66           H3       SER  66   2.041 -21.134  20.619
    4    HA   SER  66           HA       SER  66   0.215 -21.507  19.141
    5    HB2  SER  66           HB2      SER  66   1.132 -19.013  17.657
    6    HB3  SER  66           HB3      SER  66  -0.173 -20.123  17.187
    7    HG   SER  66           HG       SER  66  -0.959 -18.296  18.351
    8    H    GLY  67           H        GLY  67   3.122 -20.109  17.398
    9    HA2  GLY  67           HA2      GLY  67   4.441 -22.612  17.092
   10    HA3  GLY  67           HA3      GLY  67   3.437 -22.332  15.666
   11    H    SER  68           H        SER  68   6.126 -22.581  15.379
   12    HA   SER  68           HA       SER  68   7.717 -20.262  15.565
   13    HB2  SER  68           HB2      SER  68   7.964 -22.553  13.581
   14    HB3  SER  68           HB3      SER  68   9.238 -21.398  14.014
   15    HG   SER  68           HG       SER  68   9.410 -23.365  15.205
   16    H    GLY  69           H        GLY  69   8.336 -18.636  14.155
   17    HA2  GLY  69           HA2      GLY  69   8.149 -17.072  12.490
   18    HA3  GLY  69           HA3      GLY  69   7.736 -18.405  11.408
   19    H    ARG  70           H        ARG  70   5.699 -17.581  14.158
   20    HA   ARG  70           HA       ARG  70   3.454 -17.284  14.293
   21    HB2  ARG  70           HB2      ARG  70   4.492 -14.964  13.767
   22    HB3  ARG  70           HB3      ARG  70   3.704 -15.115  12.197
   23    HG2  ARG  70           HG2      ARG  70   1.488 -15.391  13.422
   24    HG3  ARG  70           HG3      ARG  70   2.365 -15.221  14.948
   25    HD2  ARG  70           HD2      ARG  70   1.374 -13.102  14.435
   26    HD3  ARG  70           HD3      ARG  70   3.128 -12.955  14.234
   27    HE   ARG  70           HE       ARG  70   1.868 -13.642  11.733
   28   HH11  ARG  70          HH11      ARG  70   2.264 -10.851  13.820
   29   HH12  ARG  70          HH12      ARG  70   2.082  -9.725  12.503
   30   HH21  ARG  70          HH21      ARG  70   1.643 -12.156  10.096
   31   HH22  ARG  70          HH22      ARG  70   1.740 -10.455  10.448
   32    H    GLY  71           H        GLY  71   4.240 -19.340  12.464
   33    HA2  GLY  71           HA2      GLY  71   3.102 -20.927  11.244
   34    HA3  GLY  71           HA3      GLY  71   1.667 -19.901  11.240
   35    H    ARG  72           H        ARG  72   4.371 -18.194   9.940
   36    HA   ARG  72           HA       ARG  72   3.269 -18.170   7.275
   37    HB2  ARG  72           HB2      ARG  72   4.483 -16.247   8.221
   38    HB3  ARG  72           HB3      ARG  72   5.947 -17.225   8.377
   39    HG2  ARG  72           HG2      ARG  72   6.194 -15.750   6.499
   40    HG3  ARG  72           HG3      ARG  72   6.125 -17.399   5.932
   41    HD2  ARG  72           HD2      ARG  72   3.574 -16.912   5.491
   42    HD3  ARG  72           HD3      ARG  72   4.034 -15.214   5.711
   43    HE   ARG  72           HE       ARG  72   5.676 -16.758   3.797
   44   HH11  ARG  72          HH11      ARG  72   2.891 -14.629   4.044
   45   HH12  ARG  72          HH12      ARG  72   2.909 -14.266   2.341
   46   HH21  ARG  72          HH21      ARG  72   5.585 -16.334   1.653
   47   HH22  ARG  72          HH22      ARG  72   4.425 -15.192   1.015
   48    H    GLY  73           H        GLY  73   3.782 -19.291   5.459
   49    HA2  GLY  73           HA2      GLY  73   5.182 -21.789   5.549
   50    HA3  GLY  73           HA3      GLY  73   4.604 -20.963   4.096
   51    H    ALA  74           H        ALA  74   7.048 -22.448   4.391
   52    HA   ALA  74           HA       ALA  74   9.312 -20.604   4.322
   53    HB1  ALA  74           HB1      ALA  74  10.552 -22.671   3.814
   54    HB2  ALA  74           HB2      ALA  74   9.430 -22.951   5.157
   55    HB3  ALA  74           HB3      ALA  74   9.017 -23.523   3.516
   56    H    ILE  75           H        ILE  75   7.401 -19.698   2.618
   57    HA   ILE  75           HA       ILE  75   8.518 -19.966  -0.108
   58    HB   ILE  75           HB       ILE  75   5.787 -20.739   0.894
   59   HG12  ILE  75          HG12      ILE  75   7.614 -21.917  -1.243
   60   HG13  ILE  75          HG13      ILE  75   7.498 -22.451   0.431
   61   HG21  ILE  75          HG21      ILE  75   5.214 -18.989  -0.717
   62   HG22  ILE  75          HG22      ILE  75   6.309 -19.709  -1.921
   63   HG23  ILE  75          HG23      ILE  75   4.825 -20.545  -1.406
   64   HD11  ILE  75          HD11      ILE  75   5.089 -23.041   0.063
   65   HD12  ILE  75          HD12      ILE  75   5.332 -22.697  -1.666
   66   HD13  ILE  75          HD13      ILE  75   6.252 -23.987  -0.888
   67    H    ASP  76           H        ASP  76   8.277 -18.170  -1.367
   68    HA   ASP  76           HA       ASP  76   7.332 -15.648  -0.037
   69    HB2  ASP  76           HB2      ASP  76   9.711 -15.677  -0.525
   70    HB3  ASP  76           HB3      ASP  76   9.408 -16.169  -2.190
   71    H    ARG  77           H        ARG  77   7.461 -17.385  -3.127
   72    HA   ARG  77           HA       ARG  77   4.904 -16.161  -4.112
   73    HB2  ARG  77           HB2      ARG  77   7.695 -15.971  -5.295
   74    HB3  ARG  77           HB3      ARG  77   6.289 -15.937  -6.360
   75    HG2  ARG  77           HG2      ARG  77   5.390 -13.964  -5.328
   76    HG3  ARG  77           HG3      ARG  77   6.605 -13.986  -4.046
   77    HD2  ARG  77           HD2      ARG  77   8.398 -13.546  -5.637
   78    HD3  ARG  77           HD3      ARG  77   7.284 -13.716  -6.995
   79    HE   ARG  77           HE       ARG  77   6.489 -11.583  -6.671
   80   HH11  ARG  77          HH11      ARG  77   8.357 -12.375  -3.768
   81   HH12  ARG  77          HH12      ARG  77   8.308 -10.723  -3.217
   82   HH21  ARG  77          HH21      ARG  77   6.479  -9.521  -5.868
   83   HH22  ARG  77          HH22      ARG  77   7.275  -9.160  -4.366
   84    H    GLU  78           H        GLU  78   6.813 -18.920  -3.788
   85    HA   GLU  78           HA       GLU  78   6.158 -20.346  -6.162
   86    HB2  GLU  78           HB2      GLU  78   7.064 -21.509  -3.500
   87    HB3  GLU  78           HB3      GLU  78   7.200 -22.227  -5.103
   88    HG2  GLU  78           HG2      GLU  78   9.309 -21.468  -4.972
   89    HG3  GLU  78           HG3      GLU  78   8.610 -19.978  -5.584
   90    H    GLN  79           H        GLN  79   3.724 -19.675  -5.900
   91    HA   GLN  79           HA       GLN  79   2.033 -21.080  -4.124
   92    HB2  GLN  79           HB2      GLN  79   1.567 -19.840  -6.859
   93    HB3  GLN  79           HB3      GLN  79   0.260 -20.586  -5.944
   94    HG2  GLN  79           HG2      GLN  79   1.980 -18.292  -4.902
   95    HG3  GLN  79           HG3      GLN  79   0.375 -18.129  -5.618
   96   HE21  GLN  79          HE22      GLN  79  -1.455 -19.375  -4.487
   97   HE22  GLN  79          HE21      GLN  79  -1.320 -19.600  -2.748
   98    H    SER  80           H        SER  80   3.447 -22.298  -7.143
   99    HA   SER  80           HA       SER  80   1.828 -24.658  -7.421
  100    HB2  SER  80           HB2      SER  80   3.859 -25.541  -8.606
  101    HB3  SER  80           HB3      SER  80   3.274 -23.977  -9.204
  102    HG   SER  80           HG       SER  80   5.566 -23.973  -8.916
  103    H    ALA  81           H        ALA  81   4.974 -24.191  -5.716
  104    HA   ALA  81           HA       ALA  81   5.018 -26.707  -4.472
  105    HB1  ALA  81           HB1      ALA  81   6.982 -25.255  -4.760
  106    HB2  ALA  81           HB2      ALA  81   6.309 -24.092  -3.598
  107    HB3  ALA  81           HB3      ALA  81   6.777 -25.716  -3.061
  108    H    ALA  82           H        ALA  82   3.583 -23.615  -3.337
  109    HA   ALA  82           HA       ALA  82   2.817 -24.523  -0.747
  110    HB1  ALA  82           HB1      ALA  82   2.841 -22.142  -1.500
  111    HB2  ALA  82           HB2      ALA  82   1.399 -22.476  -2.495
  112    HB3  ALA  82           HB3      ALA  82   1.317 -22.622  -0.730
  113    H    ILE  83           H        ILE  83   0.976 -24.656  -3.859
  114    HA   ILE  83           HA       ILE  83  -1.308 -25.996  -2.700
  115    HB   ILE  83           HB       ILE  83  -0.403 -25.704  -5.582
  116   HG12  ILE  83          HG12      ILE  83  -2.644 -24.350  -4.013
  117   HG13  ILE  83          HG13      ILE  83  -1.080 -23.609  -4.245
  118   HG21  ILE  83          HG21      ILE  83  -2.717 -26.407  -6.194
  119   HG22  ILE  83          HG22      ILE  83  -1.886 -27.709  -5.362
  120   HG23  ILE  83          HG23      ILE  83  -3.078 -26.725  -4.486
  121   HD11  ILE  83          HD11      ILE  83  -1.451 -23.718  -6.746
  122   HD12  ILE  83          HD12      ILE  83  -3.133 -24.201  -6.393
  123   HD13  ILE  83          HD13      ILE  83  -2.530 -22.635  -5.842
  124    H    ARG  84           H        ARG  84   1.638 -27.247  -4.327
  125    HA   ARG  84           HA       ARG  84   1.020 -30.047  -4.244
  126    HB2  ARG  84           HB2      ARG  84   3.035 -28.814  -5.324
  127    HB3  ARG  84           HB3      ARG  84   3.731 -28.698  -3.729
  128    HG2  ARG  84           HG2      ARG  84   4.825 -30.567  -4.410
  129    HG3  ARG  84           HG3      ARG  84   3.414 -31.360  -3.726
  130    HD2  ARG  84           HD2      ARG  84   3.888 -32.346  -5.854
  131    HD3  ARG  84           HD3      ARG  84   2.397 -31.396  -6.038
  132    HE   ARG  84           HE       ARG  84   4.691 -29.786  -6.734
  133   HH11  ARG  84          HH11      ARG  84   3.102 -32.599  -8.070
  134   HH12  ARG  84          HH12      ARG  84   3.325 -32.018  -9.726
  135   HH21  ARG  84          HH21      ARG  84   5.043 -29.225  -8.905
  136   HH22  ARG  84          HH22      ARG  84   4.441 -30.296 -10.151
  137    H    GLU  85           H        GLU  85   2.716 -28.060  -1.725
  138    HA   GLU  85           HA       GLU  85   2.836 -30.130   0.142
  139    HB2  GLU  85           HB2      GLU  85   4.161 -27.986   0.136
  140    HB3  GLU  85           HB3      GLU  85   2.738 -27.177   0.822
  141    HG2  GLU  85           HG2      GLU  85   2.791 -28.899   2.695
  142    HG3  GLU  85           HG3      GLU  85   4.296 -29.518   2.019
  143    H    TRP  86           H        TRP  86   0.359 -27.489  -0.114
  144    HA   TRP  86           HA       TRP  86  -1.290 -28.270   1.968
  145    HB2  TRP  86           HB2      TRP  86  -1.536 -26.176   0.758
  146    HB3  TRP  86           HB3      TRP  86  -1.961 -27.030  -0.718
  147    HD1  TRP  86           HD1      TRP  86  -3.391 -26.113   2.710
  148    HE1  TRP  86           HE1      TRP  86  -5.946 -26.307   2.661
  149    HE3  TRP  86           HE3      TRP  86  -3.966 -28.099  -1.987
  150    HZ2  TRP  86           HZ2      TRP  86  -7.967 -27.335   0.886
  151    HZ3  TRP  86           HZ3      TRP  86  -6.238 -28.603  -2.854
  152    HH2  TRP  86           HH2      TRP  86  -8.239 -28.259  -1.414
  153    H    ALA  87           H        ALA  87  -1.326 -29.461  -1.414
  154    HA   ALA  87           HA       ALA  87  -3.487 -31.295  -1.132
  155    HB1  ALA  87           HB1      ALA  87  -1.060 -31.259  -3.013
  156    HB2  ALA  87           HB2      ALA  87  -2.486 -32.297  -3.200
