*HEADER    TRANSCRIPTION                           26-JAN-15   2RUT              
*TITLE     SOLUTION STRUCTURES OF THE DNA-BINDING DOMAIN (ZF2) OF IMMUNE-RELATED 
*TITLE    2 ZINC-FINGER PROTEIN ZFAT                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN ZFAT;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 269-297;                                      
*COMPND   5 SYNONYM: ZINC FINGER GENE IN AITD SUSCEPTIBILITY REGION, ZINC FINGER 
*COMPND   6 PROTEIN 406;                                                         
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZFAT, KIAA1485, ZFAT1, ZNF406;                                 
*SOURCE   6 EXPRESSION_SYSTEM: CELL-FREE SYNTHESIS;                              
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: P060718-15                                 
*KEYWDS    ZFAT, ZINC FINGER, TRANSCRIPTION                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    N.TOCHIO, T.UMEHARA, T.KIGAWA, S.YOKOYAMA                             
*REVDAT   1   08-APR-15 2RUT    0                                                


#
#  chirality for residue 1 atoms:  N C HA2 HA3
 &rst iat=1,8,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 250., rk3 = 250.,  &end
#
#  chirality for residue 2 atoms:  CA OG HB2 HB3
 &rst iat=12,17,15,16, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=10,19,13,14, &end
#
#  chirality for residue 3 atoms:  CA OG HB2 HB3
 &rst iat=23,28,26,27, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=21,30,24,25, &end
#
#  chirality for residue 4 atoms:  N C HA2 HA3
 &rst iat=32,37,35,36, &end
#
#  chirality for residue 5 atoms:  CA OG HB2 HB3
 &rst iat=41,46,44,45, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=39,48,42,43, &end
#
#  chirality for residue 6 atoms:  CA OG HB2 HB3
 &rst iat=52,57,55,56, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=50,59,53,54, &end
#
#  chirality for residue 7 atoms:  N C HA2 HA3
 &rst iat=61,66,64,65, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=70,75,73,74, &end
#
#  chirality for residue 8 atoms:  CB CD HG2 HG3
 &rst iat=72,78,76,77, &end
#
#  chirality for residue 8 atoms:  CD NZ HE2 HE3
 &rst iat=78,84,82,83, &end
#
#  chirality for residue 8 atoms:  CG CE HD2 HD3
 &rst iat=75,81,79,80, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=68,88,71,72, &end
#
#  chirality for residue 9 atoms:  CA CG2 CG1 HB
 &rst iat=92,96,100,95, &end
#
#  chirality for residue 9 atoms:  CB CD1 HG12 HG13
 &rst iat=94,103,101,102, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=90,107,93,94, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=111,116,114,115, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=109,127,112,113, &end
#
#  chirality for residue 11 atoms:  CA CG2 OG1 HB
 &rst iat=131,135,139,134, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=129,141,132,133, &end
#
#  chirality for residue 13 atoms:  CA CG HB2 HB3
 &rst iat=155,160,158,159, &end
#
#  chirality for residue 13 atoms:  CB CD HG2 HG3
 &rst iat=157,163,161,162, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=153,166,156,157, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=170,175,173,174, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=168,187,171,172, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=201,206,204,205, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=199,211,202,203, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=215,220,218,219, &end
#
#  chirality for residue 17 atoms:  CB CD HG2 HG3
 &rst iat=217,223,221,222, &end
#
#  chirality for residue 17 atoms:  CD NZ HE2 HE3
 &rst iat=223,229,227,228, &end
#
#  chirality for residue 17 atoms:  CG CE HD2 HD3
 &rst iat=220,226,224,225, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=213,233,216,217, &end
#
#  chirality for residue 18 atoms:  CA CG1 CG2 HB
 &rst iat=237,241,245,240, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=235,249,238,239, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=253,258,256,257, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=251,269,254,255, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=273,278,276,277, &end
#
#  chirality for residue 20 atoms:  CB CD HG2 HG3
 &rst iat=275,281,279,280, &end
#
#  chirality for residue 20 atoms:  CD NZ HE2 HE3
 &rst iat=281,287,285,286, &end
#
#  chirality for residue 20 atoms:  CG CE HD2 HD3
 &rst iat=278,284,282,283, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=271,291,274,275, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=295,300,298,299, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=293,311,296,297, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=315,320,318,319, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=317,323,321,322, &end
#
#  chirality for residue 22 atoms:  CD NZ HE2 HE3
 &rst iat=323,329,327,328, &end
#
#  chirality for residue 22 atoms:  CG CE HD2 HD3
 &rst iat=320,326,324,325, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=313,333,316,317, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=337,342,340,341, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=335,350,338,339, &end
#
#  chirality for residue 24 atoms:  CA OG HB2 HB3
 &rst iat=354,359,357,358, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=352,361,355,356, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=365,370,368,369, &end
#
#  chirality for residue 25 atoms:  CB CD1 CD2 HG
 &rst iat=367,372,376,371, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=363,380,366,367, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=384,389,387,388, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=386,392,390,391, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=382,397,385,386, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=399,407,402,403, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=411,416,414,415, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=409,424,412,413, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=428,433,431,432, &end
#
#  chirality for residue 29 atoms:  CB CD1 CD2 HG
 &rst iat=430,435,439,434, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=426,443,429,430, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=447,452,450,451, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=449,455,453,454, &end
#
#  chirality for residue 30 atoms:  CG NE HD2 HD3
 &rst iat=452,458,456,457, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=445,467,448,449, &end
#
#  chirality for residue 31 atoms:  CA CG2 CG1 HB
 &rst iat=471,475,479,474, &end
#
#  chirality for residue 31 atoms:  CB CD1 HG12 HG13
 &rst iat=473,482,480,481, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=469,486,472,473, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=490,495,493,494, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=488,503,491,492, &end
#
#  chirality for residue 33 atoms:  CA CG2 OG1 HB
 &rst iat=507,511,515,510, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=505,517,508,509, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=521,526,524,525, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=519,531,522,523, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=535,540,538,539, &end
#
#  chirality for residue 35 atoms:  CB CD HG2 HG3
 &rst iat=537,543,541,542, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=533,546,536,537, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=550,555,553,554, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=552,558,556,557, &end
#
#  chirality for residue 36 atoms:  CD NZ HE2 HE3
 &rst iat=558,564,562,563, &end
#
#  chirality for residue 36 atoms:  CG CE HD2 HD3
 &rst iat=555,561,559,560, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=548,568,551,552, &end
#
#  trans-omega constraint for residue 2
 &rst iat=12,10,8,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=23,21,19,12, &end
#
#  trans-omega constraint for residue 4
 &rst iat=34,32,30,23, &end
#
#  trans-omega constraint for residue 5
 &rst iat=41,39,37,34, &end
#
#  trans-omega constraint for residue 6
 &rst iat=52,50,48,41, &end
#
#  trans-omega constraint for residue 7
 &rst iat=63,61,59,52, &end
#
#  trans-omega constraint for residue 8
 &rst iat=70,68,66,63, &end
#
#  trans-omega constraint for residue 9
 &rst iat=92,90,88,70, &end
#
#  trans-omega constraint for residue 10
 &rst iat=111,109,107,92, &end
#
#  trans-omega constraint for residue 11
 &rst iat=131,129,127,111, &end
#
#  trans-omega constraint for residue 12
 &rst iat=145,143,141,131, &end
#
#  trans-omega constraint for residue 13
 &rst iat=155,153,151,145, &end
#
#  trans-omega constraint for residue 14
 &rst iat=170,168,166,155, &end
#
#  trans-omega constraint for residue 15
 &rst iat=191,189,187,170, &end
#
#  trans-omega constraint for residue 16
 &rst iat=201,199,197,191, &end
#
#  trans-omega constraint for residue 17
 &rst iat=215,213,211,201, &end
#
#  trans-omega constraint for residue 18
 &rst iat=237,235,233,215, &end
#
#  trans-omega constraint for residue 19
 &rst iat=253,251,249,237, &end
#
#  trans-omega constraint for residue 20
 &rst iat=273,271,269,253, &end
#
#  trans-omega constraint for residue 21
 &rst iat=295,293,291,273, &end
#
#  trans-omega constraint for residue 22
 &rst iat=315,313,311,295, &end
#
#  trans-omega constraint for residue 23
 &rst iat=337,335,333,315, &end
#
#  trans-omega constraint for residue 24
 &rst iat=354,352,350,337, &end
#
#  trans-omega constraint for residue 25
 &rst iat=365,363,361,354, &end
#
#  trans-omega constraint for residue 26
 &rst iat=384,382,380,365, &end
#
#  trans-omega constraint for residue 27
 &rst iat=401,399,397,384, &end
#
#  trans-omega constraint for residue 28
 &rst iat=411,409,407,401, &end
#
#  trans-omega constraint for residue 29
 &rst iat=428,426,424,411, &end
#
#  trans-omega constraint for residue 30
 &rst iat=447,445,443,428, &end
#
#  trans-omega constraint for residue 31
 &rst iat=471,469,467,447, &end
#
#  trans-omega constraint for residue 32
 &rst iat=490,488,486,471, &end
#
#  trans-omega constraint for residue 33
 &rst iat=507,505,503,490, &end
#
#  trans-omega constraint for residue 34
 &rst iat=521,519,517,507, &end
#
#  trans-omega constraint for residue 35
 &rst iat=535,533,531,521, &end
#
#  trans-omega constraint for residue 36
 &rst iat=550,548,546,535, &end
#
# 7 GLY QA 8 LYS QB 4.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
      rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
 igr1=  64,  65,
 igr2=  73,  74,
 &end
#
# 7 GLY QA 9 ILE HN 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  64,  65,
 &end
#
# 7 GLY QA 9 ILE QG2 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1=  64,  65,
 igr2=  97,  98,  99,
 &end
#
# 8 LYS HA 8 LYS QD 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2=  79,  80,
 &end
#
# 8 LYS HA 8 LYS QG 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=  76,  77,
 &end
#
# 8 LYS HA 9 ILE HG12 5.13
 &rst
  ixpk= 0, nxpk= 0, iat=  71, 101, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 8 LYS HA 9 ILE HG13 5.13
 &rst
  ixpk= 0, nxpk= 0, iat=  71, 102, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 8 LYS HA 9 ILE HN 2.76
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  91, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
# 8 LYS HA 9 ILE QG1 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 101, 102,
 &end
#
# 8 LYS HA 9 ILE QG2 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2=  97,  98,  99,
 &end
#
# 8 LYS QB 10 PHE QE 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr1=  73,  74,
 igr2= 120, 124,
 &end
#
# 8 LYS QB 9 ILE HN 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=  73,  74,
 &end
#
# 8 LYS QD 10 PHE QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  79,  80,
 igr2= 120, 124,
 &end
#
# 8 LYS QD 9 ILE HN 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr1=  79,  80,
 &end
#
# 8 LYS QE 10 PHE QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  82,  83,
 igr2= 120, 124,
 &end
#
# 8 LYS QE 9 ILE HN 5.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1=  82,  83,
 &end
#
# 8 LYS QG 10 PHE QE 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  76,  77,
 igr2= 120, 124,
 &end
#
# 8 LYS QG 8 LYS QE 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=  76,  77,
 igr2=  82,  83,
 &end
#
# 9 ILE HA 10 PHE HN 2.85
 &rst
  ixpk= 0, nxpk= 0, iat=  93, 110, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
# 9 ILE HA 10 PHE QD 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 118, 126,
 &end
#
# 9 ILE HA 18 VAL QG1 5.09
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 242, 243, 244,
 &end
#
# 9 ILE HA 19 PHE HN 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  93, 252, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 9 ILE HA 9 ILE QD1 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 104, 105, 106,
 &end
#
# 9 ILE HA 9 ILE QG2 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=  97,  98,  99,
 &end
#
# 9 ILE HB 10 PHE HN 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  95, 110, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 9 ILE HB 18 VAL QG1 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 242, 243, 244,
 &end
#
# 9 ILE HB 18 VAL QG2 4.35
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 246, 247, 248,
 &end
#
# 9 ILE HB 9 ILE QD1 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 104, 105, 106,
 &end