  157    HB3  ALA  87           HB3      ALA  87  -2.650 -30.534  -3.294
  158    H    ARG  88           H        ARG  88   0.049 -31.797  -0.633
  159    HA   ARG  88           HA       ARG  88  -0.115 -34.564   0.100
  160    HB2  ARG  88           HB2      ARG  88   1.942 -33.259  -0.571
  161    HB3  ARG  88           HB3      ARG  88   1.936 -32.501   1.025
  162    HG2  ARG  88           HG2      ARG  88   2.147 -34.805   2.057
  163    HG3  ARG  88           HG3      ARG  88   2.185 -35.484   0.422
  164    HD2  ARG  88           HD2      ARG  88   4.444 -35.338   1.173
  165    HD3  ARG  88           HD3      ARG  88   4.218 -34.076  -0.052
  166    HE   ARG  88           HE       ARG  88   3.750 -33.129   2.679
  167   HH11  ARG  88          HH11      ARG  88   6.381 -33.808   0.463
  168   HH12  ARG  88          HH12      ARG  88   7.468 -32.718   1.274
  169   HH21  ARG  88          HH21      ARG  88   5.207 -31.774   3.687
  170   HH22  ARG  88          HH22      ARG  88   6.815 -31.599   3.050
  171    H    ARG  89           H        ARG  89  -0.234 -31.628   2.129
  172    HA   ARG  89           HA       ARG  89  -0.494 -32.909   4.691
  173    HB2  ARG  89           HB2      ARG  89  -1.393 -30.190   3.647
  174    HB3  ARG  89           HB3      ARG  89  -1.582 -30.681   5.328
  175    HG2  ARG  89           HG2      ARG  89   0.826 -30.946   5.607
  176    HG3  ARG  89           HG3      ARG  89   1.115 -30.570   3.904
  177    HD2  ARG  89           HD2      ARG  89   0.114 -28.325   4.215
  178    HD3  ARG  89           HD3      ARG  89  -0.198 -28.672   5.914
  179    HE   ARG  89           HE       ARG  89   2.358 -27.934   4.656
  180   HH11  ARG  89          HH11      ARG  89   1.059 -29.350   7.620
  181   HH12  ARG  89          HH12      ARG  89   2.496 -28.918   8.500
  182   HH21  ARG  89          HH21      ARG  89   4.015 -27.464   5.746
  183   HH22  ARG  89          HH22      ARG  89   4.182 -27.847   7.464
  184    H    ASN  90           H        ASN  90  -2.964 -32.088   2.289
  185    HA   ASN  90           HA       ASN  90  -5.120 -33.096   4.075
  186    HB2  ASN  90           HB2      ASN  90  -5.147 -31.516   1.478
  187    HB3  ASN  90           HB3      ASN  90  -6.599 -32.133   2.271
  188   HD21  ASN  90          HD22      ASN  90  -4.026 -29.738   2.511
  189   HD22  ASN  90          HD21      ASN  90  -4.789 -28.847   3.825
  190    H    GLY  91           H        GLY  91  -3.084 -34.666   2.021
  191    HA2  GLY  91           HA2      GLY  91  -3.138 -36.802   1.197
  192    HA3  GLY  91           HA3      GLY  91  -4.721 -37.026   1.941
  193    H    HIS  92           H        HIS  92  -4.217 -34.470  -0.440
  194    HA   HIS  92           HA       HIS  92  -6.249 -35.672  -2.226
  195    HB2  HIS  92           HB2      HIS  92  -4.729 -33.034  -2.454
  196    HB3  HIS  92           HB3      HIS  92  -6.105 -33.520  -3.435
  197    HD1  HIS  92           HD1      HIS  92  -7.875 -34.583  -0.800
  198    HD2  HIS  92           HD2      HIS  92  -5.992 -30.873  -1.530
  199    HE1  HIS  92           HE1      HIS  92  -9.158 -32.834   0.586
  200    HE2  HIS  92           HE2      HIS  92  -8.011 -30.570   0.130
  201    H    ASN  93           H        ASN  93  -5.938 -35.926  -4.523
  202    HA   ASN  93           HA       ASN  93  -3.512 -37.395  -5.112
  203    HB2  ASN  93           HB2      ASN  93  -5.775 -38.081  -5.855
  204    HB3  ASN  93           HB3      ASN  93  -5.882 -36.642  -6.880
  205   HD21  ASN  93          HD22      ASN  93  -6.317 -38.539  -8.459
  206   HD22  ASN  93          HD21      ASN  93  -4.891 -39.176  -9.260
  207    H    VAL  94           H        VAL  94  -1.664 -36.295  -5.404
  208    HA   VAL  94           HA       VAL  94  -1.455 -34.399  -7.679
  209    HB   VAL  94           HB       VAL  94   0.257 -33.070  -6.383
  210   HG11  VAL  94          HG11      VAL  94  -2.603 -32.859  -5.431
  211   HG12  VAL  94          HG12      VAL  94  -1.373 -31.566  -5.487
  212   HG13  VAL  94          HG13      VAL  94  -1.986 -32.264  -6.983
  213   HG21  VAL  94          HG21      VAL  94   0.588 -34.600  -4.455
  214   HG22  VAL  94          HG22      VAL  94   0.179 -32.952  -3.990
  215   HG23  VAL  94          HG23      VAL  94  -1.057 -34.227  -3.908
  216    H    SER  95           H        SER  95   0.379 -34.590  -8.895
  217    HA   SER  95           HA       SER  95   2.017 -36.971  -8.640
  218    HB2  SER  95           HB2      SER  95   1.554 -35.956 -10.833
  219    HB3  SER  95           HB3      SER  95   2.365 -34.465 -10.332
  220    HG   SER  95           HG       SER  95   3.472 -36.980 -10.968
  221    H    THR  96           H        THR  96   4.301 -37.070  -8.221
  222    HA   THR  96           HA       THR  96   5.338 -35.251  -6.159
  223    HB   THR  96           HB       THR  96   7.377 -36.691  -6.352
  224    HG1  THR  96           HG1      THR  96   7.198 -38.546  -7.668
  225   HG21  THR  96          HG21      THR  96   6.389 -38.715  -5.415
  226   HG22  THR  96          HG22      THR  96   5.533 -37.292  -4.795
  227   HG23  THR  96          HG23      THR  96   4.792 -38.288  -6.066
  228    H    ARG  97           H        ARG  97   5.536 -35.446  -9.640
  229    HA   ARG  97           HA       ARG  97   7.504 -33.191  -9.701
  230    HB2  ARG  97           HB2      ARG  97   8.954 -34.347 -11.271
  231    HB3  ARG  97           HB3      ARG  97   8.826 -35.231  -9.754
  232    HG2  ARG  97           HG2      ARG  97   7.199 -36.808 -10.814
  233    HG3  ARG  97           HG3      ARG  97   7.383 -35.943 -12.351
  234    HD2  ARG  97           HD2      ARG  97   9.828 -36.470 -12.327
  235    HD3  ARG  97           HD3      ARG  97   9.617 -37.320 -10.800
  236    HE   ARG  97           HE       ARG  97   8.569 -39.107 -11.866
  237   HH11  ARG  97          HH11      ARG  97   9.139 -36.625 -14.290
  238   HH12  ARG  97          HH12      ARG  97   8.792 -37.715 -15.605
  239   HH21  ARG  97          HH21      ARG  97   8.145 -40.426 -13.591
  240   HH22  ARG  97          HH22      ARG  97   8.241 -39.806 -15.211
  241    H    GLY  98           H        GLY  98   4.860 -34.800 -11.337
  242    HA2  GLY  98           HA2      GLY  98   5.014 -33.244 -13.803
  243    HA3  GLY  98           HA3      GLY  98   3.702 -34.287 -13.267
  244    H    ARG  99           H        ARG  99   2.559 -32.378 -14.332
  245    HA   ARG  99           HA       ARG  99   2.266 -29.874 -12.882
  246    HB2  ARG  99           HB2      ARG  99   0.489 -31.230 -14.963
  247    HB3  ARG  99           HB3      ARG  99   0.233 -29.596 -14.339
  248    HG2  ARG  99           HG2      ARG  99   2.460 -28.898 -15.179
  249    HG3  ARG  99           HG3      ARG  99   2.720 -30.525 -15.840
  250    HD2  ARG  99           HD2      ARG  99   0.721 -30.269 -17.276
  251    HD3  ARG  99           HD3      ARG  99   0.460 -28.635 -16.627
  252    HE   ARG  99           HE       ARG  99   3.108 -28.735 -17.619
  253   HH11  ARG  99          HH21      ARG  99  -0.118 -28.876 -18.985
  254   HH12  ARG  99          HH22      ARG  99   0.398 -28.218 -20.513
  255   HH21  ARG  99          HH11      ARG  99   3.703 -27.900 -19.586
  256   HH22  ARG  99          HH12      ARG  99   2.518 -27.691 -20.843
  257    H    ILE 100           H        ILE 100   0.420 -29.111 -11.776
  258    HA   ILE 100           HA       ILE 100  -0.844 -31.099  -9.973
  259    HB   ILE 100           HB       ILE 100  -0.805 -28.076  -9.889
  260   HG12  ILE 100          HG12      ILE 100   0.607 -30.267  -8.285
  261   HG13  ILE 100          HG13      ILE 100   1.362 -29.112  -9.389
  262   HG21  ILE 100          HG21      ILE 100  -2.933 -28.985  -8.914
  263   HG22  ILE 100          HG22      ILE 100  -1.967 -30.018  -7.833
  264   HG23  ILE 100          HG23      ILE 100  -1.900 -28.249  -7.713
  265   HD11  ILE 100          HD11      ILE 100   0.144 -28.531  -6.680
  266   HD12  ILE 100          HD12      ILE 100   1.826 -28.363  -7.204
  267   HD13  ILE 100          HD13      ILE 100   0.599 -27.255  -7.844
  268    HA   PRO 101           HA       PRO 101  -4.547 -30.951 -12.543
  269    HB2  PRO 101           HB2      PRO 101  -6.090 -31.793 -10.129
  270    HB3  PRO 101           HB3      PRO 101  -5.983 -32.577 -11.728
  271    HG2  PRO 101           HG2      PRO 101  -4.714 -33.601  -9.532
  272    HG3  PRO 101           HG3      PRO 101  -3.963 -33.661 -11.165
  273    HD2  PRO 101           HD2      PRO 101  -3.427 -31.706  -8.918
  274    HD3  PRO 101           HD3      PRO 101  -2.278 -32.569  -9.987
  275    H    ALA 102           H        ALA 102  -5.976 -29.325 -13.051
  276    HA   ALA 102           HA       ALA 102  -6.128 -26.983 -11.544
  277    HB1  ALA 102           HB1      ALA 102  -6.524 -27.147 -13.960
  278    HB2  ALA 102           HB2      ALA 102  -8.075 -27.977 -13.643
  279    HB3  ALA 102           HB3      ALA 102  -7.830 -26.288 -13.112
  280    H    ASP 103           H        ASP 103  -8.280 -29.808 -11.407
  281    HA   ASP 103           HA       ASP 103 -10.318 -28.763  -9.854
  282    HB2  ASP 103           HB2      ASP 103 -10.304 -30.987 -10.917
  283    HB3  ASP 103           HB3      ASP 103  -9.076 -31.537  -9.774
  284    H    VAL 104           H        VAL 104  -7.078 -29.857  -8.832
  285    HA   VAL 104           HA       VAL 104  -7.640 -29.593  -6.008
  286    HB   VAL 104           HB       VAL 104  -4.980 -29.986  -7.348
  287   HG11  VAL 104          HG11      VAL 104  -5.840 -30.445  -4.466
  288   HG12  VAL 104          HG12      VAL 104  -4.276 -30.926  -5.162
  289   HG13  VAL 104          HG13      VAL 104  -4.691 -29.217  -5.044
  290   HG21  VAL 104          HG21      VAL 104  -5.217 -32.385  -6.770
  291   HG22  VAL 104          HG22      VAL 104  -6.852 -32.075  -6.145
  292   HG23  VAL 104          HG23      VAL 104  -6.494 -31.895  -7.873
  293    H    ILE 105           H        ILE 105  -6.027 -27.645  -8.534
  294    HA   ILE 105           HA       ILE 105  -5.183 -25.487  -6.817
  295    HB   ILE 105           HB       ILE 105  -5.943 -25.670  -9.754
  296   HG12  ILE 105          HG12      ILE 105  -3.174 -25.043  -8.686
  297   HG13  ILE 105          HG13      ILE 105  -3.741 -26.697  -8.512
  298   HG21  ILE 105          HG21      ILE 105  -6.350 -23.359  -9.193
  299   HG22  ILE 105          HG22      ILE 105  -4.833 -23.252  -8.262
  300   HG23  ILE 105          HG23      ILE 105  -4.800 -23.443 -10.029
  301   HD11  ILE 105          HD11      ILE 105  -2.426 -26.344 -10.579
  302   HD12  ILE 105          HD12      ILE 105  -4.065 -26.955 -10.863
  303   HD13  ILE 105          HD13      ILE 105  -3.686 -25.240 -11.175
  304    H    ASP 106           H        ASP 106  -8.292 -25.976  -8.605
  305    HA   ASP 106           HA       ASP 106  -9.621 -23.782  -7.522
  306    HB2  ASP 106           HB2      ASP 106 -10.420 -25.080  -9.441
  307    HB3  ASP 106           HB3      ASP 106 -10.734 -26.465  -8.394
  308    H    ALA 107           H        ALA 107  -9.473 -27.171  -6.239
  309    HA   ALA 107           HA       ALA 107 -10.978 -26.838  -3.966
  310    HB1  ALA 107           HB1      ALA 107 -10.082 -28.996  -4.823
  311    HB2  ALA 107           HB2      ALA 107  -8.455 -28.534  -4.285
  312    HB3  ALA 107           HB3      ALA 107  -9.752 -28.786  -3.101
  313    H    TYR 108           H        TYR 108  -7.472 -26.106  -4.341
  314    HA   TYR 108           HA       TYR 108  -6.982 -25.193  -1.680
  315    HB2  TYR 108           HB2      TYR 108  -5.144 -25.709  -3.097
  316    HB3  TYR 108           HB3      TYR 108  -5.696 -24.630  -4.360
  317    HD1  TYR 108           HD2      TYR 108  -4.196 -24.734  -0.955
  318    HD2  TYR 108           HD1      TYR 108  -5.188 -22.282  -4.367
  319    HE1  TYR 108           HE2      TYR 108  -2.734 -22.920  -0.077
  320    HE2  TYR 108           HE1      TYR 108  -3.738 -20.464  -3.476
  321    HH   TYR 108           HH       TYR 108  -1.908 -20.788  -0.408
  322    H    HIS 109           H        HIS 109  -7.921 -23.305  -4.635
  323    HA   HIS 109           HA       HIS 109  -8.127 -20.822  -3.225
  324    HB2  HIS 109           HB2      HIS 109  -9.371 -21.769  -5.829
  325    HB3  HIS 109           HB3      HIS 109  -9.630 -20.153  -5.180
  326    HD1  HIS 109           HD1      HIS 109  -7.146 -18.794  -4.581
  327    HD2  HIS 109           HD2      HIS 109  -7.327 -21.873  -7.458
  328    HE1  HIS 109           HE1      HIS 109  -5.084 -18.494  -6.089
  329    HE2  HIS 109           HE2      HIS 109  -5.200 -20.367  -7.855
  330    H    ALA 110           H        ALA 110 -10.645 -23.342  -3.712
  331    HA   ALA 110           HA       ALA 110 -12.735 -21.916  -2.465
  332    HB1  ALA 110           HB1      ALA 110 -12.212 -24.920  -2.556
  333    HB2  ALA 110           HB2      ALA 110 -13.763 -24.145  -2.188
  334    HB3  ALA 110           HB3      ALA 110 -13.047 -23.964  -3.800
  335    H    ALA 111           H        ALA 111 -10.201 -24.035  -0.993
  336    HA   ALA 111           HA       ALA 111 -11.119 -23.832   1.635
  337    HB1  ALA 111           HB1      ALA 111  -9.589 -25.560   0.814
  338    HB2  ALA 111           HB2      ALA 111  -8.311 -24.338   0.592
  339    HB3  ALA 111           HB3      ALA 111  -8.904 -24.716   2.220
  340    H    THR 112           H        THR 112  -8.750 -21.762  -0.142
  341    HA   THR 112           HA       THR 112  -8.155 -20.165   2.210
  342    HB   THR 112           HB       THR 112  -6.911 -18.699   0.691
  343    HG1  THR 112           HG1      THR 112  -6.751 -19.242  -1.470
  344   HG21  THR 112          HG21      THR 112  -6.317 -21.650   0.203
  345   HG22  THR 112          HG22      THR 112  -5.187 -20.291   0.040
  346   HG23  THR 112          HG23      THR 112  -5.828 -20.716   1.633
  347    H    LEU 113           H        LEU 113 -10.302 -19.558  -0.634
  348    HA   LEU 113           HA       LEU 113 -11.006 -16.917   0.335
  349    HB2  LEU 113           HB2      LEU 113 -10.763 -17.511  -2.045
  350    HB3  LEU 113           HB3      LEU 113 -12.069 -18.690  -1.899
  351    HG   LEU 113           HG       LEU 113 -13.678 -16.953  -1.458
  352   HD11  LEU 113          HD11      LEU 113 -12.313 -15.196  -0.382
  353   HD12  LEU 113          HD12      LEU 113 -11.375 -14.989  -1.881
  354   HD13  LEU 113          HD13      LEU 113 -13.095 -14.539  -1.820
  355   HD21  LEU 113          HD21      LEU 113 -13.716 -15.954  -3.702
  356   HD22  LEU 113          HD22      LEU 113 -11.994 -16.338  -3.919
  357   HD23  LEU 113          HD23      LEU 113 -13.183 -17.648  -3.782
  358    H    GLU 114           H        GLU 114 -12.383 -20.135   0.619
  359    HA   GLU 114           HA       GLU 114 -14.169 -21.006   1.683
  360    HB2  GLU 114           HB2      GLU 114 -12.486 -20.289   3.367
  361    HB3  GLU 114           HB3      GLU 114 -13.491 -18.888   3.744
  362    HG2  GLU 114           HG2      GLU 114 -15.355 -20.418   4.393
  363    HG3  GLU 114           HG3      GLU 114 -14.376 -21.807   3.935
  364    H    HIS 115           H        HIS 115 -15.600 -20.211  -0.069
  365    HA   HIS 115           HA       HIS 115 -17.251 -17.982  -0.001
  366    HB2  HIS 115           HB2      HIS 115 -17.952 -20.794  -0.963
  367    HB3  HIS 115           HB3      HIS 115 -18.822 -19.335  -1.402
  368    HD1  HIS 115           HD1      HIS 115 -17.254 -17.429  -2.799
  369    HD2  HIS 115           HD2      HIS 115 -16.089 -21.488  -2.663
  370    HE1  HIS 115           HE1      HIS 115 -15.679 -17.801  -4.803
  371    HE2  HIS 115           HE2      HIS 115 -14.970 -20.274  -4.706
  372    H    HIS 116           H        HIS 116 -17.649 -20.779   2.074
  373    HA   HIS 116           HA       HIS 116 -20.375 -20.159   2.922
  374    HB2  HIS 116           HB2      HIS 116 -18.327 -21.985   4.239
  375    HB3  HIS 116           HB3      HIS 116 -20.072 -22.005   4.482
  376    HD1  HIS 116           HD1      HIS 116 -17.800 -24.173   2.932
  377    HD2  HIS 116           HD2      HIS 116 -21.264 -22.145   1.610
  378    HE1  HIS 116           HE1      HIS 116 -18.660 -25.467   0.877
  379    HE2  HIS 116           HE2      HIS 116 -20.770 -24.219   0.076
  380    H    HIS 117           H        HIS 117 -17.534 -18.519   3.694
  381    HA   HIS 117           HA       HIS 117 -17.952 -18.110   6.536
  382    HB2  HIS 117           HB2      HIS 117 -15.772 -18.097   5.182
  383    HB3  HIS 117           HB3      HIS 117 -16.167 -16.460   4.705
  384    HD1  HIS 117           HD1      HIS 117 -14.471 -18.401   7.321
  385    HD2  HIS 117           HD2      HIS 117 -16.467 -14.689   7.006
  386    HE1  HIS 117           HE1      HIS 117 -13.749 -16.993   9.378
  387    HE2  HIS 117           HE2      HIS 117 -15.017 -14.741   9.195
  388    H    HIS 118           H        HIS 118 -20.330 -17.551   6.105
  389    HA   HIS 118           HA       HIS 118 -20.924 -14.798   5.267
  390    HB2  HIS 118           HB2      HIS 118 -22.727 -16.840   6.616
  391    HB3  HIS 118           HB3      HIS 118 -23.237 -15.387   5.765
  392    HD1  HIS 118           HD1      HIS 118 -21.888 -15.562   3.002
  393    HD2  HIS 118           HD2      HIS 118 -23.388 -18.868   5.156
  394    HE1  HIS 118           HE1      HIS 118 -22.347 -17.405   1.266
  395    HE2  HIS 118           HE2      HIS 118 -23.301 -19.409   2.584
  396    H    HIS 119           H        HIS 119 -20.334 -16.354   8.348
  397    HA   HIS 119           HA       HIS 119 -21.120 -14.048  10.004
  398    HB2  HIS 119           HB2      HIS 119 -20.161 -15.392  11.845
  399    HB3  HIS 119           HB3      HIS 119 -21.324 -16.296  10.903
  400    HD1  HIS 119           HD1      HIS 119 -17.453 -16.072  11.362
  401    HD2  HIS 119           HD2      HIS 119 -20.540 -18.609   9.931
  402    HE1  HIS 119           HE1      HIS 119 -16.362 -18.343  10.832
  403    HE2  HIS 119           HE2      HIS 119 -18.240 -19.877   9.965
  404    H    HIS 120           H        HIS 120 -19.394 -13.175  11.566
  405    HA   HIS 120           HA       HIS 120 -17.177 -11.922  10.225
  406    HB2  HIS 120           HB2      HIS 120 -18.281 -11.053  12.284
  407    HB3  HIS 120           HB3      HIS 120 -17.641 -12.418  13.197
  408    HD1  HIS 120           HD1      HIS 120 -16.438  -9.188  11.466
  409    HD2  HIS 120           HD2      HIS 120 -15.086 -12.309  13.969
  410    HE1  HIS 120           HE1      HIS 120 -14.120  -8.467  12.334
  411    HE2  HIS 120           HE2      HIS 120 -13.305 -10.372  13.870
  Start of MODEL   19
    1    H1   SER  66           H1       SER  66  15.757  -7.603   9.617
    2    H2   SER  66           H2       SER  66  16.689  -6.325   9.194
    3    H3   SER  66           H3       SER  66  15.945  -7.214   8.032
    4    HA   SER  66           HA       SER  66  18.268  -7.751   8.074
    5    HB2  SER  66           HB2      SER  66  17.817  -8.535  10.981
    6    HB3  SER  66           HB3      SER  66  19.323  -8.696  10.058
    7    HG   SER  66           HG       SER  66  19.291  -6.764  11.302
    8    H    GLY  67           H        GLY  67  19.041  -9.871   7.562
    9    HA2  GLY  67           HA2      GLY  67  18.903 -12.105   7.057
   10    HA3  GLY  67           HA3      GLY  67  17.596 -12.284   8.231
   11    H    SER  68           H        SER  68  17.117  -9.960   5.671
   12    HA   SER  68           HA       SER  68  14.643 -11.044   4.950
   13    HB2  SER  68           HB2      SER  68  16.308  -9.096   3.319
   14    HB3  SER  68           HB3      SER  68  14.542  -9.270   3.312
   15    HG   SER  68           HG       SER  68  15.200  -7.524   4.643
   16    H    GLY  69           H        GLY  69  17.741 -11.885   3.584
   17    HA2  GLY  69           HA2      GLY  69  16.831 -12.901   1.031
   18    HA3  GLY  69           HA3      GLY  69  18.370 -13.226   1.820
   19    H    ARG  70           H        ARG  70  16.380 -14.191   4.190
   20    HA   ARG  70           HA       ARG  70  16.474 -17.036   3.526
   21    HB2  ARG  70           HB2      ARG  70  15.190 -15.519   5.842
   22    HB3  ARG  70           HB3      ARG  70  15.243 -17.275   5.705
   23    HG2  ARG  70           HG2      ARG  70  17.724 -17.241   5.712
   24    HG3  ARG  70           HG3      ARG  70  17.708 -15.479   5.799
   25    HD2  ARG  70           HD2      ARG  70  18.105 -16.291   8.005
   26    HD3  ARG  70           HD3      ARG  70  16.471 -15.604   7.958
   27    HE   ARG  70           HE       ARG  70  16.476 -18.467   7.432
   28   HH11  ARG  70          HH11      ARG  70  16.707 -16.237  10.127
   29   HH12  ARG  70          HH12      ARG  70  16.053 -17.393  11.256
   30   HH21  ARG  70          HH21      ARG  70  15.630 -19.884   8.917
   31   HH22  ARG  70          HH22      ARG  70  15.495 -19.418  10.587
   32    H    GLY  71           H        GLY  71  14.698 -18.474   3.445
   33    HA2  GLY  71           HA2      GLY  71  12.686 -17.770   1.555
   34    HA3  GLY  71           HA3      GLY  71  12.748 -19.267   2.484
   35    H    ARG  72           H        ARG  72  10.715 -16.965   1.744
   36    HA   ARG  72           HA       ARG  72   9.211 -16.934   4.333
   37    HB2  ARG  72           HB2      ARG  72   9.898 -14.571   2.531
   38    HB3  ARG  72           HB3      ARG  72   8.606 -14.512   3.735
   39    HG2  ARG  72           HG2      ARG  72  10.151 -14.894   5.560
   40    HG3  ARG  72           HG3      ARG  72  11.502 -15.140   4.453
   41    HD2  ARG  72           HD2      ARG  72   9.950 -12.538   4.707
   42    HD3  ARG  72           HD3      ARG  72  11.461 -12.896   5.535
   43    HE   ARG  72           HE       ARG  72  12.625 -13.046   3.407
   44   HH11  ARG  72          HH21      ARG  72   9.451 -11.576   3.069
   45   HH12  ARG  72          HH22      ARG  72   9.889 -10.782   1.587
   46   HH21  ARG  72          HH11      ARG  72  13.155 -11.893   1.655
   47   HH22  ARG  72          HH12      ARG  72  11.938 -11.009   0.762
   48    H    GLY  73           H        GLY  73   6.962 -16.593   4.134
   49    HA2  GLY  73           HA2      GLY  73   5.784 -17.965   1.827
   50    HA3  GLY  73           HA3      GLY  73   4.979 -17.508   3.330
   51    H    ALA  74           H        ALA  74   6.532 -14.799   1.912
   52    HA   ALA  74           HA       ALA  74   4.033 -13.639   0.909
   53    HB1  ALA  74           HB1      ALA  74   6.894 -12.587   0.937