#
# 9 ILE HN 10 PHE HN 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  91, 110, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 9 ILE HN 9 ILE HB 3.95
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  95, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 9 ILE HN 9 ILE HG12 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  91, 101, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 9 ILE HN 9 ILE HG13 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  91, 102, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 9 ILE HN 9 ILE QD1 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 104, 105, 106,
 &end
#
# 9 ILE HN 9 ILE QG2 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2=  97,  98,  99,
 &end
#
# 9 ILE QD1 10 PHE HN 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 104, 105, 106,
 &end
#
# 9 ILE QD1 11 THR HB 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 104, 105, 106,
 &end
#
# 9 ILE QD1 11 THR QG2 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 104, 105, 106,
 igr2= 136, 137, 138,
 &end
#
# 9 ILE QD1 18 VAL HB 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 104, 105, 106,
 &end
#
# 9 ILE QG1 10 PHE HN 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 101, 102,
 &end
#
# 9 ILE QG1 18 VAL QG1 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 101, 102,
 igr2= 242, 243, 244,
 &end
#
# 9 ILE QG2 10 PHE HN 3.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1=  97,  98,  99,
 &end
#
# 9 ILE QG2 18 VAL HB 4.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1=  97,  98,  99,
 &end
#
# 9 ILE QG2 20 LYS HA 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1=  97,  98,  99,
 &end
#
# 9 ILE QG2 20 LYS QD 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1=  97,  98,  99,
 igr2= 282, 283,
 &end
#
# 9 ILE QG2 20 LYS QE 4.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=  97,  98,  99,
 igr2= 285, 286,
 &end
#
# 9 ILE QG2 9 ILE HG12 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 101, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=  97,  98,  99,
 &end
#
# 9 ILE QG2 9 ILE HG13 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=  97,  98,  99,
 &end
#
# 9 ILE QG2 9 ILE QG1 3.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=  97,  98,  99,
 igr2= 101, 102,
 &end
#
# 10 PHE HA 10 PHE QD 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 118, 126,
 &end
#
# 10 PHE HA 11 THR HN 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 130, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 10 PHE HA 25 LEU QD2 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 377, 378, 379,
 &end
#
# 10 PHE HB2 11 THR HN 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 130, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 10 PHE HB2 19 PHE HB2 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 256, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 10 PHE HB2 19 PHE HB3 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 257, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 10 PHE HB2 19 PHE HN 4.19
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 252, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 10 PHE HB2 19 PHE QD 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 260, 268,
 &end
#
# 10 PHE HB2 21 PHE HN 5.32
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 294, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 10 PHE HB2 25 LEU HB2 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 368, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 10 PHE HB2 25 LEU HB3 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 369, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 10 PHE HB2 25 LEU QD2 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 377, 378, 379,
 &end
#
# 10 PHE HB3 11 THR HN 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 130, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 10 PHE HB3 19 PHE HB2 4.19
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 256, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 10 PHE HB3 19 PHE HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 PHE HB3 19 PHE HN 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 252, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 10 PHE HB3 19 PHE QD 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 260, 268,
 &end
#
# 10 PHE HB3 22 LYS HA 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 316, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 10 PHE HB3 25 LEU HB2 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 368, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 10 PHE HB3 25 LEU HB3 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 369, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 10 PHE HB3 25 LEU QD2 3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 377, 378, 379,
 &end
#
# 10 PHE HN 10 PHE HB2 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 114, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 10 PHE HN 10 PHE HB3 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 115, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 10 PHE HN 10 PHE QD 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 118, 126,
 &end
#
# 10 PHE HN 10 PHE QE 5.21
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 120, 124,
 &end
#
# 10 PHE HN 18 VAL QG1 4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 242, 243, 244,
 &end
#
# 10 PHE HN 19 PHE HB2 4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 256, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 10 PHE HN 19 PHE HN 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 252, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 10 PHE HN 20 LYS HA 4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 274, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 10 PHE HN 25 LEU QD2 5.25
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2= 377, 378, 379,
 &end
#
# 10 PHE HZ 22 LYS HG2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 122, 321, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 PHE HZ 22 LYS HG3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 122, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 PHE HZ 22 LYS QB 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 122,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 318, 319,
 &end
#
# 10 PHE HZ 22 LYS QD 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 122,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 324, 325,
 &end
#
# 10 PHE HZ 22 LYS QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 122,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 327, 328,
 &end
#
# 10 PHE QD 11 THR HN 4.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 130, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 118, 126,
 &end
#
# 10 PHE QD 20 LYS HA 5.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 118, 126,
 &end
#
# 10 PHE QD 25 LEU QD2 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 118, 126,
 igr2= 377, 378, 379,
 &end
#
# 10 PHE QE 21 PHE HA 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 296, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1= 120, 124,
 &end
#
# 10 PHE QE 22 LYS HA 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 120, 124,
 &end
#
# 10 PHE QE 22 LYS HB2 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 120, 124,
 &end
#
# 10 PHE QE 22 LYS HB3 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 120, 124,
 &end
#
# 10 PHE QE 22 LYS HG2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 120, 124,
 &end
#
# 10 PHE QE 22 LYS HG3 4.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 120, 124,
 &end
#
# 10 PHE QE 22 LYS QB 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 120, 124,
 igr2= 318, 319,
 &end
#
# 10 PHE QE 22 LYS QD 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 120, 124,
 igr2= 324, 325,
 &end
#
# 10 PHE QE 22 LYS QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 120, 124,
 igr2= 327, 328,
 &end
#
# 11 THR HA 11 THR QG2 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 136, 137, 138,
 &end
#
# 11 THR HA 12 CYM  HB2 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 149, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 11 THR HA 12 CYM  HB3 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 148, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 11 THR HA 12 CYM  HN 2.89
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 144, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 11 THR HA 17 LYS HN 5.09
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 214, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 11 THR HA 18 VAL HA 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 238, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 11 THR HA 18 VAL HB 4.81
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 240, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 11 THR HA 18 VAL QG1 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 242, 243, 244,
 &end
#
# 11 THR HA 18 VAL QG2 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 246, 247, 248,
 &end
#
# 11 THR HA 19 PHE HN 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 252, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 11 THR HA 19 PHE QD 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 260, 268,
 &end
#
# 11 THR HA 25 LEU QD1 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2= 373, 374, 375,
 &end
#
# 11 THR HB 12 CYM  HN 4.11
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 144, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 11 THR HB 18 VAL QG1 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 242, 243, 244,
 &end
#
# 11 THR HN 11 THR HB 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 130, 134, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
# 11 THR HN 11 THR QG2 3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 136, 137, 138,
 &end
#
# 11 THR HN 12 CYM  HN 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 130, 144, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 11 THR HN 25 LEU QD2 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 377, 378, 379,
 &end
#
# 11 THR QG2 12 CYM  HB2 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 149, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 12 CYM  HB3 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 12 CYM  HN 3.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 13 GLU HA 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 13 GLU HN 5.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 13 GLU QB 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1= 136, 137, 138,
 igr2= 158, 159,
 &end
#
# 11 THR QG2 14 TYR HN 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 16 ASN HA 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 16 ASN HN 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 16 ASN QB 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 136, 137, 138,
 igr2= 204, 205,
 &end
#
# 11 THR QG2 17 LYS HN 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 18 VAL HA 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 18 VAL HB 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 136, 137, 138,
 &end
#
# 11 THR QG2 18 VAL QG1 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 136, 137, 138,
 igr2= 242, 243, 244,
 &end
#
# 11 THR QG2 18 VAL QG2 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 136, 137, 138,
 igr2= 246, 247, 248,
 &end
#
# 11 THR QG2 19 PHE HN 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 136, 137, 138,
 &end
#
# 12 CYM  HA 13 GLU HA 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 156, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 12 CYM  HA 13 GLU HN 3.02
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 154, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
# 12 CYM  HA 13 GLU QB 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 158, 159,
 &end
#
# 12 CYM  HA 14 TYR HN 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 169, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 12 CYM  HA 25 LEU QD1 3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 373, 374, 375,
 &end
#
# 12 CYM  HA 25 LEU QD2 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 377, 378, 379,
 &end
#
# 12 CYM  HA 28 HIS HD2 5.18
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 423, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
# 12 CYM  HA 29 LEU QD2 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 440, 441, 442,
 &end
#
# 12 CYM  HB2 13 GLU HN 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 154, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 12 CYM  HB2 14 TYR HN 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 169, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 12 CYM  HB2 15 CYM  HN 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 190, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 12 CYM  HB2 17 LYS HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 216, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 12 CYM  HB2 17 LYS HN 3.61
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 214, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
# 12 CYM  HB2 17 LYS QB 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 218, 219,
 &end
#
# 12 CYM  HB2 19 PHE HZ 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 264, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 12 CYM  HB2 19 PHE QD 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 260, 268,
 &end
#
# 12 CYM  HB2 19 PHE QE 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 262, 266,
 &end
#
# 12 CYM  HB2 25 LEU QD1 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 373, 374, 375,
 &end
#
# 12 CYM  HB2 28 HIS HD2 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 149, 423, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 12 CYM  HB2 29 LEU QD2 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 440, 441, 442,
 &end
#
# 12 CYM  HB3 13 GLU HN 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 154, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 12 CYM  HB3 14 TYR HN 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 169, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 12 CYM  HB3 15 CYM  HN 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 190, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 12 CYM  HB3 16 ASN HA 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 202, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 12 CYM  HB3 16 ASN HN 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 200, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 12 CYM  HB3 17 LYS HB2 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 218, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 12 CYM  HB3 17 LYS HB3 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 219, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 12 CYM  HB3 17 LYS HN 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 214, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 12 CYM  HB3 17 LYS QB 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 218, 219,
 &end
#
# 12 CYM  HB3 19 PHE QE 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 262, 266,
 &end
#
# 12 CYM  HB3 25 LEU QD1 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 373, 374, 375,
 &end
#
# 12 CYM  HB3 25 LEU QD2 5.48
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr2= 377, 378, 379,
 &end
#
# 12 CYM  HB3 28 HIS HD2 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 423, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 12 CYM  HN 12 CYM  HB2 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 149, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 12 CYM  HN 12 CYM  HB3 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 148, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 12 CYM  HN 13 GLU HN 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 154, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 12 CYM  HN 15 CYM  HN 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 190, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 12 CYM  HN 16 ASN HN 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 200, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 12 CYM  HN 17 LYS HN 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 214, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 12 CYM  HN 17 LYS QB 5.13
 &rst
  ixpk= 0, nxpk= 0, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 218, 219,
 &end
#
# 12 CYM  HN 18 VAL HA 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 238, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 12 CYM  HN 18 VAL QG1 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2= 242, 243, 244,
 &end
#
# 12 CYM  HN 18 VAL QG2 5.39
 &rst
  ixpk= 0, nxpk= 0, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2= 246, 247, 248,
 &end
#
# 12 CYM  HN 19 PHE QD 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 260, 268,
 &end
#
# 12 CYM  HN 19 PHE QE 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 262, 266,
 &end
#
# 12 CYM  HN 25 LEU QD1 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 373, 374, 375,
 &end
#
# 13 GLU HA 13 GLU HG2 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 161, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 13 GLU HA 13 GLU HG3 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 162, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 13 GLU HA 13 GLU QB 2.89
 &rst
  ixpk= 0, nxpk= 0, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 158, 159,
 &end
#
# 13 GLU HA 15 CYM  HN 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 190, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 13 GLU HG2 14 TYR QE 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 161,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 179, 184,
 &end
#
# 13 GLU HG3 14 TYR QE 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 179, 184,
 &end
#
# 13 GLU HN 13 GLU HG2 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 161, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 13 GLU HN 13 GLU HG3 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 162, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 13 GLU HN 13 GLU QB 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 158, 159,
 &end
#
# 13 GLU HN 13 GLU QG 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 161, 162,
 &end
#
# 13 GLU HN 14 TYR HN 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 169, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 13 GLU HN 14 TYR QD 4.72
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 177, 186,
 &end
#
# 13 GLU HN 15 CYM  HN 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 190, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 13 GLU HN 25 LEU QD1 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 373, 374, 375,
 &end
#
# 13 GLU HN 29 LEU QD2 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 440, 441, 442,
 &end
#
# 13 GLU QB 14 TYR HN 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 158, 159,
 &end
#
# 13 GLU QB 14 TYR QD 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 158, 159,
 igr2= 177, 186,
 &end
#
# 13 GLU QB 14 TYR QE 4.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 158, 159,
 igr2= 179, 184,
 &end
#
# 13 GLU QG 14 TYR HN 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 161, 162,
 &end
#
# 13 GLU QG 14 TYR QD 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 161, 162,
 igr2= 177, 186,
 &end
#
# 13 GLU QG 14 TYR QE 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 161, 162,
 igr2= 179, 184,
 &end
#
# 14 TYR HA 14 TYR QD 3.61
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 177, 186,
 &end
#
# 14 TYR HA 14 TYR QE 4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 179, 184,
 &end
#
# 14 TYR HB2 15 CYM  HN 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 173, 190, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 14 TYR HB2 16 ASN HN 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 173, 200, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 14 TYR HB2 32 HIS HD2 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 173, 502, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 14 TYR HB2 32 HIS HE1 4.72
 &rst
  ixpk= 0, nxpk= 0, iat= 173, 499, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 14 TYR HB3 15 CYM  HN 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 190, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 14 TYR HB3 32 HIS HD2 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 502, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 14 TYR HB3 32 HIS HE1 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 499, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 14 TYR HN 14 TYR HB2 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 173, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
# 14 TYR HN 14 TYR HB3 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 174, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 14 TYR HN 14 TYR QD 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 177, 186,
 &end
#
# 14 TYR HN 14 TYR QE 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 179, 184,
 &end
#
# 14 TYR HN 15 CYM  HN 3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 190, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 14 TYR HN 16 ASN HN 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 200, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 14 TYR HN 16 ASN QD2 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 209, 210,
 &end
#
# 14 TYR HN 25 LEU QD1 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 373, 374, 375,
 &end
#
# 14 TYR HN 29 LEU QD2 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 440, 441, 442,
 &end
#
# 14 TYR QD 15 CYM  HN 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 177, 186,
 &end
#
# 14 TYR QD 25 LEU QD1 4.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1= 177, 186,
 igr2= 373, 374, 375,
 &end
#
# 14 TYR QD 29 LEU HA 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 429, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 177, 186,
 &end
#
# 14 TYR QD 29 LEU QD1 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 177, 186,
 igr2= 436, 437, 438,
 &end
#
# 14 TYR QD 29 LEU QD2 3.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 177, 186,
 igr2= 440, 441, 442,
 &end
#
# 14 TYR QD 32 HIS HB2 4.56
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 177, 186,
 &end
#
# 14 TYR QD 32 HIS HB3 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 494, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 177, 186,
 &end
#
# 14 TYR QD 32 HIS HD2 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 502, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 177, 186,
 &end
#
# 14 TYR QE 29 LEU QD1 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 179, 184,
 igr2= 436, 437, 438,
 &end
#
# 14 TYR QE 29 LEU QD2 3.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1= 179, 184,
 igr2= 440, 441, 442,
 &end
#
# 14 TYR QE 32 HIS HB3 4.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 494, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 179, 184,
 &end
#
# 14 TYR QE 33 THR QG2 4.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr1= 179, 184,
 igr2= 512, 513, 514,
 &end
#
# 15 CYM  HA 16 ASN QB 4.81
 &rst
  ixpk= 0, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 204, 205,
 &end
#
# 15 CYM  HA 32 HIS HE1 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 499, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 15 CYM  HB2 16 ASN HN 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 200, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 15 CYM  HB2 32 HIS HE1 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 499, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 15 CYM  HB3 16 ASN HN 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 200, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 15 CYM  HB3 17 LYS QB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 194,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 218, 219,
 &end
#
# 15 CYM  HB3 31 ILE QD1 5.33
 &rst
  ixpk= 0, nxpk= 0, iat= 194,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 483, 484, 485,
 &end
#
# 15 CYM  HB3 32 HIS HE1 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 499, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
# 15 CYM  HN 15 CYM  HB2 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 195, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 15 CYM  HN 15 CYM  HB3 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 194, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 15 CYM  HN 16 ASN HA 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 202, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 15 CYM  HN 16 ASN QD2 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 209, 210,
 &end
#
# 15 CYM  HN 17 LYS HN 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 214, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 16 ASN HN 16 ASN HA 2.86
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 202, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
# 16 ASN HN 16 ASN QB 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 204, 205,
 &end
#
# 16 ASN HN 17 LYS HN 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 214, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 16 ASN HN 17 LYS QB 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 218, 219,
 &end
#
# 16 ASN QB 16 ASN HD21 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 209, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 204, 205,
 &end
#
# 16 ASN QB 16 ASN HD22 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 210, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 204, 205,
 &end
#
# 16 ASN QB 16 ASN QD2 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 204, 205,
 igr2= 209, 210,
 &end
#
# 16 ASN QB 17 LYS HA 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 204, 205,
 &end
#
# 16 ASN QB 17 LYS HN 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 204, 205,
 &end
#
# 16 ASN QB 18 VAL QG1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205,
 igr2= 242, 243, 244,
 &end
#
# 17 LYS HA 17 LYS HG2 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 221, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 17 LYS HA 17 LYS HG3 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 222, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 17 LYS HA 17 LYS QD 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 224, 225,
 &end
#
# 17 LYS HA 17 LYS QE 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 227, 228,
 &end
#
# 17 LYS HA 18 VAL HN 2.72
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 236, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