   54    HB2  ALA  74           HB2      ALA  74   5.438 -11.652   0.530
   55    HB3  ALA  74           HB3      ALA  74   5.654 -12.280   2.175
   56    H    ILE  75           H        ILE  75   3.808 -15.545  -0.486
   57    HA   ILE  75           HA       ILE  75   5.213 -15.316  -3.102
   58    HB   ILE  75           HB       ILE  75   4.233 -17.745  -1.560
   59   HG12  ILE  75          HG12      ILE  75   6.338 -16.893  -0.659
   60   HG13  ILE  75          HG13      ILE  75   6.537 -18.459  -1.407
   61   HG21  ILE  75          HG21      ILE  75   5.331 -19.100  -3.367
   62   HG22  ILE  75          HG22      ILE  75   3.851 -18.278  -3.853
   63   HG23  ILE  75          HG23      ILE  75   5.424 -17.613  -4.346
   64   HD11  ILE  75          HD11      ILE  75   8.435 -17.003  -1.904
   65   HD12  ILE  75          HD12      ILE  75   7.586 -17.422  -3.398
   66   HD13  ILE  75          HD13      ILE  75   7.371 -15.810  -2.669
   67    H    ASP  76           H        ASP  76   4.045 -15.370  -4.954
   68    HA   ASP  76           HA       ASP  76   1.090 -15.750  -4.810
   69    HB2  ASP  76           HB2      ASP  76   0.645 -13.789  -6.004
   70    HB3  ASP  76           HB3      ASP  76   1.628 -13.359  -4.613
   71    H    ARG  77           H        ARG  77   3.686 -15.219  -7.250
   72    HA   ARG  77           HA       ARG  77   2.352 -16.765  -9.300
   73    HB2  ARG  77           HB2      ARG  77   3.939 -14.870  -9.645
   74    HB3  ARG  77           HB3      ARG  77   5.263 -15.881  -9.048
   75    HG2  ARG  77           HG2      ARG  77   4.961 -17.436 -10.943
   76    HG3  ARG  77           HG3      ARG  77   3.545 -16.511 -11.500
   77    HD2  ARG  77           HD2      ARG  77   4.986 -14.534 -11.856
   78    HD3  ARG  77           HD3      ARG  77   6.396 -15.459 -11.288
   79    HE   ARG  77           HE       ARG  77   5.150 -16.895 -13.418
   80   HH11  ARG  77          HH11      ARG  77   7.012 -13.950 -13.029
   81   HH12  ARG  77          HH12      ARG  77   7.638 -14.014 -14.652
   82   HH21  ARG  77          HH21      ARG  77   5.972 -16.914 -15.488
   83   HH22  ARG  77          HH22      ARG  77   7.052 -15.652 -16.010
   84    H    GLU  78           H        GLU  78   4.724 -17.595  -6.875
   85    HA   GLU  78           HA       GLU  78   5.197 -20.290  -8.019
   86    HB2  GLU  78           HB2      GLU  78   6.650 -18.706  -5.879
   87    HB3  GLU  78           HB3      GLU  78   7.099 -20.337  -6.399
   88    HG2  GLU  78           HG2      GLU  78   7.368 -19.497  -8.736
   89    HG3  GLU  78           HG3      GLU  78   7.040 -17.859  -8.163
   90    H    GLN  79           H        GLN  79   2.654 -19.563  -6.538
   91    HA   GLN  79           HA       GLN  79   2.617 -20.998  -4.030
   92    HB2  GLN  79           HB2      GLN  79   0.430 -20.103  -5.946
   93    HB3  GLN  79           HB3      GLN  79   0.092 -20.970  -4.442
   94    HG2  GLN  79           HG2      GLN  79   1.246 -19.222  -3.132
   95    HG3  GLN  79           HG3      GLN  79   1.554 -18.313  -4.613
   96   HE21  GLN  79          HE22      GLN  79  -0.364 -17.500  -5.843
   97   HE22  GLN  79          HE21      GLN  79  -1.865 -17.216  -4.955
   98    H    SER  80           H        SER  80   2.925 -22.377  -7.158
   99    HA   SER  80           HA       SER  80   1.444 -24.731  -7.051
  100    HB2  SER  80           HB2      SER  80   4.349 -24.454  -7.925
  101    HB3  SER  80           HB3      SER  80   3.214 -25.731  -8.413
  102    HG   SER  80           HG       SER  80   3.339 -24.039  -9.981
  103    H    ALA  81           H        ALA  81   4.593 -24.155  -5.336
  104    HA   ALA  81           HA       ALA  81   4.715 -26.731  -4.184
  105    HB1  ALA  81           HB1      ALA  81   6.644 -25.208  -4.393
  106    HB2  ALA  81           HB2      ALA  81   5.897 -24.082  -3.239
  107    HB3  ALA  81           HB3      ALA  81   6.411 -25.694  -2.704
  108    H    ALA  82           H        ALA  82   3.190 -23.717  -3.001
  109    HA   ALA  82           HA       ALA  82   2.391 -24.738  -0.428
  110    HB1  ALA  82           HB1      ALA  82   1.250 -22.465  -2.115
  111    HB2  ALA  82           HB2      ALA  82   0.923 -22.759  -0.394
  112    HB3  ALA  82           HB3      ALA  82   2.561 -22.333  -0.927
  113    H    ILE  83           H        ILE  83   0.764 -24.660  -3.614
  114    HA   ILE  83           HA       ILE  83  -1.704 -25.884  -2.813
  115    HB   ILE  83           HB       ILE  83  -0.250 -25.783  -5.488
  116   HG12  ILE  83          HG12      ILE  83  -2.730 -24.256  -4.661
  117   HG13  ILE  83          HG13      ILE  83  -1.141 -23.609  -4.294
  118   HG21  ILE  83          HG21      ILE  83  -2.468 -26.350  -6.517
  119   HG22  ILE  83          HG22      ILE  83  -1.830 -27.675  -5.551
  120   HG23  ILE  83          HG23      ILE  83  -3.120 -26.649  -4.895
  121   HD11  ILE  83          HD11      ILE  83  -0.601 -23.659  -6.748
  122   HD12  ILE  83          HD12      ILE  83  -2.285 -24.148  -7.043
  123   HD13  ILE  83          HD13      ILE  83  -1.944 -22.583  -6.303
  124    H    ARG  84           H        ARG  84   1.337 -27.321  -4.094
  125    HA   ARG  84           HA       ARG  84   0.459 -30.050  -3.984
  126    HB2  ARG  84           HB2      ARG  84   2.461 -29.034  -5.220
  127    HB3  ARG  84           HB3      ARG  84   3.319 -29.010  -3.681
  128    HG2  ARG  84           HG2      ARG  84   2.933 -31.535  -3.548
  129    HG3  ARG  84           HG3      ARG  84   2.251 -31.451  -5.180
  130    HD2  ARG  84           HD2      ARG  84   5.087 -30.723  -4.333
  131    HD3  ARG  84           HD3      ARG  84   4.608 -32.151  -5.227
  132    HE   ARG  84           HE       ARG  84   3.971 -30.734  -7.141
  133   HH11  ARG  84          HH11      ARG  84   6.127 -29.197  -4.828
  134   HH12  ARG  84          HH12      ARG  84   6.670 -28.025  -5.989
  135   HH21  ARG  84          HH21      ARG  84   4.787 -29.307  -8.572
  136   HH22  ARG  84          HH22      ARG  84   5.873 -28.034  -8.051
  137    H    GLU  85           H        GLU  85   2.323 -28.161  -1.535
  138    HA   GLU  85           HA       GLU  85   2.383 -30.211   0.365
  139    HB2  GLU  85           HB2      GLU  85   3.732 -28.077   0.365
  140    HB3  GLU  85           HB3      GLU  85   2.307 -27.243   1.011
  141    HG2  GLU  85           HG2      GLU  85   2.302 -28.940   2.906
  142    HG3  GLU  85           HG3      GLU  85   3.802 -29.596   2.265
  143    H    TRP  86           H        TRP  86  -0.062 -27.542   0.013
  144    HA   TRP  86           HA       TRP  86  -1.788 -28.262   2.047
  145    HB2  TRP  86           HB2      TRP  86  -2.055 -26.223   0.786
  146    HB3  TRP  86           HB3      TRP  86  -2.351 -27.116  -0.702
  147    HD1  TRP  86           HD1      TRP  86  -4.054 -25.944   2.466
  148    HE1  TRP  86           HE1      TRP  86  -6.563 -26.476   2.403
  149    HE3  TRP  86           HE3      TRP  86  -4.205 -28.643  -1.892
  150    HZ2  TRP  86           HZ2      TRP  86  -8.338 -28.150   0.849
  151    HZ3  TRP  86           HZ3      TRP  86  -6.293 -29.785  -2.582
  152    HH2  TRP  86           HH2      TRP  86  -8.351 -29.591  -1.183
  153    H    ALA  87           H        ALA  87  -1.731 -29.559  -1.317
  154    HA   ALA  87           HA       ALA  87  -3.942 -31.311  -0.980
  155    HB1  ALA  87           HB1      ALA  87  -2.999 -30.591  -3.146
  156    HB2  ALA  87           HB2      ALA  87  -1.520 -31.523  -2.843
  157    HB3  ALA  87           HB3      ALA  87  -3.078 -32.365  -3.048
  158    H    ARG  88           H        ARG  88  -0.432 -31.919  -0.476
  159    HA   ARG  88           HA       ARG  88  -0.695 -34.664   0.324
  160    HB2  ARG  88           HB2      ARG  88   1.405 -33.520  -0.404
  161    HB3  ARG  88           HB3      ARG  88   1.431 -32.614   1.115
  162    HG2  ARG  88           HG2      ARG  88   1.630 -34.743   2.384
  163    HG3  ARG  88           HG3      ARG  88   1.549 -35.657   0.861
  164    HD2  ARG  88           HD2      ARG  88   3.625 -34.554   0.093
  165    HD3  ARG  88           HD3      ARG  88   3.697 -33.631   1.615
  166    HE   ARG  88           HE       ARG  88   3.518 -36.407   2.242
  167   HH11  ARG  88          HH11      ARG  88   5.904 -34.215   0.895
  168   HH12  ARG  88          HH12      ARG  88   7.238 -35.181   1.459
  169   HH21  ARG  88          HH21      ARG  88   5.269 -37.589   2.926
  170   HH22  ARG  88          HH22      ARG  88   6.881 -37.037   2.582
  171    H    ARG  89           H        ARG  89  -0.773 -31.672   2.284
  172    HA   ARG  89           HA       ARG  89  -1.118 -32.919   4.861
  173    HB2  ARG  89           HB2      ARG  89  -1.903 -30.185   3.771
  174    HB3  ARG  89           HB3      ARG  89  -2.161 -30.656   5.448
  175    HG2  ARG  89           HG2      ARG  89   0.228 -31.005   5.801
  176    HG3  ARG  89           HG3      ARG  89   0.576 -30.642   4.109
  177    HD2  ARG  89           HD2      ARG  89  -0.367 -28.363   4.392
  178    HD3  ARG  89           HD3      ARG  89  -0.716 -28.702   6.087
  179    HE   ARG  89           HE       ARG  89   1.883 -28.046   4.872
  180   HH11  ARG  89          HH11      ARG  89   0.498 -29.445   7.802
  181   HH12  ARG  89          HH12      ARG  89   1.937 -29.075   8.711
  182   HH21  ARG  89          HH21      ARG  89   3.534 -27.622   5.995
  183   HH22  ARG  89          HH22      ARG  89   3.670 -28.038   7.706
  184    H    ASN  90           H        ASN  90  -3.501 -32.059   2.383
  185    HA   ASN  90           HA       ASN  90  -5.751 -32.955   4.090
  186    HB2  ASN  90           HB2      ASN  90  -5.570 -31.689   1.329
  187    HB3  ASN  90           HB3      ASN  90  -7.076 -32.293   1.999
  188   HD21  ASN  90          HD22      ASN  90  -4.574 -29.840   2.390
  189   HD22  ASN  90          HD21      ASN  90  -5.511 -28.842   3.500
  190    H    GLY  91           H        GLY  91  -3.581 -34.639   2.126
  191    HA2  GLY  91           HA2      GLY  91  -3.569 -36.800   1.336
  192    HA3  GLY  91           HA3      GLY  91  -5.129 -37.085   2.122
  193    H    HIS  92           H        HIS  92  -4.769 -34.469  -0.211
  194    HA   HIS  92           HA       HIS  92  -6.853 -35.691  -1.908
  195    HB2  HIS  92           HB2      HIS  92  -6.890 -33.279  -1.099
  196    HB3  HIS  92           HB3      HIS  92  -5.551 -32.950  -2.196
  197    HD1  HIS  92           HD1      HIS  92  -9.301 -33.830  -2.227
  198    HD2  HIS  92           HD2      HIS  92  -6.161 -32.738  -4.833
  199    HE1  HIS  92           HE1      HIS  92 -10.394 -33.267  -4.494
  200    HE2  HIS  92           HE2      HIS  92  -8.490 -32.607  -6.086
  201    H    ASN  93           H        ASN  93  -6.664 -36.024  -4.166
  202    HA   ASN  93           HA       ASN  93  -4.225 -37.230  -5.034
  203    HB2  ASN  93           HB2      ASN  93  -6.537 -37.818  -5.803
  204    HB3  ASN  93           HB3      ASN  93  -6.620 -36.280  -6.673
  205   HD21  ASN  93          HD22      ASN  93  -7.102 -37.923  -8.461
  206   HD22  ASN  93          HD21      ASN  93  -5.707 -38.546  -9.324
  207    H    VAL  94           H        VAL  94  -2.471 -36.460  -6.143
  208    HA   VAL  94           HA       VAL  94  -2.485 -33.870  -7.494
  209    HB   VAL  94           HB       VAL  94  -2.196 -33.306  -5.083
  210   HG11  VAL  94          HG11      VAL  94   0.526 -34.659  -5.282
  211   HG12  VAL  94          HG12      VAL  94  -0.098 -33.698  -3.929
  212   HG13  VAL  94          HG13      VAL  94  -0.857 -35.241  -4.337
  213   HG21  VAL  94          HG21      VAL  94  -1.353 -31.820  -6.885
  214   HG22  VAL  94          HG22      VAL  94  -0.484 -31.686  -5.355
  215   HG23  VAL  94          HG23      VAL  94   0.265 -32.552  -6.699
  216    H    SER  95           H        SER  95  -0.486 -33.439  -8.700
  217    HA   SER  95           HA       SER  95   0.276 -35.780 -10.137
  218    HB2  SER  95           HB2      SER  95   1.629 -34.140 -11.444
  219    HB3  SER  95           HB3      SER  95  -0.026 -33.570 -11.160
  220    HG   SER  95           HG       SER  95   1.668 -31.997 -10.689
  221    H    THR  96           H        THR  96   1.822 -34.245  -7.458
  222    HA   THR  96           HA       THR  96   3.866 -34.169  -6.536
  223    HB   THR  96           HB       THR  96   5.143 -36.166  -6.180
  224    HG1  THR  96           HG1      THR  96   4.538 -38.118  -7.123
  225   HG21  THR  96          HG21      THR  96   2.163 -36.768  -6.082
  226   HG22  THR  96          HG22      THR  96   3.439 -37.515  -5.095
  227   HG23  THR  96          HG23      THR  96   3.059 -35.801  -4.889
  228    H    ARG  97           H        ARG  97   3.652 -33.209  -9.254
  229    HA   ARG  97           HA       ARG  97   6.543 -33.098 -10.046
  230    HB2  ARG  97           HB2      ARG  97   4.109 -33.924 -11.653
  231    HB3  ARG  97           HB3      ARG  97   5.422 -33.101 -12.489
  232    HG2  ARG  97           HG2      ARG  97   7.022 -34.751 -11.980
  233    HG3  ARG  97           HG3      ARG  97   6.020 -35.504 -10.735
  234    HD2  ARG  97           HD2      ARG  97   5.203 -35.443 -13.665
  235    HD3  ARG  97           HD3      ARG  97   6.187 -36.738 -12.951
  236    HE   ARG  97           HE       ARG  97   3.923 -36.383 -11.281
  237   HH11  ARG  97          HH11      ARG  97   4.511 -37.626 -14.511
  238   HH12  ARG  97          HH12      ARG  97   3.176 -38.741 -14.408
  239   HH21  ARG  97          HH21      ARG  97   2.310 -37.782 -11.198
  240   HH22  ARG  97          HH22      ARG  97   1.923 -38.822 -12.553
  241    H    GLY  98           H        GLY  98   6.746 -31.376 -11.867
  242    HA2  GLY  98           HA2      GLY  98   6.524 -28.850 -10.653
  243    HA3  GLY  98           HA3      GLY  98   6.857 -29.140 -12.363
  244    H    ARG  99           H        ARG  99   4.535 -30.185 -13.303
  245    HA   ARG  99           HA       ARG  99   2.584 -27.947 -13.201
  246    HB2  ARG  99           HB2      ARG  99   2.673 -30.490 -14.884
  247    HB3  ARG  99           HB3      ARG  99   1.414 -29.250 -14.994
  248    HG2  ARG  99           HG2      ARG  99   3.130 -27.551 -15.584
  249    HG3  ARG  99           HG3      ARG  99   4.388 -28.803 -15.531
  250    HD2  ARG  99           HD2      ARG  99   3.196 -30.052 -17.322
  251    HD3  ARG  99           HD3      ARG  99   1.962 -28.775 -17.382
  252    HE   ARG  99           HE       ARG  99   4.531 -27.585 -17.730
  253   HH11  ARG  99          HH11      ARG  99   2.355 -29.636 -19.561
  254   HH12  ARG  99          HH12      ARG  99   2.971 -29.085 -21.094
  255   HH21  ARG  99          HH21      ARG  99   5.265 -26.914 -19.718
  256   HH22  ARG  99          HH22      ARG  99   4.576 -27.574 -21.173
  257    H    ILE 100           H        ILE 100   0.494 -28.093 -12.478
  258    HA   ILE 100           HA       ILE 100  -0.234 -30.428 -10.763
  259    HB   ILE 100           HB       ILE 100  -0.375 -27.482 -10.092
  260   HG12  ILE 100          HG12      ILE 100   1.127 -29.867  -8.902
  261   HG13  ILE 100          HG13      ILE 100   1.822 -28.479  -9.747
  262   HG21  ILE 100          HG21      ILE 100  -1.459 -28.078  -7.988
  263   HG22  ILE 100          HG22      ILE 100  -2.472 -28.614  -9.307
  264   HG23  ILE 100          HG23      ILE 100  -1.466 -29.798  -8.425
  265   HD11  ILE 100          HD11      ILE 100   0.951 -27.011  -7.878
  266   HD12  ILE 100          HD12      ILE 100   0.573 -28.509  -6.989
  267   HD13  ILE 100          HD13      ILE 100   2.246 -28.149  -7.451
  268    HA   PRO 101           HA       PRO 101  -4.014 -30.190 -13.145
  269    HB2  PRO 101           HB2      PRO 101  -5.484 -31.484 -10.900
  270    HB3  PRO 101           HB3      PRO 101  -5.244 -32.051 -12.574
  271    HG2  PRO 101           HG2      PRO 101  -3.945 -33.171 -10.418
  272    HG3  PRO 101           HG3      PRO 101  -3.200 -33.058 -12.047
  273    HD2  PRO 101           HD2      PRO 101  -2.756 -31.294  -9.644
  274    HD3  PRO 101           HD3      PRO 101  -1.582 -31.945 -10.821
  275    H    ALA 102           H        ALA 102  -5.732 -28.805 -13.380
  276    HA   ALA 102           HA       ALA 102  -6.011 -26.583 -11.726
  277    HB1  ALA 102           HB1      ALA 102  -7.923 -26.028 -13.084
  278    HB2  ALA 102           HB2      ALA 102  -6.618 -26.680 -14.099
  279    HB3  ALA 102           HB3      ALA 102  -8.020 -27.707 -13.690
  280    H    ASP 103           H        ASP 103  -7.757 -29.666 -11.523
  281    HA   ASP 103           HA       ASP 103  -9.795 -29.055  -9.777
  282    HB2  ASP 103           HB2      ASP 103  -9.495 -31.263 -10.752
  283    HB3  ASP 103           HB3      ASP 103  -7.959 -31.480  -9.906
  284    H    VAL 104           H        VAL 104  -6.348 -29.627  -9.022
  285    HA   VAL 104           HA       VAL 104  -6.739 -29.451  -6.177
  286    HB   VAL 104           HB       VAL 104  -4.063 -29.250  -7.487
  287   HG11  VAL 104          HG11      VAL 104  -4.150 -28.999  -5.042
  288   HG12  VAL 104          HG12      VAL 104  -4.995 -30.554  -4.904
  289   HG13  VAL 104          HG13      VAL 104  -3.318 -30.488  -5.507
  290   HG21  VAL 104          HG21      VAL 104  -5.657 -31.815  -7.103
  291   HG22  VAL 104          HG22      VAL 104  -5.012 -31.173  -8.634
  292   HG23  VAL 104          HG23      VAL 104  -3.905 -31.760  -7.406
  293    H    ILE 105           H        ILE 105  -5.538 -27.289  -8.729
  294    HA   ILE 105           HA       ILE 105  -4.767 -25.081  -7.054
  295    HB   ILE 105           HB       ILE 105  -5.761 -25.273  -9.927
  296   HG12  ILE 105          HG12      ILE 105  -2.957 -24.474  -9.131
  297   HG13  ILE 105          HG13      ILE 105  -3.373 -26.167  -8.918
  298   HG21  ILE 105          HG21      ILE 105  -6.251 -23.004  -9.186
  299   HG22  ILE 105          HG22      ILE 105  -4.639 -22.851  -8.444
  300   HG23  ILE 105          HG23      ILE 105  -4.818 -22.965 -10.212
  301   HD11  ILE 105          HD11      ILE 105  -3.711 -24.683 -11.546
  302   HD12  ILE 105          HD12      ILE 105  -2.311 -25.686 -11.099
  303   HD13  ILE 105          HD13      ILE 105  -3.916 -26.423 -11.229
  304    H    ASP 106           H        ASP 106  -7.943 -25.848  -8.615
  305    HA   ASP 106           HA       ASP 106  -9.386 -23.780  -7.428
  306    HB2  ASP 106           HB2      ASP 106 -10.138 -25.092  -9.356
  307    HB3  ASP 106           HB3      ASP 106 -10.301 -26.523  -8.338
  308    H    ALA 107           H        ALA 107  -8.904 -27.174  -6.267
  309    HA   ALA 107           HA       ALA 107 -10.388 -27.057  -3.965
  310    HB1  ALA 107           HB1      ALA 107  -9.357 -29.092  -4.946
  311    HB2  ALA 107           HB2      ALA 107  -7.746 -28.527  -4.447
  312    HB3  ALA 107           HB3      ALA 107  -8.972 -28.942  -3.233
  313    H    TYR 108           H        TYR 108  -6.946 -26.121  -4.340
  314    HA   TYR 108           HA       TYR 108  -6.513 -25.223  -1.654
  315    HB2  TYR 108           HB2      TYR 108  -4.676 -25.711  -3.112
  316    HB3  TYR 108           HB3      TYR 108  -5.228 -24.562  -4.319
  317    HD1  TYR 108           HD2      TYR 108  -3.765 -24.851  -0.894
  318    HD2  TYR 108           HD1      TYR 108  -4.615 -22.257  -4.235
  319    HE1  TYR 108           HE2      TYR 108  -2.239 -23.130   0.056
  320    HE2  TYR 108           HE1      TYR 108  -3.107 -20.526  -3.276
  321    HH   TYR 108           HH       TYR 108  -1.674 -19.983  -1.582
  322    H    HIS 109           H        HIS 109  -7.522 -23.361  -4.623
  323    HA   HIS 109           HA       HIS 109  -7.842 -20.860  -3.274
  324    HB2  HIS 109           HB2      HIS 109  -9.352 -21.978  -5.676
  325    HB3  HIS 109           HB3      HIS 109  -9.435 -20.310  -5.129
  326    HD1  HIS 109           HD1      HIS 109  -8.399 -20.944  -8.031
  327    HD2  HIS 109           HD2      HIS 109  -6.041 -20.280  -4.592
  328    HE1  HIS 109           HE1      HIS 109  -6.109 -20.121  -8.865
  329    HE2  HIS 109           HE2      HIS 109  -4.677 -19.724  -6.762
  330    H    ALA 110           H        ALA 110 -10.234 -23.544  -3.580
  331    HA   ALA 110           HA       ALA 110 -12.329 -22.181  -2.249
  332    HB1  ALA 110           HB1      ALA 110 -11.713 -25.168  -2.317
  333    HB2  ALA 110           HB2      ALA 110 -13.266 -24.426  -1.898
  334    HB3  ALA 110           HB3      ALA 110 -12.621 -24.260  -3.546
  335    H    ALA 111           H        ALA 111  -9.686 -24.255  -0.868
  336    HA   ALA 111           HA       ALA 111 -10.501 -24.068   1.784
  337    HB1  ALA 111           HB1      ALA 111  -8.887 -25.701   0.882
  338    HB2  ALA 111           HB2      ALA 111  -7.700 -24.396   0.654
  339    HB3  ALA 111           HB3      ALA 111  -8.230 -24.829   2.290
  340    H    THR 112           H        THR 112  -8.341 -21.878  -0.085
  341    HA   THR 112           HA       THR 112  -7.725 -20.233   2.242
  342    HB   THR 112           HB       THR 112  -6.588 -18.737   0.677
  343    HG1  THR 112           HG1      THR 112  -6.494 -19.253  -1.488
  344   HG21  THR 112          HG21      THR 112  -4.834 -20.274  -0.061
  345   HG22  THR 112          HG22      THR 112  -5.376 -20.701   1.570
  346   HG23  THR 112          HG23      THR 112  -5.903 -21.666   0.177
  347    H    LEU 113           H        LEU 113 -10.195 -19.944  -0.320
  348    HA   LEU 113           HA       LEU 113 -10.880 -17.237   0.579
  349    HB2  LEU 113           HB2      LEU 113 -10.584 -17.781  -1.803
  350    HB3  LEU 113           HB3      LEU 113 -11.845 -19.016  -1.680
  351    HG   LEU 113           HG       LEU 113 -13.524 -17.328  -1.215
  352   HD11  LEU 113          HD11      LEU 113 -13.007 -14.899  -1.573
  353   HD12  LEU 113          HD12      LEU 113 -12.198 -15.540  -0.142
  354   HD13  LEU 113          HD13      LEU 113 -11.279 -15.300  -1.643
  355   HD21  LEU 113          HD21      LEU 113 -13.067 -18.000  -3.538
  356   HD22  LEU 113          HD22      LEU 113 -13.582 -16.312  -3.459
  357   HD23  LEU 113          HD23      LEU 113 -11.865 -16.700  -3.692
  358    H    GLU 114           H        GLU 114 -12.395 -20.473   0.600
  359    HA   GLU 114           HA       GLU 114 -14.919 -19.329   1.608
  360    HB2  GLU 114           HB2      GLU 114 -14.600 -21.095  -0.291
  361    HB3  GLU 114           HB3      GLU 114 -14.549 -22.261   1.025