# 17 LYS HA 18 VAL QG1 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 242, 243, 244,
 &end
#
# 17 LYS HA 18 VAL QG2 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2= 246, 247, 248,
 &end
#
# 17 LYS HB2 18 VAL HN 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 236, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 17 LYS HB2 19 PHE HZ 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 264, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 17 LYS HB2 19 PHE QE 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 262, 266,
 &end
#
# 17 LYS HB3 18 VAL HN 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 236, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 17 LYS HB3 19 PHE HZ 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 264, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 17 LYS HB3 19 PHE QE 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 219,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 262, 266,
 &end
#
# 17 LYS HD2 19 PHE HZ 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 224, 264, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 17 LYS HD2 28 HIS HE1 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 224, 420, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 17 LYS HD3 19 PHE HZ 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 225, 264, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 17 LYS HD3 28 HIS HE1 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 225, 420, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 17 LYS HG2 17 LYS HE2 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 227, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 17 LYS HG2 17 LYS HE3 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 228, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 17 LYS HG2 18 VAL HN 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 236, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 17 LYS HG3 17 LYS HE2 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 222, 227, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 17 LYS HG3 17 LYS HE3 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 222, 228, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 17 LYS HG3 18 VAL HN 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 222, 236, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 17 LYS HN 17 LYS HB2 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 218, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
# 17 LYS HN 17 LYS HB3 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 219, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
# 17 LYS HN 17 LYS HG2 4.74
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 221, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 17 LYS HN 17 LYS HG3 4.74
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 222, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 17 LYS HN 17 LYS QB 2.83
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2= 218, 219,
 &end
#
# 17 LYS HN 17 LYS QD 5.11
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 224, 225,
 &end
#
# 17 LYS HN 18 VAL HN 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 236, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 17 LYS HN 18 VAL QG1 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr2= 242, 243, 244,
 &end
#
# 17 LYS HN 19 PHE QE 4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr2= 262, 266,
 &end
#
# 17 LYS QB 17 LYS QD 3.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1= 218, 219,
 igr2= 224, 225,
 &end
#
# 17 LYS QB 17 LYS QE 5.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 218, 219,
 igr2= 227, 228,
 &end
#
# 17 LYS QB 18 VAL HN 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1= 218, 219,
 &end
#
# 17 LYS QB 18 VAL QG2 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1= 218, 219,
 igr2= 246, 247, 248,
 &end
#
# 17 LYS QB 19 PHE HZ 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 218, 219,
 &end
#
# 17 LYS QB 19 PHE QE 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 218, 219,
 igr2= 262, 266,
 &end
#
# 17 LYS QD 19 PHE HZ 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr1= 224, 225,
 &end
#
# 17 LYS QD 19 PHE QE 4.99
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1= 224, 225,
 igr2= 262, 266,
 &end
#
# 17 LYS QD 28 HIS HE1 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 420, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 224, 225,
 &end
#
# 17 LYS QE 19 PHE QE 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 227, 228,
 igr2= 262, 266,
 &end
#
# 17 LYS QG 17 LYS QE 3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 221, 222,
 igr2= 227, 228,
 &end
#
# 17 LYS QG 18 VAL HN 3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 221, 222,
 &end
#
# 17 LYS QG 18 VAL QG2 4.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 221, 222,
 igr2= 246, 247, 248,
 &end
#
# 18 VAL HA 18 VAL QG1 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 242, 243, 244,
 &end
#
# 18 VAL HA 18 VAL QG2 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 246, 247, 248,
 &end
#
# 18 VAL HA 19 PHE HN 2.93
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 252, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
# 18 VAL HB 19 PHE HN 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 252, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 18 VAL HN 18 VAL HB 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 18 VAL HN 18 VAL QG1 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 242, 243, 244,
 &end
#
# 18 VAL HN 18 VAL QG2 3.13
 &rst
  ixpk= 0, nxpk= 0, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 246, 247, 248,
 &end
#
# 18 VAL HN 19 PHE HN 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 252, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 18 VAL QG1 19 PHE HN 3.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 242, 243, 244,
 &end
#
# 18 VAL QG2 19 PHE HN 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 246, 247, 248,
 &end
#
# 19 PHE HA 19 PHE QD 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 260, 268,
 &end
#
# 19 PHE HA 21 PHE HN 4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 254, 294, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 19 PHE HB2 20 LYS QG 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 256,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 279, 280,
 &end
#
# 19 PHE HB2 21 PHE HN 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 294, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 19 PHE HB2 24 SER HB2 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 357, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 19 PHE HB2 24 SER HB3 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 358, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 19 PHE HB2 25 LEU HA 4.94
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 366, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 19 PHE HB2 25 LEU HB2 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 368, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 19 PHE HB2 25 LEU HB3 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 369, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 19 PHE HB2 25 LEU HN 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 364, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 19 PHE HB2 25 LEU QD1 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 256,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 373, 374, 375,
 &end
#
# 19 PHE HB3 20 LYS HB2 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 276, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 19 PHE HB3 20 LYS QG 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 279, 280,
 &end
#
# 19 PHE HB3 21 PHE HN 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 294, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 19 PHE HB3 24 SER HB2 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 357, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 19 PHE HB3 24 SER HB3 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 358, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 19 PHE HB3 25 LEU HA 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 366, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 19 PHE HB3 25 LEU HB2 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 368, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 19 PHE HB3 25 LEU HN 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 364, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 19 PHE HN 19 PHE HB2 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 256, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 19 PHE HN 19 PHE HB3 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 257, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 19 PHE HN 19 PHE QD 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 252,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2= 260, 268,
 &end
#
# 19 PHE HN 19 PHE QE 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 252,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 262, 266,
 &end
#
# 19 PHE HZ 25 LEU QD1 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 373, 374, 375,
 &end
#
# 19 PHE HZ 28 HIS HB2 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 414, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 19 PHE HZ 28 HIS HB3 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 415, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 19 PHE HZ 28 HIS HD2 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 423, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 19 PHE HZ 28 HIS HE1 4.75
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 420, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 19 PHE QD 19 PHE HZ 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 24 SER HA 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 24 SER HB2 3.99
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 24 SER HB3 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 25 LEU HA 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 25 LEU HB2 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 25 LEU HB3 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 25 LEU HN 4.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 260, 268,
 &end
#
# 19 PHE QD 25 LEU QD1 3.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 260, 268,
 igr2= 373, 374, 375,
 &end
#
# 19 PHE QD 25 LEU QD2 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 260, 268,
 igr2= 377, 378, 379,
 &end
#
# 19 PHE QD 28 HIS HB2 5.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 260, 268,
 &end
#
# 19 PHE QE 25 LEU HA 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 262, 266,
 &end
#
# 19 PHE QE 25 LEU QD1 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 262, 266,
 igr2= 373, 374, 375,
 &end
#
# 19 PHE QE 25 LEU QD2 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 262, 266,
 igr2= 377, 378, 379,
 &end
#
# 19 PHE QE 28 HIS HB2 4.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 262, 266,
 &end
#
# 19 PHE QE 28 HIS HB3 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 262, 266,
 &end
#
# 19 PHE QE 28 HIS HD2 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 262, 266,
 &end
#
# 20 LYS HA 20 LYS HG2 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 279, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 20 LYS HA 20 LYS HG3 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 280, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 20 LYS HA 20 LYS QD 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 282, 283,
 &end
#
# 20 LYS HA 20 LYS QG 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 279, 280,
 &end
#
# 20 LYS HB2 21 PHE HN 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 294, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 20 LYS HB2 21 PHE QD 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 302, 310,
 &end
#
# 20 LYS HB2 24 SER HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 358, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 LYS HB3 20 LYS QE 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 285, 286,
 &end
#
# 20 LYS HB3 21 PHE HN 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 294, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 20 LYS HB3 21 PHE QD 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 302, 310,
 &end
#
# 20 LYS HB3 21 PHE QE 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr2= 304, 308,
 &end
#
# 20 LYS HG2 20 LYS QE 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 285, 286,
 &end
#
# 20 LYS HG3 20 LYS QE 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 280,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 285, 286,
 &end
#
# 20 LYS HN 21 PHE HN 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 294, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 20 LYS QD 21 PHE QD 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 282, 283,
 igr2= 302, 310,
 &end
#
# 20 LYS QD 21 PHE QE 5.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
 igr1= 282, 283,
 igr2= 304, 308,
 &end
#
# 20 LYS QE 21 PHE QE 5.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr1= 285, 286,
 igr2= 304, 308,
 &end
#
# 20 LYS QG 20 LYS QE 3.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 279, 280,
 igr2= 285, 286,
 &end
#
# 20 LYS QG 21 PHE HN 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 279, 280,
 &end
#
# 21 PHE HA 21 PHE QD 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 302, 310,
 &end
#
# 21 PHE HB2 24 SER HB2 4.74
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 357, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 21 PHE HB2 24 SER HN 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 353, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 21 PHE HB3 24 SER HB2 4.74
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 357, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 21 PHE HB3 24 SER HN 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 353, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 21 PHE HN 21 PHE HB2 3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 298, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 21 PHE HN 21 PHE HB3 3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 299, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 21 PHE HN 21 PHE QB 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 298, 299,
 &end
#
# 21 PHE HN 21 PHE QD 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 302, 310,
 &end
#
# 21 PHE HN 24 SER HB2 3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 357, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 21 PHE HN 24 SER HB3 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 358, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 21 PHE HN 24 SER HN 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 353, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 21 PHE QB 23 HIS HD2 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 298, 299,
 &end
#
# 21 PHE QB 23 HIS HE1 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 298, 299,
 &end
#
# 21 PHE QB 24 SER HB2 4.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 298, 299,
 &end
#
# 21 PHE QB 24 SER HB3 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 298, 299,
 &end
#
# 21 PHE QB 24 SER HN 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 298, 299,
 &end
#
# 21 PHE QB 25 LEU HN 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 298, 299,
 &end
#
# 21 PHE QD 24 SER HN 4.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 302, 310,
 &end
#
# 22 LYS HA 22 LYS HG2 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 321, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 22 LYS HA 22 LYS HG3 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 322, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 22 LYS HA 25 LEU HB2 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 368, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 22 LYS HA 25 LEU HB3 3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 369, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 22 LYS HA 25 LEU HN 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 364, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 22 LYS HA 26 GLN HN 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 383, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 22 LYS HG2 23 HIS HA 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 22 LYS HG2 24 SER HN 5.27
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 353, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 22 LYS HG2 26 GLN HG2 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 390, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 22 LYS HG2 26 GLN HG3 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 391, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 22 LYS HG2 26 GLN HN 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 383, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 22 LYS HG3 26 GLN HG2 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 390, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 22 LYS HG3 26 GLN HG3 4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 391, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 22 LYS HG3 26 GLN QG 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 390, 391,
 &end
#
# 22 LYS QB 22 LYS QD 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 318, 319,
 igr2= 324, 325,
 &end
#
# 23 HIS HA 23 HIS HD2 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 349, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 23 HIS HA 25 LEU HN 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 364, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 HIS HA 26 GLN HB2 3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 387, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 23 HIS HA 26 GLN HB3 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 388, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 23 HIS HA 26 GLN HG2 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 390, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 23 HIS HA 26 GLN HG3 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 391, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 23 HIS HA 26 GLN HN 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 383, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 23 HIS HA 27 ALA HN 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 400, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 23 HIS HB2 24 SER HN 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 353, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 23 HIS HB3 24 SER HN 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 353, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 23 HIS HD2 24 SER HN 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 349, 353, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
# 23 HIS QB 24 SER HN 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 340, 341,
 &end
#
# 23 HIS QB 27 ALA HN 5.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 340, 341,
 &end
#
# 23 HIS QB 27 ALA QB 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 340, 341,
 igr2= 404, 405, 406,
 &end
#
# 24 SER HA 27 ALA HN 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 400, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 24 SER HA 27 ALA QB 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 404, 405, 406,
 &end
#
# 24 SER HB2 25 LEU HN 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 364, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 24 SER HB3 25 LEU HN 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 358, 364, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 24 SER HB3 26 GLN HN 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 358, 383, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 SER HB3 27 ALA QB 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 358,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 404, 405, 406,
 &end
#
# 24 SER HN 24 SER HB2 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 357, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 24 SER HN 24 SER HB3 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 358, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 24 SER HN 25 LEU HB3 5.22
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 369, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 24 SER HN 25 LEU HN 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 364, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
# 24 SER HN 26 GLN HN 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 383, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 25 LEU HA 25 LEU HG 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 371, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 25 LEU HA 25 LEU QD1 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 373, 374, 375,
 &end
#
# 25 LEU HA 27 ALA HN 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 400, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 25 LEU HA 27 ALA QB 5.12
 &rst
  ixpk= 0, nxpk= 0, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 404, 405, 406,
 &end
#
# 25 LEU HA 28 HIS HB2 3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 414, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 25 LEU HA 28 HIS HB3 3.56
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 415, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 25 LEU HA 28 HIS HD2 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 423, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 25 LEU HA 28 HIS HN 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 410, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 25 LEU HA 29 LEU HN 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 427, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 25 LEU HB2 25 LEU QD1 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 373, 374, 375,
 &end
#
# 25 LEU HB2 25 LEU QD2 3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr2= 377, 378, 379,
 &end
#
# 25 LEU HB2 26 GLN HN 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 383, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25 LEU HB3 25 LEU QD1 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 373, 374, 375,
 &end
#
# 25 LEU HB3 25 LEU QD2 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 377, 378, 379,
 &end
#
# 25 LEU HB3 26 GLN HN 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 383, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 25 LEU HB3 27 ALA HN 5.37
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 400, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 25 LEU HG 26 GLN HA 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 385, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 25 LEU HG 26 GLN HN 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 383, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 25 LEU HG 29 LEU HG 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 434, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 25 LEU HN 25 LEU HB2 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 368, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
# 25 LEU HN 25 LEU HB3 3.17
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 369, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
# 25 LEU HN 25 LEU HG 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 371, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 25 LEU HN 25 LEU QD1 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 373, 374, 375,
 &end
#
# 25 LEU HN 25 LEU QD2 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 377, 378, 379,
 &end
#
# 25 LEU HN 26 GLN HN 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 383, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 25 LEU HN 26 GLN QG 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 390, 391,
 &end
#
# 25 LEU HN 27 ALA HN 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 400, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 25 LEU HN 28 HIS HN 4.81
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 410, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 25 LEU QD1 26 GLN HA 5.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 26 GLN HN 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 28 HIS HA 5.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 28 HIS HB2 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 28 HIS HB3 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 28 HIS HD2 3.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 28 HIS HN 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 29 LEU HA 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 429, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 29 LEU HG 3.56
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 434, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 29 LEU HN 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 373, 374, 375,
 &end
#
# 25 LEU QD1 29 LEU QD2 3.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 373, 374, 375,
 igr2= 440, 441, 442,
 &end
#
# 25 LEU QD2 26 GLN HA 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 377, 378, 379,
 &end
#
# 25 LEU QD2 26 GLN HN 4.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 377, 378, 379,
 &end
#
# 26 GLN HA 26 GLN HG2 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 390, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 26 GLN HA 26 GLN HG3 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 391, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 26 GLN HA 26 GLN QG 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 390, 391,
 &end
#
# 26 GLN HA 27 ALA QB 5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 404, 405, 406,
 &end
#
# 26 GLN HA 28 HIS HN 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 410, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 26 GLN HA 29 LEU HB2 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 431, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 26 GLN HA 29 LEU HB3 5.07
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 432, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 26 GLN HA 29 LEU HG 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 434, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 26 GLN HA 29 LEU HN 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 427, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 26 GLN HA 29 LEU QD1 3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 436, 437, 438,
 &end
#
# 26 GLN HA 29 LEU QD2 4.19
 &rst
  ixpk= 0, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 440, 441, 442,
 &end