  362    HG2  GLU 114           HG2      GLU 114 -16.773 -20.228   0.516
  363    HG3  GLU 114           HG3      GLU 114 -16.792 -21.907  -0.016
  364    H    HIS 115           H        HIS 115 -14.354 -18.661   3.657
  365    HA   HIS 115           HA       HIS 115 -12.900 -20.315   5.493
  366    HB2  HIS 115           HB2      HIS 115 -14.414 -17.735   6.043
  367    HB3  HIS 115           HB3      HIS 115 -13.120 -18.425   7.024
  368    HD1  HIS 115           HD1      HIS 115 -13.268 -15.573   5.096
  369    HD2  HIS 115           HD2      HIS 115 -10.966 -19.099   4.730
  370    HE1  HIS 115           HE1      HIS 115 -11.232 -14.969   3.636
  371    HE2  HIS 115           HE2      HIS 115  -9.856 -17.148   3.388
  372    H    HIS 116           H        HIS 116 -16.139 -20.686   4.758
  373    HA   HIS 116           HA       HIS 116 -16.888 -21.561   7.522
  374    HB2  HIS 116           HB2      HIS 116 -18.713 -21.049   5.154
  375    HB3  HIS 116           HB3      HIS 116 -19.178 -21.288   6.832
  376    HD1  HIS 116           HD1      HIS 116 -18.439 -19.187   8.553
  377    HD2  HIS 116           HD2      HIS 116 -18.169 -18.603   4.377
  378    HE1  HIS 116           HE1      HIS 116 -18.250 -16.642   8.186
  379    HE2  HIS 116           HE2      HIS 116 -18.098 -16.293   5.636
  380    H    HIS 117           H        HIS 117 -15.370 -23.080   5.176
  381    HA   HIS 117           HA       HIS 117 -17.172 -25.202   4.476
  382    HB2  HIS 117           HB2      HIS 117 -14.958 -24.119   3.317
  383    HB3  HIS 117           HB3      HIS 117 -14.243 -25.578   3.994
  384    HD1  HIS 117           HD1      HIS 117 -17.177 -24.480   1.745
  385    HD2  HIS 117           HD2      HIS 117 -14.705 -27.806   2.581
  386    HE1  HIS 117           HE1      HIS 117 -17.736 -26.287  -0.045
  387    HE2  HIS 117           HE2      HIS 117 -16.210 -28.303   0.484
  388    H    HIS 118           H        HIS 118 -15.471 -24.900   7.351
  389    HA   HIS 118           HA       HIS 118 -15.791 -27.798   7.981
  390    HB2  HIS 118           HB2      HIS 118 -13.627 -27.851   9.118
  391    HB3  HIS 118           HB3      HIS 118 -13.415 -27.430   7.433
  392    HD1  HIS 118           HD1      HIS 118 -13.147 -25.829  10.943
  393    HD2  HIS 118           HD2      HIS 118 -12.369 -25.026   6.856
  394    HE1  HIS 118           HE1      HIS 118 -11.753 -23.670  10.877
  395    HE2  HIS 118           HE2      HIS 118 -11.268 -23.191   8.386
  396    H    HIS 119           H        HIS 119 -15.873 -28.256  10.291
  397    HA   HIS 119           HA       HIS 119 -17.393 -26.319  11.879
  398    HB2  HIS 119           HB2      HIS 119 -16.100 -28.960  12.709
  399    HB3  HIS 119           HB3      HIS 119 -17.308 -28.063  13.624
  400    HD1  HIS 119           HD1      HIS 119 -17.253 -31.001  11.600
  401    HD2  HIS 119           HD2      HIS 119 -19.673 -27.539  11.802
  402    HE1  HIS 119           HE1      HIS 119 -19.500 -31.620  10.505
  403    HE2  HIS 119           HE2      HIS 119 -20.965 -29.499  10.622
  404    H    HIS 120           H        HIS 120 -16.716 -25.507  13.975
  405    HA   HIS 120           HA       HIS 120 -15.430 -24.018  15.115
  406    HB2  HIS 120           HB2      HIS 120 -14.696 -26.217  16.022
  407    HB3  HIS 120           HB3      HIS 120 -13.311 -26.179  14.935
  408    HD1  HIS 120           HD1      HIS 120 -11.885 -23.662  15.304
  409    HD2  HIS 120           HD2      HIS 120 -14.138 -25.379  18.424
  410    HE1  HIS 120           HE1      HIS 120 -10.948 -22.662  17.526
  411    HE2  HIS 120           HE2      HIS 120 -12.348 -23.721  19.413
  Start of MODEL   20
    1    H1   SER  66           H1       SER  66  20.887  -5.896   1.469
    2    H2   SER  66           H2       SER  66  19.504  -6.665   1.038
    3    H3   SER  66           H3       SER  66  20.961  -7.318   0.662
    4    HA   SER  66           HA       SER  66  19.865  -4.800  -0.409
    5    HB2  SER  66           HB2      SER  66  22.505  -6.152  -1.107
    6    HB3  SER  66           HB3      SER  66  21.846  -4.675  -1.831
    7    HG   SER  66           HG       SER  66  23.343  -4.210  -0.141
    8    H    GLY  67           H        GLY  67  19.300  -4.831  -2.670
    9    HA2  GLY  67           HA2      GLY  67  19.362  -7.131  -4.355
   10    HA3  GLY  67           HA3      GLY  67  17.794  -7.069  -3.540
   11    H    SER  68           H        SER  68  17.596  -6.961  -6.131
   12    HA   SER  68           HA       SER  68  17.954  -4.393  -7.377
   13    HB2  SER  68           HB2      SER  68  16.260  -6.751  -8.276
   14    HB3  SER  68           HB3      SER  68  16.831  -5.416  -9.293
   15    HG   SER  68           HG       SER  68  18.191  -7.278  -9.465
   16    H    GLY  69           H        GLY  69  15.352  -5.520  -5.389
   17    HA2  GLY  69           HA2      GLY  69  13.366  -4.509  -4.749
   18    HA3  GLY  69           HA3      GLY  69  13.848  -3.074  -5.643
   19    H    ARG  70           H        ARG  70  11.676  -2.811  -6.283
   20    HA   ARG  70           HA       ARG  70   9.803  -2.980  -7.601
   21    HB2  ARG  70           HB2      ARG  70  11.835  -3.941  -9.646
   22    HB3  ARG  70           HB3      ARG  70  10.237  -3.265  -9.997
   23    HG2  ARG  70           HG2      ARG  70  10.901  -1.124  -8.918
   24    HG3  ARG  70           HG3      ARG  70  12.531  -1.776  -8.648
   25    HD2  ARG  70           HD2      ARG  70  12.809  -2.103 -11.083
   26    HD3  ARG  70           HD3      ARG  70  11.186  -1.436 -11.358
   27    HE   ARG  70           HE       ARG  70  12.699   0.444  -9.840
   28   HH11  ARG  70          HH21      ARG  70  12.669  -0.809 -13.109
   29   HH12  ARG  70          HH22      ARG  70  13.375   0.642 -13.776
   30   HH21  ARG  70          HH11      ARG  70  13.585   2.269 -10.742
   31   HH22  ARG  70          HH12      ARG  70  13.897   2.334 -12.453
   32    H    GLY  71           H        GLY  71   9.944  -5.128  -5.908
   33    HA2  GLY  71           HA2      GLY  71   9.334  -7.650  -7.139
   34    HA3  GLY  71           HA3      GLY  71   8.935  -7.175  -5.491
   35    H    ARG  72           H        ARG  72   7.472  -8.554  -7.785
   36    HA   ARG  72           HA       ARG  72   4.810  -7.278  -7.392
   37    HB2  ARG  72           HB2      ARG  72   5.997  -8.034 -10.113
   38    HB3  ARG  72           HB3      ARG  72   4.304  -7.631  -9.849
   39    HG2  ARG  72           HG2      ARG  72   6.635  -5.718  -9.423
   40    HG3  ARG  72           HG3      ARG  72   5.577  -5.774 -10.827
   41    HD2  ARG  72           HD2      ARG  72   3.620  -5.237  -9.435
   42    HD3  ARG  72           HD3      ARG  72   4.621  -5.176  -7.992
   43    HE   ARG  72           HE       ARG  72   4.504  -3.211 -10.202
   44   HH11  ARG  72          HH11      ARG  72   6.222  -4.067  -7.243
   45   HH12  ARG  72          HH12      ARG  72   6.721  -2.412  -6.977
   46   HH21  ARG  72          HH21      ARG  72   5.252  -1.174  -9.832
   47   HH22  ARG  72          HH22      ARG  72   6.244  -0.839  -8.446
   48    H    GLY  73           H        GLY  73   3.027  -8.683  -8.010
   49    HA2  GLY  73           HA2      GLY  73   3.369 -11.349  -6.919
   50    HA3  GLY  73           HA3      GLY  73   1.860 -10.588  -7.432
   51    H    ALA  74           H        ALA  74   4.312 -10.695  -9.890
   52    HA   ALA  74           HA       ALA  74   2.982 -12.815 -11.416
   53    HB1  ALA  74           HB1      ALA  74   3.861 -10.794 -12.527
   54    HB2  ALA  74           HB2      ALA  74   5.502 -11.188 -11.961
   55    HB3  ALA  74           HB3      ALA  74   4.674 -12.254 -13.117
   56    H    ILE  75           H        ILE  75   3.238 -14.195  -9.504
   57    HA   ILE  75           HA       ILE  75   5.838 -15.637  -9.380
   58    HB   ILE  75           HB       ILE  75   3.811 -14.958  -7.210
   59   HG12  ILE  75          HG12      ILE  75   5.202 -13.028  -7.751
   60   HG13  ILE  75          HG13      ILE  75   5.526 -13.628  -6.143
   61   HG21  ILE  75          HG21      ILE  75   6.344 -16.618  -6.939
   62   HG22  ILE  75          HG22      ILE  75   5.403 -15.946  -5.587
   63   HG23  ILE  75          HG23      ILE  75   4.660 -17.133  -6.660
   64   HD11  ILE  75          HD11      ILE  75   7.640 -14.666  -6.926
   65   HD12  ILE  75          HD12      ILE  75   7.302 -14.099  -8.583
   66   HD13  ILE  75          HD13      ILE  75   7.582 -12.934  -7.280
   67    H    ASP  76           H        ASP  76   5.810 -17.870  -9.251
   68    HA   ASP  76           HA       ASP  76   3.202 -19.308  -9.599
   69    HB2  ASP  76           HB2      ASP  76   3.913 -18.492 -11.818
   70    HB3  ASP  76           HB3      ASP  76   5.465 -19.304 -11.631
   71    H    ARG  77           H        ARG  77   6.794 -19.751  -9.533
   72    HA   ARG  77           HA       ARG  77   6.768 -22.470  -8.879
   73    HB2  ARG  77           HB2      ARG  77   8.779 -21.221  -9.594
   74    HB3  ARG  77           HB3      ARG  77   8.753 -20.280  -8.110
   75    HG2  ARG  77           HG2      ARG  77  10.502 -21.840  -7.909
   76    HG3  ARG  77           HG3      ARG  77   9.258 -22.383  -6.806
   77    HD2  ARG  77           HD2      ARG  77   9.785 -23.507  -9.585
   78    HD3  ARG  77           HD3      ARG  77  10.399 -24.204  -8.077
   79    HE   ARG  77           HE       ARG  77   7.652 -24.131  -7.679
   80   HH11  ARG  77          HH11      ARG  77   9.815 -25.779  -9.921
   81   HH12  ARG  77          HH12      ARG  77   8.590 -26.976 -10.315
   82   HH21  ARG  77          HH21      ARG  77   6.095 -25.562  -8.517
   83   HH22  ARG  77          HH22      ARG  77   6.660 -26.904  -9.504
   84    H    GLU  78           H        GLU  78   6.571 -19.729  -6.685
   85    HA   GLU  78           HA       GLU  78   6.568 -21.257  -4.230
   86    HB2  GLU  78           HB2      GLU  78   7.169 -18.843  -4.486
   87    HB3  GLU  78           HB3      GLU  78   5.471 -18.482  -4.815
   88    HG2  GLU  78           HG2      GLU  78   4.851 -19.289  -2.557
   89    HG3  GLU  78           HG3      GLU  78   6.525 -19.760  -2.251
   90    H    GLN  79           H        GLN  79   3.946 -20.091  -6.385
   91    HA   GLN  79           HA       GLN  79   1.795 -20.810  -4.579
   92    HB2  GLN  79           HB2      GLN  79   1.685 -20.407  -7.605
   93    HB3  GLN  79           HB3      GLN  79   0.319 -20.480  -6.485
   94    HG2  GLN  79           HG2      GLN  79   1.531 -18.475  -5.269
   95    HG3  GLN  79           HG3      GLN  79   2.401 -18.308  -6.800
   96   HE21  GLN  79          HE22      GLN  79   1.264 -17.254  -8.558
   97   HE22  GLN  79          HE21      GLN  79  -0.431 -16.804  -8.411
   98    H    SER  80           H        SER  80   3.247 -22.472  -7.419
   99    HA   SER  80           HA       SER  80   1.607 -24.824  -7.239
  100    HB2  SER  80           HB2      SER  80   3.415 -25.910  -8.570
  101    HB3  SER  80           HB3      SER  80   2.840 -24.379  -9.253
  102    HG   SER  80           HG       SER  80   4.676 -23.397  -8.715
  103    H    ALA  81           H        ALA  81   4.851 -24.151  -5.769