#
# 26 GLN HA 30 ARG HN 5.38
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 446, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 26 GLN HB2 27 ALA HN 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 400, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 26 GLN HB2 27 ALA QB 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 404, 405, 406,
 &end
#
# 26 GLN HB2 29 LEU QD1 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 436, 437, 438,
 &end
#
# 26 GLN HB3 27 ALA HN 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 388, 400, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 26 GLN HB3 27 ALA QB 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 404, 405, 406,
 &end
#
# 26 GLN HB3 29 LEU QD1 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 436, 437, 438,
 &end
#
# 26 GLN HN 26 GLN HB2 3.18
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 387, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
# 26 GLN HN 26 GLN HB3 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 388, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 26 GLN HN 26 GLN HG2 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 390, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 26 GLN HN 26 GLN HG3 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 391, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 26 GLN HN 27 ALA HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 26 GLN HN 27 ALA HN 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 400, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
# 26 GLN HN 27 ALA QB 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2= 404, 405, 406,
 &end
#
# 26 GLN HN 28 HIS HB3 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 415, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 26 GLN HN 29 LEU QD1 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 436, 437, 438,
 &end
#
# 26 GLN HN 29 LEU QD2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 440, 441, 442,
 &end
#
# 26 GLN QG 27 ALA HN 4.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 390, 391,
 &end
#
# 26 GLN QG 29 LEU QD1 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 390, 391,
 igr2= 436, 437, 438,
 &end
#
# 27 ALA HA 29 LEU HN 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 427, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 27 ALA HA 30 ARG HG2 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 453, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 27 ALA HA 30 ARG HG3 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 454, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 27 ALA HA 30 ARG HN 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 446, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 27 ALA HA 30 ARG QD 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 456, 457,
 &end
#
# 27 ALA HA 30 ARG QG 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 453, 454,
 &end
#
# 27 ALA HN 27 ALA QB 2.81
 &rst
  ixpk= 0, nxpk= 0, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2= 404, 405, 406,
 &end
#
# 27 ALA HN 28 HIS HB2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 ALA HN 28 HIS HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 415, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 ALA HN 29 LEU QD1 5.22
 &rst
  ixpk= 0, nxpk= 0, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2= 436, 437, 438,
 &end
#
# 27 ALA QB 28 HIS HA 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 28 HIS HB2 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 28 HIS HB3 5.22
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 28 HIS HN 3.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 29 LEU HG 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 434, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 30 ARG HB2 5.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 450, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 30 ARG HN 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 404, 405, 406,
 &end
#
# 27 ALA QB 30 ARG QD 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 404, 405, 406,
 igr2= 456, 457,
 &end
#
# 27 ALA QB 30 ARG QG 5.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 404, 405, 406,
 igr2= 453, 454,
 &end
#
# 27 ALA QB 31 ILE QG2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 404, 405, 406,
 igr2= 476, 477, 478,
 &end
#
# 28 HIS HA 28 HIS HD2 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 423, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 28 HIS HA 30 ARG HN 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 446, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 28 HIS HA 31 ILE HN 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 470, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 28 HIS HA 31 ILE QD1 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 483, 484, 485,
 &end
#
# 28 HIS HA 31 ILE QG2 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 476, 477, 478,
 &end
#
# 28 HIS HB2 29 LEU HN 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 427, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 28 HIS HB2 31 ILE QD1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 483, 484, 485,
 &end
#
# 28 HIS HB3 28 HIS HD2 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 423, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 28 HIS HB3 29 LEU HN 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 427, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 28 HIS HB3 29 LEU QD2 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 440, 441, 442,
 &end
#
# 28 HIS HD2 29 LEU HA 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 429, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 28 HIS HD2 29 LEU HG 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 434, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 28 HIS HD2 29 LEU HN 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 427, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 28 HIS HD2 29 LEU QD2 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 440, 441, 442,
 &end
#
# 28 HIS HD2 32 HIS HD2 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 502, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 28 HIS HE1 31 ILE QD1 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 420,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 483, 484, 485,
 &end
#
# 28 HIS HE1 31 ILE QG1 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 420,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 480, 481,
 &end
#
# 28 HIS HE1 31 ILE QG2 5.20
 &rst
  ixpk= 0, nxpk= 0, iat= 420,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 476, 477, 478,
 &end
#
# 28 HIS HN 28 HIS HB2 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 414, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 28 HIS HN 28 HIS HB3 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 415, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 28 HIS HN 28 HIS HD2 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 423, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 28 HIS HN 29 LEU HB2 5.13
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 431, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 28 HIS HN 29 LEU HG 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 434, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 28 HIS HN 29 LEU HN 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 427, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 28 HIS HN 30 ARG HN 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 446, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 29 LEU HA 29 LEU HG 3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 434, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 29 LEU HA 29 LEU QD1 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 429,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 436, 437, 438,
 &end
#
# 29 LEU HA 29 LEU QD2 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 429,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 440, 441, 442,
 &end
#
# 29 LEU HA 31 ILE HN 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 470, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 29 LEU HA 32 HIS HB2 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 493, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 29 LEU HA 32 HIS HB3 4.89
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 494, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 29 LEU HA 32 HIS HD2 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 502, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
# 29 LEU HA 32 HIS HN 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 489, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 29 LEU HB2 29 LEU QD1 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 436, 437, 438,
 &end
#
# 29 LEU HB2 29 LEU QD2 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 440, 441, 442,
 &end
#
# 29 LEU HB2 30 ARG HN 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 446, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 29 LEU HB3 29 LEU QD1 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 436, 437, 438,
 &end
#
# 29 LEU HB3 29 LEU QD2 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2= 440, 441, 442,
 &end
#
# 29 LEU HB3 30 ARG HN 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 446, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 29 LEU HB3 33 THR QG2 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 512, 513, 514,
 &end
#
# 29 LEU HG 30 ARG HN 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 446, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 29 LEU HN 29 LEU HB2 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 431, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 29 LEU HN 29 LEU HB3 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 432, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
# 29 LEU HN 29 LEU HG 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 434, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 29 LEU HN 29 LEU QD1 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 436, 437, 438,
 &end
#
# 29 LEU HN 29 LEU QD2 3.56
 &rst
  ixpk= 0, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 440, 441, 442,
 &end
#
# 29 LEU HN 30 ARG HB2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 450, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 LEU HN 30 ARG HN 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 446, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 29 LEU HN 30 ARG QG 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 453, 454,
 &end
#
# 29 LEU HN 31 ILE HN 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 470, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 29 LEU HN 32 HIS HD2 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 502, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 29 LEU QD1 30 ARG HN 4.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 436, 437, 438,
 &end
#
# 29 LEU QD2 30 ARG HN 5.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr1= 440, 441, 442,
 &end
#
# 29 LEU QD2 32 HIS HB2 4.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 440, 441, 442,
 &end
#
# 29 LEU QD2 32 HIS HB3 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 494, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 440, 441, 442,
 &end
#
# 29 LEU QD2 32 HIS HD2 3.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 502, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 440, 441, 442,
 &end
#
# 29 LEU QD2 32 HIS HN 4.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 440, 441, 442,
 &end
#
# 30 ARG HA 30 ARG HG2 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 453, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 30 ARG HA 30 ARG HG3 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 454, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 30 ARG HA 30 ARG QD 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 456, 457,
 &end
#
# 30 ARG HA 30 ARG QG 3.17
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 453, 454,
 &end
#
# 30 ARG HA 32 HIS HN 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 489, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 30 ARG HA 33 THR HN 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 506, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 30 ARG HA 33 THR QG2 4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 512, 513, 514,
 &end
#
# 30 ARG HB2 30 ARG QD 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 456, 457,
 &end
#
# 30 ARG HB2 31 ILE HN 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 470, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 30 ARG HB2 31 ILE QG2 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 476, 477, 478,
 &end
#
# 30 ARG HB3 30 ARG QD 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 456, 457,
 &end
#
# 30 ARG HB3 31 ILE HN 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 451, 470, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 30 ARG HB3 33 THR QG2 4.86
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 512, 513, 514,
 &end
#
# 30 ARG HN 30 ARG HB2 3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 450, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30 ARG HN 30 ARG HB3 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 451, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 30 ARG HN 30 ARG HG2 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 453, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 30 ARG HN 30 ARG HG3 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 30 ARG HN 30 ARG QD 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 456, 457,
 &end
#
# 30 ARG HN 30 ARG QG 3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 453, 454,
 &end
#
# 30 ARG HN 31 ILE HN 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 470, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 30 ARG HN 31 ILE QG2 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 476, 477, 478,
 &end
#
# 30 ARG HN 32 HIS HN 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 446, 489, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 30 ARG HN 33 THR QG2 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 512, 513, 514,
 &end
#
# 31 ILE HA 31 ILE QD1 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 472,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 483, 484, 485,
 &end
#
# 31 ILE HA 31 ILE QG1 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 472,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 480, 481,
 &end
#
# 31 ILE HA 31 ILE QG2 3.17
 &rst
  ixpk= 0, nxpk= 0, iat= 472,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 476, 477, 478,
 &end
#
# 31 ILE HB 31 ILE QD1 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 483, 484, 485,
 &end
#
# 31 ILE HB 32 HIS HN 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 489, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 31 ILE HG12 32 HIS HN 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 480, 489, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 31 ILE HG13 32 HIS HN 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 481, 489, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 31 ILE HN 31 ILE HB 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 474, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 31 ILE HN 31 ILE QD1 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 470,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 483, 484, 485,
 &end
#
# 31 ILE HN 31 ILE QG1 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 470,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 480, 481,
 &end
#
# 31 ILE HN 31 ILE QG2 3.18
 &rst
  ixpk= 0, nxpk= 0, iat= 470,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 476, 477, 478,
 &end
#
# 31 ILE HN 32 HIS HA 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 491, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 31 ILE HN 32 HIS HB2 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 493, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31 ILE HN 32 HIS HD2 5.42
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 502, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 31 ILE HN 32 HIS HN 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 489, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 31 ILE QG1 32 HIS HN 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 480, 481,
 &end
#
# 31 ILE QG1 33 THR HN 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 506, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 480, 481,
 &end
#
# 31 ILE QG2 31 ILE QG1 3.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr1= 476, 477, 478,
 igr2= 480, 481,
 &end
#
# 31 ILE QG2 32 HIS HN 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 476, 477, 478,
 &end
#
# 32 HIS HB2 32 HIS HD2 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 502, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 32 HIS HB2 33 THR HN 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 506, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 32 HIS HB2 33 THR QG2 4.75
 &rst
  ixpk= 0, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr2= 512, 513, 514,
 &end
#
# 32 HIS HB3 33 THR HN 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 506, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 32 HIS HB3 33 THR QG2 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 494,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 512, 513, 514,
 &end
#
# 32 HIS HD2 33 THR HN 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 502, 506, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 HIS HN 32 HIS HB2 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 493, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
# 32 HIS HN 32 HIS HB3 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 494, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 HIS HN 32 HIS HD2 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 502, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 32 HIS HN 33 THR HA 5.29
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 508, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 32 HIS HN 33 THR HN 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 506, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 32 HIS HN 33 THR QG2 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 489,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 512, 513, 514,
 &end
#
# 33 THR HA 33 THR QG2 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 508,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2= 512, 513, 514,
 &end
#
# 33 THR HN 33 THR HB 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 506, 510, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 33 THR HN 33 THR QG2 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 506,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 512, 513, 514,
 &end
#
# 35 GLU HA 35 GLU QG 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 536,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 541, 542,
 &end
#
# 35 GLU HA 36 LYS HN 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 536, 549, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 35 GLU HB2 36 LYS HN 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 538, 549, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 35 GLU HB3 36 LYS HN 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 549, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 35 GLU HN 35 GLU QG 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 541, 542,
 &end
#
# 35 GLU QG 36 LYS HN 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 541, 542,
 &end
#
# 36 LYS HN 36 LYS QB 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 549,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 553, 554,
 &end
#
# 36 LYS HN 36 LYS QG 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 549,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 556, 557,
 &end
# 571 atoms read from pdb file leap.pdb.
# 10 PHE PHI:  (9 ILE C)-(10 PHE N)-(10 PHE CA)-(10 PHE C) -139.0 -79.0
 &rst     iat =   107,   109,   111,   127,
   r1 = -140.0, r2 = -139.0, r3 = -79.0, r4 = -78.0,
   rk2 = 60.0, rk3 = 60.0,    &end
# 10 PHE PSI:  (10 PHE N)-(10 PHE CA)-(10 PHE C)-(11 THR N)  80.0 140.0
 &rst     iat =   109,   111,   127,   129,
   r1 =  79.0, r2 =  80.0, r3 = 140.0, r4 = 141.0,
 &end
# 11 THR PHI:  (10 PHE C)-(11 THR N)-(11 THR CA)-(11 THR C) -145.0 -85.0
 &rst     iat =   127,   129,   131,   141,
   r1 = -146.0, r2 = -145.0, r3 = -85.0, r4 = -84.0,
 &end
# 11 THR PSI:  (11 THR N)-(11 THR CA)-(11 THR C)-(12 CYM N) 112.0 172.0
 &rst     iat =   129,   131,   141,   143,
   r1 = 111.0, r2 = 112.0, r3 = 172.0, r4 = 173.0,
 &end
# 18 VAL PHI:  (17 LYS C)-(18 VAL N)-(18 VAL CA)-(18 VAL C) -145.0 -85.0
 &rst     iat =   233,   235,   237,   249,
   r1 = -146.0, r2 = -145.0, r3 = -85.0, r4 = -84.0,
 &end
# 18 VAL PSI:  (18 VAL N)-(18 VAL CA)-(18 VAL C)-(19 PHE N) 112.0 172.0
 &rst     iat =   235,   237,   249,   251,
   r1 = 111.0, r2 = 112.0, r3 = 172.0, r4 = 173.0,
 &end
# 19 PHE PHI:  (18 VAL C)-(19 PHE N)-(19 PHE CA)-(19 PHE C) -146.1 -86.1
 &rst     iat =   249,   251,   253,   269,
   r1 = -147.1, r2 = -146.1, r3 = -86.1, r4 = -85.1,
 &end
# 19 PHE PSI:  (19 PHE N)-(19 PHE CA)-(19 PHE C)-(20 LYS N) 116.3 176.3
 &rst     iat =   251,   253,   269,   271,
   r1 = 115.3, r2 = 116.3, r3 = 176.3, r4 = 177.3,
 &end
# 23 HIS PHI:  (22 LYS C)-(23 HID N)-(23 HID CA)-(23 HID C) -95.8 -35.8
 &rst     iat =   333,   335,   337,   350,
   r1 = -96.8, r2 = -95.8, r3 = -35.8, r4 = -34.8,
 &end
# 23 HIS PSI:  (23 HID N)-(23 HID CA)-(23 HID C)-(24 SER N) -67.7  -7.7
 &rst     iat =   335,   337,   350,   352,
   r1 = -68.7, r2 = -67.7, r3 =  -7.7, r4 =  -6.7,
 &end
# 24 SER PHI:  (23 HID C)-(24 SER N)-(24 SER CA)-(24 SER C) -96.7 -36.7
 &rst     iat =   350,   352,   354,   361,
   r1 = -97.7, r2 = -96.7, r3 = -36.7, r4 = -35.7,
 &end
# 24 SER PSI:  (24 SER N)-(24 SER CA)-(24 SER C)-(25 LEU N) -68.5  -8.5
 &rst     iat =   352,   354,   361,   363,
   r1 = -69.5, r2 = -68.5, r3 =  -8.5, r4 =  -7.5,
 &end
# 25 LEU PHI:  (24 SER C)-(25 LEU N)-(25 LEU CA)-(25 LEU C) -98.4 -38.4
 &rst     iat =   361,   363,   365,   380,
   r1 = -99.4, r2 = -98.4, r3 = -38.4, r4 = -37.4,
 &end
# 25 LEU PSI:  (25 LEU N)-(25 LEU CA)-(25 LEU C)-(26 GLN N) -66.8  -6.8
 &rst     iat =   363,   365,   380,   382,
   r1 = -67.8, r2 = -66.8, r3 =  -6.8, r4 =  -5.8,
 &end
# 26 GLN PHI:  (25 LEU C)-(26 GLN N)-(26 GLN CA)-(26 GLN C) -91.0 -31.0
 &rst     iat =   380,   382,   384,   397,
   r1 = -92.0, r2 = -91.0, r3 = -31.0, r4 = -30.0,
 &end
# 26 GLN PSI:  (26 GLN N)-(26 GLN CA)-(26 GLN C)-(27 ALA N) -71.1 -11.1
 &rst     iat =   382,   384,   397,   399,
   r1 = -72.1, r2 = -71.1, r3 = -11.1, r4 = -10.1,
 &end
# 27 ALA PHI:  (26 GLN C)-(27 ALA N)-(27 ALA CA)-(27 ALA C) -94.0 -34.0
 &rst     iat =   397,   399,   401,   407,
   r1 = -95.0, r2 = -94.0, r3 = -34.0, r4 = -33.0,
 &end
# 27 ALA PSI:  (27 ALA N)-(27 ALA CA)-(27 ALA C)-(28 HID N) -71.7 -11.7
 &rst     iat =   399,   401,   407,   409,
   r1 = -72.7, r2 = -71.7, r3 = -11.7, r4 = -10.7,
 &end
# 28 HIS PHI:  (27 ALA C)-(28 HID N)-(28 HID CA)-(28 HID C) -94.1 -34.1
 &rst     iat =   407,   409,   411,   424,
   r1 = -95.1, r2 = -94.1, r3 = -34.1, r4 = -33.1,
 &end
# 28 HIS PSI:  (28 HID N)-(28 HID CA)-(28 HID C)-(29 LEU N) -68.5  -8.5
 &rst     iat =   409,   411,   424,   426,
   r1 = -69.5, r2 = -68.5, r3 =  -8.5, r4 =  -7.5,
 &end
# 29 LEU PHI:  (28 HID C)-(29 LEU N)-(29 LEU CA)-(29 LEU C) -93.8 -33.8
 &rst     iat =   424,   426,   428,   443,
   r1 = -94.8, r2 = -93.8, r3 = -33.8, r4 = -32.8,
 &end
# 29 LEU PSI:  (29 LEU N)-(29 LEU CA)-(29 LEU C)-(30 ARG N) -69.7  -9.7
 &rst     iat =   426,   428,   443,   445,
   r1 = -70.7, r2 = -69.7, r3 =  -9.7, r4 =  -8.7,
 &end
# 30 ARG PHI:  (29 LEU C)-(30 ARG N)-(30 ARG CA)-(30 ARG C) -93.9 -33.9
 &rst     iat =   443,   445,   447,   467,
   r1 = -94.9, r2 = -93.9, r3 = -33.9, r4 = -32.9,
 &end
# 30 ARG PSI:  (30 ARG N)-(30 ARG CA)-(30 ARG C)-(31 ILE N) -68.0  -8.0
 &rst     iat =   445,   447,   467,   469,
   r1 = -69.0, r2 = -68.0, r3 =  -8.0, r4 =  -7.0,
 &end
# 31 ILE PHI:  (30 ARG C)-(31 ILE N)-(31 ILE CA)-(31 ILE C) -102.0 -42.0
 &rst     iat =   467,   469,   471,   486,
   r1 = -103.0, r2 = -102.0, r3 = -42.0, r4 = -41.0,
 &end
# 31 ILE PSI:  (31 ILE N)-(31 ILE CA)-(31 ILE C)-(32 HID N) -63.0  -3.0
 &rst     iat =   469,   471,   486,   488,
   r1 = -64.0, r2 = -63.0, r3 =  -3.0, r4 =  -2.0,
 &end
# 32 HIS PHI:  (31 ILE C)-(32 HID N)-(32 HID CA)-(32 HID C) -113.8 -53.8
 &rst     iat =   486,   488,   490,   503,
   r1 = -114.8, r2 = -113.8, r3 = -53.8, r4 = -52.8,
 &end
# 32 HIS PSI:  (32 HID N)-(32 HID CA)-(32 HID C)-(33 THR N) -50.6   9.4
 &rst     iat =   488,   490,   503,   505,
   r1 = -51.6, r2 = -50.6, r3 =   9.4, r4 =  10.4,
 &end
#
#  12 CYM  SG   15 CYM  SG   3.56  3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 196, r1= 3.06, r2= 3.56, r3= 3.96, r4= 4.46, 
      rk2=1000, rk3=1000, ir6=1, ialtd=0,
 &end
#
#  12 CYM  SG   28 HID NE2   3.32  3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 421, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22,  &end
#
#  12 CYM  SG   32 HID NE2   3.32  3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 500, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22,  &end
#
#  12 CYM  CB   37  Zn  Zn   3.25  3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 147, 571, r1= 2.75, r2= 3.25, r3= 3.51, r4= 4.01,  &end
#
#  12 CYM  SG   37  Zn  Zn   2.19  2.39
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 571, r1= 1.69, r2= 2.19, r3= 2.39, r4= 2.89,  &end
#
#  15 CYM  SG   28 HID NE2   3.32  3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 196, 421, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22,  &end
#
#  15 CYM  SG   32 HID NE2   3.32  3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 196, 500, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22,  &end
#
#  15 CYM  CB   37  Zn  Zn   3.25  3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 193, 571, r1= 2.75, r2= 3.25, r3= 3.51, r4= 4.01,  &end
#
#  15 CYM  SG   37  Zn  Zn   2.19  2.39
 &rst
  ixpk= 0, nxpk= 0, iat= 196, 571, r1= 1.69, r2= 2.19, r3= 2.39, r4= 2.89,  &end
#
#  28 HID NE2   32 HID NE2   3.00  3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 500, r1= 2.50, r2= 3.00, r3= 3.60, r4= 4.10,  &end
#
#  28 HID NE2   37  Zn  Zn   1.90  2.10
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 571, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60,  &end
#
#  32 HID NE2   37  Zn  Zn   1.90  2.10
 &rst
  ixpk= 0, nxpk= 0, iat= 500, 571, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60,  &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1H       GLY   1  22.825  -8.928  14.378