  104    HA   ALA  81           HA       ALA  81   5.069 -26.565  -4.385
  105    HB1  ALA  81           HB1      ALA  81   6.914 -24.976  -4.694
  106    HB2  ALA  81           HB2      ALA  81   6.107 -23.797  -3.640
  107    HB3  ALA  81           HB3      ALA  81   6.692 -25.336  -2.969
  108    H    ALA  82           H        ALA  82   3.482 -23.516  -3.252
  109    HA   ALA  82           HA       ALA  82   2.739 -24.490  -0.679
  110    HB1  ALA  82           HB1      ALA  82   1.155 -22.600  -0.698
  111    HB2  ALA  82           HB2      ALA  82   2.748 -22.109  -1.304
  112    HB3  ALA  82           HB3      ALA  82   1.411 -22.384  -2.442
  113    H    ILE  83           H        ILE  83   0.935 -24.607  -3.796
  114    HA   ILE  83           HA       ILE  83  -1.378 -25.930  -2.695
  115    HB   ILE  83           HB       ILE  83  -0.345 -25.704  -5.544
  116   HG12  ILE  83          HG12      ILE  83  -2.646 -24.340  -4.084
  117   HG13  ILE  83          HG13      ILE  83  -1.080 -23.599  -4.292
  118   HG21  ILE  83          HG21      ILE  83  -1.813 -27.721  -5.354
  119   HG22  ILE  83          HG22      ILE  83  -3.062 -26.735  -4.566
  120   HG23  ILE  83          HG23      ILE  83  -2.611 -26.443  -6.261
  121   HD11  ILE  83          HD11      ILE  83  -2.486 -22.658  -5.947
  122   HD12  ILE  83          HD12      ILE  83  -1.397 -23.771  -6.805
  123   HD13  ILE  83          HD13      ILE  83  -3.091 -24.233  -6.465
  124    H    ARG  84           H        ARG  84   1.632 -27.231  -4.178
  125    HA   ARG  84           HA       ARG  84   0.936 -30.001  -3.966
  126    HB2  ARG  84           HB2      ARG  84   2.984 -28.973  -5.152
  127    HB3  ARG  84           HB3      ARG  84   3.710 -28.784  -3.562
  128    HG2  ARG  84           HG2      ARG  84   3.081 -31.440  -3.433
  129    HG3  ARG  84           HG3      ARG  84   3.210 -31.269  -5.179
  130    HD2  ARG  84           HD2      ARG  84   5.318 -30.602  -3.083
  131    HD3  ARG  84           HD3      ARG  84   5.329 -31.987  -4.165
  132    HE   ARG  84           HE       ARG  84   5.573 -30.414  -6.090
  133   HH11  ARG  84          HH21      ARG  84   6.648 -29.190  -2.959
  134   HH12  ARG  84          HH22      ARG  84   7.864 -28.192  -3.696
  135   HH21  ARG  84          HH11      ARG  84   7.162 -29.240  -6.902
  136   HH22  ARG  84          HH12      ARG  84   8.112 -28.154  -5.901
  137    H    GLU  85           H        GLU  85   2.651 -27.906  -1.567
  138    HA   GLU  85           HA       GLU  85   2.855 -29.837   0.423
  139    HB2  GLU  85           HB2      GLU  85   3.962 -27.541   0.326
  140    HB3  GLU  85           HB3      GLU  85   2.439 -26.874   0.930
  141    HG2  GLU  85           HG2      GLU  85   2.725 -28.708   2.829
  142    HG3  GLU  85           HG3      GLU  85   4.395 -28.753   2.294
  143    H    TRP  86           H        TRP  86   0.228 -27.399  -0.000
  144    HA   TRP  86           HA       TRP  86  -1.445 -28.151   2.063
  145    HB2  TRP  86           HB2      TRP  86  -1.729 -26.147   0.752
  146    HB3  TRP  86           HB3      TRP  86  -2.032 -27.075  -0.707
  147    HD1  TRP  86           HD1      TRP  86  -3.710 -25.988   2.535
  148    HE1  TRP  86           HE1      TRP  86  -6.255 -26.281   2.335
  149    HE3  TRP  86           HE3      TRP  86  -3.891 -28.388  -1.990
  150    HZ2  TRP  86           HZ2      TRP  86  -8.117 -27.494   0.491
  151    HZ3  TRP  86           HZ3      TRP  86  -6.070 -29.109  -2.937
  152    HH2  TRP  86           HH2      TRP  86  -8.181 -28.693  -1.689
  153    H    ALA  87           H        ALA  87  -1.435 -29.463  -1.295
  154    HA   ALA  87           HA       ALA  87  -3.503 -31.377  -0.910
  155    HB1  ALA  87           HB1      ALA  87  -1.153 -31.272  -2.867
  156    HB2  ALA  87           HB2      ALA  87  -2.541 -32.373  -2.988
  157    HB3  ALA  87           HB3      ALA  87  -2.785 -30.619  -3.113
  158    H    ARG  88           H        ARG  88   0.062 -31.728  -0.532
  159    HA   ARG  88           HA       ARG  88   0.040 -34.503   0.192
  160    HB2  ARG  88           HB2      ARG  88   2.028 -33.205  -0.543
  161    HB3  ARG  88           HB3      ARG  88   2.019 -32.313   0.983
  162    HG2  ARG  88           HG2      ARG  88   2.397 -34.443   2.223
  163    HG3  ARG  88           HG3      ARG  88   2.362 -35.336   0.687
  164    HD2  ARG  88           HD2      ARG  88   4.333 -34.059  -0.096
  165    HD3  ARG  88           HD3      ARG  88   4.356 -33.164   1.442
  166    HE   ARG  88           HE       ARG  88   4.414 -35.972   1.980
  167   HH11  ARG  88          HH21      ARG  88   6.590 -33.515   0.740
  168   HH12  ARG  88          HH22      ARG  88   8.004 -34.378   1.267
  169   HH21  ARG  88          HH11      ARG  88   6.263 -37.017   2.625
  170   HH22  ARG  88          HH12      ARG  88   7.820 -36.313   2.311
  171    H    ARG  89           H        ARG  89  -0.167 -31.580   2.230
  172    HA   ARG  89           HA       ARG  89  -0.291 -32.935   4.777
  173    HB2  ARG  89           HB2      ARG  89  -1.091 -30.154   3.835
  174    HB3  ARG  89           HB3      ARG  89  -1.264 -30.674   5.512
  175    HG2  ARG  89           HG2      ARG  89   1.119 -31.061   5.749
  176    HG3  ARG  89           HG3      ARG  89   1.392 -30.826   4.024
  177    HD2  ARG  89           HD2      ARG  89   2.112 -28.858   5.188
  178    HD3  ARG  89           HD3      ARG  89   0.686 -28.459   4.215
  179    HE   ARG  89           HE       ARG  89  -0.175 -29.128   6.847
  180   HH11  ARG  89          HH11      ARG  89   1.733 -26.562   5.350
  181   HH12  ARG  89          HH12      ARG  89   1.221 -25.394   6.543
  182   HH21  ARG  89          HH21      ARG  89  -0.766 -27.562   8.320
  183   HH22  ARG  89          HH22      ARG  89  -0.134 -25.950   8.180
  184    H    ASN  90           H        ASN  90  -2.889 -32.006   2.519
  185    HA   ASN  90           HA       ASN  90  -4.875 -33.157   4.380
  186    HB2  ASN  90           HB2      ASN  90  -6.531 -32.001   3.214
  187    HB3  ASN  90           HB3      ASN  90  -5.167 -30.905   3.378
  188   HD21  ASN  90          HD22      ASN  90  -6.164 -29.656   1.663
  189   HD22  ASN  90          HD21      ASN  90  -6.004 -30.170   0.005
  190    H    GLY  91           H        GLY  91  -2.919 -34.683   2.353
  191    HA2  GLY  91           HA2      GLY  91  -2.940 -36.936   1.923
  192    HA3  GLY  91           HA3      GLY  91  -4.627 -37.021   2.419
  193    H    HIS  92           H        HIS  92  -3.864 -34.798  -0.199
  194    HA   HIS  92           HA       HIS  92  -5.140 -36.679  -2.157
  195    HB2  HIS  92           HB2      HIS  92  -4.860 -33.655  -2.187
  196    HB3  HIS  92           HB3      HIS  92  -5.397 -34.604  -3.575
  197    HD1  HIS  92           HD1      HIS  92  -6.596 -33.522  -0.119
  198    HD2  HIS  92           HD2      HIS  92  -7.852 -35.737  -3.487
  199    HE1  HIS  92           HE1      HIS  92  -9.134 -33.968   0.201
  200    HE2  HIS  92           HE2      HIS  92  -9.882 -35.315  -1.870
  201    H    ASN  93           H        ASN  93  -4.131 -37.377  -3.956
  202    HA   ASN  93           HA       ASN  93  -1.238 -37.185  -4.105
  203    HB2  ASN  93           HB2      ASN  93  -1.431 -38.721  -5.954
  204    HB3  ASN  93           HB3      ASN  93  -2.457 -39.261  -4.641
  205   HD21  ASN  93          HD22      ASN  93  -2.383 -38.680  -8.000
  206   HD22  ASN  93          HD21      ASN  93  -4.117 -38.665  -8.249
  207    H    VAL  94           H        VAL  94   0.035 -36.011  -5.430
  208    HA   VAL  94           HA       VAL  94  -1.049 -34.250  -7.545
  209    HB   VAL  94           HB       VAL  94   0.257 -32.296  -6.461
  210   HG11  VAL  94          HG11      VAL  94  -1.659 -31.471  -5.343
  211   HG12  VAL  94          HG12      VAL  94  -2.190 -32.389  -6.756
  212   HG13  VAL  94          HG13      VAL  94  -2.325 -33.115  -5.143
  213   HG21  VAL  94          HG21      VAL  94   0.490 -32.209  -4.095
  214   HG22  VAL  94          HG22      VAL  94  -0.258 -33.798  -3.876
  215   HG23  VAL  94          HG23      VAL  94   1.338 -33.651  -4.647
  216    H    SER  95           H        SER  95   0.407 -33.513  -9.007
  217    HA   SER  95           HA       SER  95   2.800 -34.990  -9.476
  218    HB2  SER  95           HB2      SER  95   1.805 -32.362 -10.619
  219    HB3  SER  95           HB3      SER  95   3.120 -33.350 -11.309
  220    HG   SER  95           HG       SER  95   1.044 -33.760 -12.293
  221    H    THR  96           H        THR  96   4.997 -34.396  -9.378
  222    HA   THR  96           HA       THR  96   5.615 -32.863  -6.985
  223    HB   THR  96           HB       THR  96   7.942 -33.738  -7.406
  224    HG1  THR  96           HG1      THR  96   8.088 -35.358  -9.013
  225   HG21  THR  96          HG21      THR  96   6.310 -34.946  -5.970
  226   HG22  THR  96          HG22      THR  96   5.716 -35.829  -7.391
  227   HG23  THR  96          HG23      THR  96   7.388 -36.056  -6.835
  228    H    ARG  97           H        ARG  97   7.094 -32.726 -10.257
  229    HA   ARG  97           HA       ARG  97   8.515 -30.298  -9.653
  230    HB2  ARG  97           HB2      ARG  97   9.224 -32.115 -11.215
  231    HB3  ARG  97           HB3      ARG  97   7.983 -31.602 -12.362
  232    HG2  ARG  97           HG2      ARG  97   9.084 -29.392 -12.583
  233    HG3  ARG  97           HG3      ARG  97  10.286 -29.861 -11.363
  234    HD2  ARG  97           HD2      ARG  97  11.050 -31.706 -12.831
  235    HD3  ARG  97           HD3      ARG  97   9.847 -31.236 -14.051
  236    HE   ARG  97           HE       ARG  97  11.431 -28.953 -13.446
  237   HH11  ARG  97          HH11      ARG  97  11.851 -32.031 -15.074
  238   HH12  ARG  97          HH12      ARG  97  13.126 -31.424 -16.094
  239   HH21  ARG  97          HH21      ARG  97  13.050 -28.236 -14.786
  240   HH22  ARG  97          HH22      ARG  97  13.781 -29.317 -15.933
  241    H    GLY  98           H        GLY  98   5.481 -30.820 -11.348
  242    HA2  GLY  98           HA2      GLY  98   4.418 -28.198 -10.973
  243    HA3  GLY  98           HA3      GLY  98   5.158 -28.284 -12.583
  244    H    ARG  99           H        ARG  99   2.930 -27.892 -13.296
  245    HA   ARG  99           HA       ARG  99   0.898 -28.478 -14.149
  246    HB2  ARG  99           HB2      ARG  99   2.697 -29.694 -15.493
  247    HB3  ARG  99           HB3      ARG  99   2.162 -31.178 -14.695
  248    HG2  ARG  99           HG2      ARG  99  -0.147 -30.787 -15.633
  249    HG3  ARG  99           HG3      ARG  99   0.443 -29.308 -16.402
  250    HD2  ARG  99           HD2      ARG  99   2.089 -30.637 -17.698
  251    HD3  ARG  99           HD3      ARG  99   1.513 -32.120 -16.946
  252    HE   ARG  99           HE       ARG  99   0.200 -30.514 -19.040
  253   HH11  ARG  99          HH11      ARG  99  -0.342 -33.124 -16.753
  254   HH12  ARG  99          HH12      ARG  99  -1.723 -33.722 -17.631
  255   HH21  ARG  99          HH21      ARG  99  -1.552 -31.341 -20.113
  256   HH22  ARG  99          HH22      ARG  99  -2.389 -32.731 -19.488
  257    H    ILE 100           H        ILE 100   0.601 -28.490 -11.564
  258    HA   ILE 100           HA       ILE 100  -0.714 -30.827 -10.453
  259    HB   ILE 100           HB       ILE 100  -0.809 -27.887  -9.713
  260   HG12  ILE 100          HG12      ILE 100   0.626 -30.325  -8.541
  261   HG13  ILE 100          HG13      ILE 100   1.381 -28.999  -9.416
  262   HG21  ILE 100          HG21      ILE 100  -1.925 -30.219  -8.084
  263   HG22  ILE 100          HG22      ILE 100  -1.900 -28.507  -7.625
  264   HG23  ILE 100          HG23      ILE 100  -2.920 -29.013  -8.944
  265   HD11  ILE 100          HD11      ILE 100   1.835 -28.641  -7.131
  266   HD12  ILE 100          HD12      ILE 100   0.608 -27.435  -7.577
  267   HD13  ILE 100          HD13      ILE 100   0.150 -28.893  -6.652
  268    HA   PRO 101           HA       PRO 101  -4.449 -30.503 -12.866
  269    HB2  PRO 101           HB2      PRO 101  -6.032 -31.572 -10.574
  270    HB3  PRO 101           HB3      PRO 101  -5.851 -32.218 -12.226
  271    HG2  PRO 101           HG2      PRO 101  -4.621 -33.374 -10.064
  272    HG3  PRO 101           HG3      PRO 101  -3.832 -33.307 -11.682
  273    HD2  PRO 101           HD2      PRO 101  -3.399 -31.520  -9.289
  274    HD3  PRO 101           HD3      PRO 101  -2.198 -32.262 -10.389
  275    H    ALA 102           H        ALA 102  -5.945 -28.913 -13.271
  276    HA   ALA 102           HA       ALA 102  -6.112 -26.658 -11.654
  277    HB1  ALA 102           HB1      ALA 102  -8.051 -27.543 -13.802
  278    HB2  ALA 102           HB2      ALA 102  -7.807 -25.889 -13.180
  279    HB3  ALA 102           HB3      ALA 102  -6.498 -26.703 -14.067
  280    H    ASP 103           H        ASP 103  -8.256 -29.492 -11.647
  281    HA   ASP 103           HA       ASP 103 -10.294 -28.529 -10.040
  282    HB2  ASP 103           HB2      ASP 103 -10.303 -30.693 -11.196
  283    HB3  ASP 103           HB3      ASP 103  -9.047 -31.296 -10.111
  284    H    VAL 104           H        VAL 104  -7.057 -29.703  -9.079
  285    HA   VAL 104           HA       VAL 104  -7.603 -29.561  -6.248
  286    HB   VAL 104           HB       VAL 104  -4.923 -29.820  -7.584
  287   HG11  VAL 104          HG11      VAL 104  -5.840 -30.579  -4.784
  288   HG12  VAL 104          HG12      VAL 104  -4.235 -30.914  -5.467
  289   HG13  VAL 104          HG13      VAL 104  -4.733 -29.245  -5.207
  290   HG21  VAL 104          HG21      VAL 104  -6.349 -31.716  -8.320
  291   HG22  VAL 104          HG22      VAL 104  -5.102 -32.264  -7.207
  292   HG23  VAL 104          HG23      VAL 104  -6.776 -32.052  -6.630
  293    H    ILE 105           H        ILE 105  -5.966 -27.503  -8.673
  294    HA   ILE 105           HA       ILE 105  -5.104 -25.436  -6.866
  295    HB   ILE 105           HB       ILE 105  -5.870 -25.481  -9.810
  296   HG12  ILE 105          HG12      ILE 105  -3.089 -24.977  -8.709
  297   HG13  ILE 105          HG13      ILE 105  -3.693 -26.626  -8.655
  298   HG21  ILE 105          HG21      ILE 105  -6.217 -23.189  -9.146
  299   HG22  ILE 105          HG22      ILE 105  -4.695 -23.161  -8.217
  300   HG23  ILE 105          HG23      ILE 105  -4.672 -23.270  -9.989
  301   HD11  ILE 105          HD11      ILE 105  -3.583 -24.979 -11.203
  302   HD12  ILE 105          HD12      ILE 105  -2.375 -26.177 -10.687
  303   HD13  ILE 105          HD13      ILE 105  -4.037 -26.692 -11.016
  304    H    ASP 106           H        ASP 106  -8.225 -25.782  -8.678
  305    HA   ASP 106           HA       ASP 106  -9.512 -23.611  -7.502
  306    HB2  ASP 106           HB2      ASP 106 -10.326 -24.810  -9.481
  307    HB3  ASP 106           HB3      ASP 106 -10.680 -26.232  -8.496
  308    H    ALA 107           H        ALA 107  -9.437 -27.060  -6.379
  309    HA   ALA 107           HA       ALA 107 -10.961 -26.813  -4.118
  310    HB1  ALA 107           HB1      ALA 107  -8.463 -28.538  -4.511
  311    HB2  ALA 107           HB2      ALA 107  -9.770 -28.823  -3.340
  312    HB3  ALA 107           HB3      ALA 107 -10.096 -28.940  -5.068
  313    H    TYR 108           H        TYR 108  -7.429 -26.162  -4.382
  314    HA   TYR 108           HA       TYR 108  -6.973 -25.332  -1.695
  315    HB2  TYR 108           HB2      TYR 108  -5.117 -25.802  -3.096
  316    HB3  TYR 108           HB3      TYR 108  -5.645 -24.688  -4.342
  317    HD1  TYR 108           HD1      TYR 108  -4.251 -24.876  -0.893
  318    HD2  TYR 108           HD2      TYR 108  -5.072 -22.358  -4.296
  319    HE1  TYR 108           HE1      TYR 108  -2.809 -23.087   0.079
  320    HE2  TYR 108           HE2      TYR 108  -3.645 -20.572  -3.321
  321    HH   TYR 108           HH       TYR 108  -2.282 -19.943  -1.561
  322    H    HIS 109           H        HIS 109  -7.824 -23.309  -4.591
  323    HA   HIS 109           HA       HIS 109  -7.986 -20.890  -3.068
  324    HB2  HIS 109           HB2      HIS 109  -9.133 -21.680  -5.763
  325    HB3  HIS 109           HB3      HIS 109  -9.385 -20.081  -5.056
  326    HD1  HIS 109           HD1      HIS 109  -6.867 -18.864  -4.243
  327    HD2  HIS 109           HD2      HIS 109  -7.049 -21.742  -7.318
  328    HE1  HIS 109           HE1      HIS 109  -4.717 -18.567  -5.639
  329    HE2  HIS 109           HE2      HIS 109  -4.848 -20.306  -7.530
  330    H    ALA 110           H        ALA 110 -10.542 -23.341  -3.660
  331    HA   ALA 110           HA       ALA 110 -12.624 -21.830  -2.391
  332    HB1  ALA 110           HB1      ALA 110 -13.754 -24.016  -2.219
  333    HB2  ALA 110           HB2      ALA 110 -13.031 -23.799  -3.824
  334    HB3  ALA 110           HB3      ALA 110 -12.238 -24.848  -2.629
  335    H    ALA 111           H        ALA 111 -10.257 -24.219  -1.031
  336    HA   ALA 111           HA       ALA 111 -11.181 -24.170   1.582
  337    HB1  ALA 111           HB1      ALA 111  -9.652 -25.834   0.617
  338    HB2  ALA 111           HB2      ALA 111  -8.360 -24.605   0.538
  339    HB3  ALA 111           HB3      ALA 111  -8.987 -25.145   2.111
  340    H    THR 112           H        THR 112  -8.886 -21.948  -0.018
  341    HA   THR 112           HA       THR 112  -8.333 -20.503   2.473
  342    HB   THR 112           HB       THR 112  -7.037 -18.957   1.086
  343    HG1  THR 112           HG1      THR 112  -6.795 -19.374  -1.093
  344   HG21  THR 112          HG21      THR 112  -5.288 -20.520   0.390
  345   HG22  THR 112          HG22      THR 112  -5.970 -21.023   1.945
  346   HG23  THR 112          HG23      THR 112  -6.429 -21.877   0.456
  347    H    LEU 113           H        LEU 113 -10.380 -19.753  -0.421
  348    HA   LEU 113           HA       LEU 113 -10.980 -17.130   0.717
  349    HB2  LEU 113           HB2      LEU 113 -10.133 -17.477  -1.579
  350    HB3  LEU 113           HB3      LEU 113 -11.565 -18.438  -1.954
  351    HG   LEU 113           HG       LEU 113 -12.999 -16.510  -1.644
  352   HD11  LEU 113          HD11      LEU 113 -10.414 -14.933  -1.237
  353   HD12  LEU 113          HD12      LEU 113 -12.011 -14.211  -1.525
  354   HD13  LEU 113          HD13      LEU 113 -11.723 -15.131  -0.048
  355   HD21  LEU 113          HD21      LEU 113 -10.687 -15.985  -3.553
  356   HD22  LEU 113          HD22      LEU 113 -12.093 -17.029  -3.869
  357   HD23  LEU 113          HD23      LEU 113 -12.318 -15.283  -3.668
  358    H    GLU 114           H        GLU 114 -12.811 -20.143   0.197
  359    HA   GLU 114           HA       GLU 114 -15.356 -18.793   0.055
  360    HB2  GLU 114           HB2      GLU 114 -14.581 -21.173  -0.789
  361    HB3  GLU 114           HB3      GLU 114 -15.160 -21.709   0.785
  362    HG2  GLU 114           HG2      GLU 114 -16.699 -20.271  -1.420
  363    HG3  GLU 114           HG3      GLU 114 -16.854 -21.965  -0.967
  364    H    HIS 115           H        HIS 115 -16.908 -18.368   1.584
  365    HA   HIS 115           HA       HIS 115 -16.023 -17.659   4.133
  366    HB2  HIS 115           HB2      HIS 115 -18.904 -18.052   3.217
  367    HB3  HIS 115           HB3      HIS 115 -18.360 -17.008   4.526
  368    HD1  HIS 115           HD1      HIS 115 -16.645 -14.901   3.635
  369    HD2  HIS 115           HD2      HIS 115 -19.123 -16.920   0.866
  370    HE1  HIS 115           HE1      HIS 115 -16.783 -13.395   1.537
  371    HE2  HIS 115           HE2      HIS 115 -18.304 -14.632  -0.132
  372    H    HIS 116           H        HIS 116 -17.338 -20.795   3.268
  373    HA   HIS 116           HA       HIS 116 -18.023 -21.447   6.081
  374    HB2  HIS 116           HB2      HIS 116 -18.333 -23.122   3.565
  375    HB3  HIS 116           HB3      HIS 116 -19.016 -23.474   5.151
  376    HD1  HIS 116           HD1      HIS 116 -19.527 -21.191   2.161
  377    HD2  HIS 116           HD2      HIS 116 -21.177 -22.027   5.954
  378    HE1  HIS 116           HE1      HIS 116 -21.856 -20.024   2.227
  379    HE2  HIS 116           HE2      HIS 116 -22.840 -20.538   4.551
  380    H    HIS 117           H        HIS 117 -15.086 -21.503   4.555
  381    HA   HIS 117           HA       HIS 117 -14.199 -24.162   5.007
  382    HB2  HIS 117           HB2      HIS 117 -12.056 -23.432   4.384
  383    HB3  HIS 117           HB3      HIS 117 -13.172 -22.443   3.460
  384    HD1  HIS 117           HD1      HIS 117 -13.049 -19.804   3.912
  385    HD2  HIS 117           HD2      HIS 117 -10.576 -22.235   6.327
  386    HE1  HIS 117           HE1      HIS 117 -11.388 -18.213   5.106
  387    HE2  HIS 117           HE2      HIS 117  -9.902 -19.711   6.593
  388    H    HIS 118           H        HIS 118 -14.500 -21.674   7.393
  389    HA   HIS 118           HA       HIS 118 -12.439 -22.500   9.206
  390    HB2  HIS 118           HB2      HIS 118 -13.732 -21.077  10.843
  391    HB3  HIS 118           HB3      HIS 118 -13.267 -20.300   9.345
  392    HD1  HIS 118           HD1      HIS 118 -16.510 -22.420   9.797
  393    HD2  HIS 118           HD2      HIS 118 -15.119 -18.485   9.116
  394    HE1  HIS 118           HE1      HIS 118 -18.601 -20.972   9.319
  395    HE2  HIS 118           HE2      HIS 118 -17.731 -18.580   8.884
  396    H    HIS 119           H        HIS 119 -12.369 -23.796  10.969
  397    HA   HIS 119           HA       HIS 119 -14.774 -25.308  11.873
  398    HB2  HIS 119           HB2      HIS 119 -12.092 -26.587  11.174
  399    HB3  HIS 119           HB3      HIS 119 -13.437 -27.414  11.941
  400    HD1  HIS 119           HD1      HIS 119 -15.823 -27.352  10.283
  401    HD2  HIS 119           HD2      HIS 119 -11.989 -26.841   8.583
  402    HE1  HIS 119           HE1      HIS 119 -16.072 -27.847   7.769
  403    HE2  HIS 119           HE2      HIS 119 -13.726 -27.549   6.743
  404    H    HIS 120           H        HIS 120 -14.492 -26.316  13.987
  405    HA   HIS 120           HA       HIS 120 -13.033 -24.631  15.885
  406    HB2  HIS 120           HB2      HIS 120 -14.062 -26.072  17.591
  407    HB3  HIS 120           HB3      HIS 120 -15.227 -25.352  16.496
  408    HD1  HIS 120           HD1      HIS 120 -17.018 -27.046  15.669
  409    HD2  HIS 120           HD2      HIS 120 -13.357 -28.802  16.833
  410    HE1  HIS 120           HE1      HIS 120 -17.335 -29.598  15.462
  411    HE2  HIS 120           HE2      HIS 120 -15.097 -30.660  16.175