    2    H2   GLY   1           2H       GLY   1  23.420 -10.365  13.860
    3    H3   GLY   1           3H       GLY   1  21.937 -10.292  14.556
    4    HA2  GLY   1           1HA      GLY   1  22.675  -9.056  11.983
    5    HA3  GLY   1           2HA      GLY   1  21.730 -10.546  12.167
    6    H    SER   2           H        SER   2  20.943  -8.055  10.851
    7    HA   SER   2           HA       SER   2  19.154  -6.518  12.461
    8    HB2  SER   2           1HB      SER   2  19.141  -6.928   9.448
    9    HB3  SER   2           2HB      SER   2  18.338  -5.621  10.339
   10    HG   SER   2           HG       SER   2  20.388  -4.981   9.505
   11    H    SER   3           H        SER   3  16.909  -6.476  12.628
   12    HA   SER   3           HA       SER   3  15.542  -9.044  12.521
   13    HB2  SER   3           1HB      SER   3  13.696  -7.765  13.583
   14    HB3  SER   3           2HB      SER   3  15.246  -7.607  14.427
   15    HG   SER   3           HG       SER   3  14.179  -5.579  14.163
   16    H    GLY   4           H        GLY   4  15.830  -6.495  10.256
   17    HA2  GLY   4           1HA      GLY   4  14.190  -7.723   8.271
   18    HA3  GLY   4           2HA      GLY   4  13.306  -6.379   9.004
   19    H    SER   5           H        SER   5  13.460  -5.683   6.678
   20    HA   SER   5           HA       SER   5  15.855  -3.954   6.218
   21    HB2  SER   5           1HB      SER   5  14.439  -5.624   4.107
   22    HB3  SER   5           2HB      SER   5  15.753  -4.474   3.817
   23    HG   SER   5           HG       SER   5  17.114  -5.790   5.109
   24    H    SER   6           H        SER   6  15.498  -2.029   5.153
   25    HA   SER   6           HA       SER   6  12.748  -1.186   4.424
   26    HB2  SER   6           1HB      SER   6  14.458   0.148   6.561
   27    HB3  SER   6           2HB      SER   6  13.054   0.912   5.792
   28    HG   SER   6           HG       SER   6  12.573  -0.165   7.795
   29    H    GLY   7           H        GLY   7  12.692   0.908   3.361
   30    HA2  GLY   7           1HA      GLY   7  14.983   2.278   2.315
   31    HA3  GLY   7           2HA      GLY   7  14.418   1.072   1.150
   32    H    LYS   8           H        LYS   8  13.480   2.348  -0.395
   33    HA   LYS   8           HA       LYS   8  11.686   4.568   0.108
   34    HB2  LYS   8           1HB      LYS   8  13.008   4.159  -1.981
   35    HB3  LYS   8           2HB      LYS   8  11.960   2.803  -2.382
   36    HG2  LYS   8           1HG      LYS   8  10.828   5.585  -1.914
   37    HG3  LYS   8           2HG      LYS   8  11.600   5.176  -3.445
   38    HD2  LYS   8           1HD      LYS   8   9.987   3.390  -3.879
   39    HD3  LYS   8           2HD      LYS   8   9.221   3.655  -2.313
   40    HE2  LYS   8           1HE      LYS   8   8.948   6.133  -3.113
   41    HE3  LYS   8           2HE      LYS   8   9.254   5.484  -4.730
   42    HZ1  LYS   8           3HZ      LYS   8   6.883   5.515  -4.245
   43    HZ2  LYS   8           1HZ      LYS   8   7.097   4.662  -2.861
   44    HZ3  LYS   8           2HZ      LYS   8   7.351   3.944  -4.317
   45    H    ILE   9           H        ILE   9   9.540   4.652   0.352
   46    HA   ILE   9           HA       ILE   9   8.021   2.109   0.667
   47    HB   ILE   9           HB       ILE   9   6.807   3.333   2.531
   48   HG12  ILE   9          1HG1      ILE   9   8.102   5.009   3.798
   49   HG13  ILE   9          2HG1      ILE   9   9.259   5.160   2.496
   50   HG21  ILE   9          1HG2      ILE   9   8.409   1.493   2.865
   51   HG22  ILE   9          2HG2      ILE   9   9.742   2.665   2.951
   52   HG23  ILE   9          3HG2      ILE   9   8.465   2.671   4.182
   53   HD11  ILE   9          3HD1      ILE   9   7.531   6.986   2.609
   54   HD12  ILE   9          1HD1      ILE   9   7.579   6.168   1.045
   55   HD13  ILE   9          2HD1      ILE   9   6.283   5.788   2.209
   56    H    PHE  10           H        PHE  10   5.697   2.417   0.791
   57    HA   PHE  10           HA       PHE  10   4.623   4.295  -1.292
   58    HB2  PHE  10           1HB      PHE  10   4.167   1.312  -0.863
   59    HB3  PHE  10           2HB      PHE  10   3.131   2.303  -1.862
   60    HD1  PHE  10           2HD      PHE  10   6.528   0.845  -1.574
   61    HD2  PHE  10           1HD      PHE  10   3.817   3.121  -4.040
   62    HE1  PHE  10           2HE      PHE  10   8.026   0.513  -3.530
   63    HE2  PHE  10           1HE      PHE  10   5.307   2.776  -5.996
   64    HZ   PHE  10           HZ       PHE  10   7.394   1.452  -5.753
   65    H    THR  11           H        THR  11   3.004   5.552  -0.520
   66    HA   THR  11           HA       THR  11   1.797   4.861   2.119
   67    HB   THR  11           HB       THR  11   1.830   7.602   0.847
   68    HG1  THR  11           1HG      THR  11   3.691   7.999   2.004
   69   HG21  THR  11          3HG2      THR  11   1.595   6.561   3.711
   70   HG22  THR  11          1HG2      THR  11   0.342   7.396   2.758
   71   HG23  THR  11          2HG2      THR  11   1.783   8.276   3.282
   72    H    CYS  12           H        CYS  12  -0.310   4.631   2.420
   73    HA   CYS  12           HA       CYS  12  -2.260   4.676   0.295
   74    HB2  CYS  12           1HB      CYS  12  -2.273   3.147   2.229
   75    HB3  CYS  12           2HB      CYS  12  -2.493   4.528   3.320
   76    H    GLU  13           H        GLU  13  -3.334   6.332  -0.515
   77    HA   GLU  13           HA       GLU  13  -3.129   8.995   0.638
   78    HB2  GLU  13           1HB      GLU  13  -4.356   9.741  -1.293
   79    HB3  GLU  13           2HB      GLU  13  -3.101   8.607  -1.789
   80    HG2  GLU  13           1HG      GLU  13  -4.816   6.806  -1.975
   81    HG3  GLU  13           2HG      GLU  13  -6.067   7.964  -1.504
   82    H    TYR  14           H        TYR  14  -5.149   6.430   1.400
   83    HA   TYR  14           HA       TYR  14  -7.521   8.107   2.060
   84    HB2  TYR  14           1HB      TYR  14  -7.142   5.114   1.942
   85    HB3  TYR  14           2HB      TYR  14  -8.653   5.941   2.261
   86    HD1  TYR  14           1HD      TYR  14  -9.751   7.310   0.458
   87    HD2  TYR  14           2HD      TYR  14  -6.337   4.782  -0.331
   88    HE1  TYR  14           1HE      TYR  14 -10.296   7.329  -1.970
   89    HE2  TYR  14           2HE      TYR  14  -6.887   4.815  -2.760
   90    HH   TYR  14           HH       TYR  14  -9.709   6.592  -4.061
   91    H    CYS  15           H        CYS  15  -5.134   5.963   3.634
   92    HA   CYS  15           HA       CYS  15  -6.076   6.968   6.273
   93    HB2  CYS  15           1HB      CYS  15  -5.938   4.832   7.293
   94    HB3  CYS  15           2HB      CYS  15  -7.070   4.788   5.947
   95    H    ASN  16           H        ASN  16  -3.480   6.977   4.292
   96    HA   ASN  16           HA       ASN  16  -1.297   7.417   4.484
   97    HB2  ASN  16           1HB      ASN  16  -2.042   8.487   7.216
   98    HB3  ASN  16           2HB      ASN  16  -0.536   8.802   6.366
   99   HD21  ASN  16          1HD2      ASN  16  -3.983   9.545   6.430
  100   HD22  ASN  16          2HD2      ASN  16  -3.877  10.823   5.229
  101    H    LYS  17           H        LYS  17  -2.158   4.692   5.368
  102    HA   LYS  17           HA       LYS  17   0.016   3.737   7.070
  103    HB2  LYS  17           1HB      LYS  17  -2.174   2.565   6.872
  104    HB3  LYS  17           2HB      LYS  17  -1.830   2.212   5.175
  105    HG2  LYS  17           1HG      LYS  17   0.072   0.820   5.781
  106    HG3  LYS  17           2HG      LYS  17  -0.032   1.328   7.477
  107    HD2  LYS  17           1HD      LYS  17  -2.188   0.207   7.735
  108    HD3  LYS  17           2HD      LYS  17  -2.209  -0.227   6.014
  109    HE2  LYS  17           1HE      LYS  17  -0.149  -1.567   6.307
  110    HE3  LYS  17           2HE      LYS  17  -0.064  -1.094   8.008
  111    HZ1  LYS  17           3HZ      LYS  17  -2.262  -2.696   6.805
  112    HZ2  LYS  17           1HZ      LYS  17  -2.176  -2.250   8.376
  113    HZ3  LYS  17           2HZ      LYS  17  -1.076  -3.282   7.760
  114    H    VAL  18           H        VAL  18   1.926   2.840   6.436
  115    HA   VAL  18           HA       VAL  18   2.746   3.206   3.597
  116    HB   VAL  18           HB       VAL  18   5.122   3.222   4.658
  117   HG11  VAL  18          1HG1      VAL  18   5.065   5.649   4.752
  118   HG12  VAL  18          2HG1      VAL  18   4.108   5.048   3.392
  119   HG13  VAL  18          3HG1      VAL  18   3.292   5.627   4.868
  120   HG21  VAL  18          3HG2      VAL  18   4.338   2.811   7.019
  121   HG22  VAL  18          1HG2      VAL  18   5.295   4.291   6.815
  122   HG23  VAL  18          2HG2      VAL  18   3.532   4.404   6.965
  123    H    PHE  19           H        PHE  19   3.819   1.745   2.502
  124    HA   PHE  19           HA       PHE  19   4.316  -0.956   3.684
  125    HB2  PHE  19           1HB      PHE  19   3.226  -0.388   0.905
  126    HB3  PHE  19           2HB      PHE  19   3.516  -1.939   1.646
  127    HD1  PHE  19           2HD      PHE  19   1.351   1.122   1.914
  128    HD2  PHE  19           1HD      PHE  19   1.849  -3.040   2.912
  129    HE1  PHE  19           2HE      PHE  19  -0.937   1.083   2.884
  130    HE2  PHE  19           1HE      PHE  19  -0.461  -3.094   3.826
  131    HZ   PHE  19           HZ       PHE  19  -1.841  -1.028   3.830
  132    H    LYS  20           H        LYS  20   5.850  -2.254   2.522
  133    HA   LYS  20           HA       LYS  20   8.208  -0.713   1.691
  134    HB2  LYS  20           1HB      LYS  20   7.775  -3.709   2.057
  135    HB3  LYS  20           2HB      LYS  20   9.332  -2.903   1.825
  136    HG2  LYS  20           1HG      LYS  20   8.954  -1.597   3.919
  137    HG3  LYS  20           2HG      LYS  20   7.420  -2.455   4.165
  138    HD2  LYS  20           1HD      LYS  20   8.622  -4.614   4.257
  139    HD3  LYS  20           2HD      LYS  20  10.171  -3.794   4.039
  140    HE2  LYS  20           1HE      LYS  20   8.255  -3.218   6.346
  141    HE3  LYS  20           2HE      LYS  20   9.522  -4.446   6.425
  142    HZ1  LYS  20           3HZ      LYS  20  10.295  -2.351   7.360
  143    HZ2  LYS  20           1HZ      LYS  20  10.032  -1.556   5.964
  144    HZ3  LYS  20           2HZ      LYS  20  11.179  -2.725   6.047
  145    H    PHE  21           H        PHE  21   5.749  -2.479   0.017
  146    HA   PHE  21           HA       PHE  21   7.201  -2.200  -2.570
  147    HB2  PHE  21           1HB      PHE  21   5.603  -4.629  -1.673
  148    HB3  PHE  21           2HB      PHE  21   6.419  -4.412  -3.212
  149    HD1  PHE  21           2HD      PHE  21   9.000  -4.150  -3.212
  150    HD2  PHE  21           1HD      PHE  21   6.753  -5.596   0.176
  151    HE1  PHE  21           2HE      PHE  21  11.068  -5.146  -2.260
  152    HE2  PHE  21           1HE      PHE  21   8.824  -6.585   1.126
  153    HZ   PHE  21           HZ       PHE  21  10.984  -6.360  -0.090
  154    H    LYS  22           H        LYS  22   5.943  -1.814  -4.365
  155    HA   LYS  22           HA       LYS  22   3.651  -0.233  -4.045
  156    HB2  LYS  22           1HB      LYS  22   5.261  -0.273  -5.998
  157    HB3  LYS  22           2HB      LYS  22   4.478  -1.747  -6.567
  158    HG2  LYS  22           1HG      LYS  22   2.320  -0.543  -6.704
  159    HG3  LYS  22           2HG      LYS  22   3.095   0.942  -6.123
  160    HD2  LYS  22           1HD      LYS  22   4.589   0.938  -8.112
  161    HD3  LYS  22           2HD      LYS  22   3.797  -0.542  -8.700
  162    HE2  LYS  22           1HE      LYS  22   1.621   0.660  -8.784
  163    HE3  LYS  22           2HE      LYS  22   2.407   2.131  -8.195
  164    HZ1  LYS  22           3HZ      LYS  22   3.774   2.129 -10.217
  165    HZ2  LYS  22           1HZ      LYS  22   2.193   2.151 -10.615
  166    HZ3  LYS  22           2HZ      LYS  22   3.049   0.770 -10.761
  167    H    HIS  23           H        HIS  23   3.749  -3.645  -5.120
  168    HA   HIS  23           HA       HIS  23   0.960  -3.930  -5.563
  169    HB2  HIS  23           1HB      HIS  23   1.409  -6.339  -5.520
  170    HB3  HIS  23           2HB      HIS  23   2.604  -5.469  -6.470
  171    HD1  HIS  23           1HD      HIS  23   5.122  -5.891  -5.787
  172    HD2  HIS  23           2HD      HIS  23   2.268  -7.213  -2.988
  173    HE1  HIS  23           1HE      HIS  23   6.412  -7.164  -3.996
  174    H    SER  24           H        SER  24   2.715  -3.875  -2.561
  175    HA   SER  24           HA       SER  24   0.741  -5.292  -0.942
  176    HB2  SER  24           1HB      SER  24   3.298  -4.765  -0.453
  177    HB3  SER  24           2HB      SER  24   2.664  -3.245   0.154
  178    HG   SER  24           HG       SER  24   2.052  -5.897   1.018
  179    H    LEU  25           H        LEU  25   1.512  -1.850  -1.598
  180    HA   LEU  25           HA       LEU  25  -0.700  -0.759  -0.132
  181    HB2  LEU  25           1HB      LEU  25   1.201   0.632  -0.685
  182    HB3  LEU  25           2HB      LEU  25   1.015   0.306  -2.410
  183    HG   LEU  25           HG       LEU  25  -1.155   1.509  -2.435
  184   HD11  LEU  25          1HD1      LEU  25  -1.873   2.825  -0.537
  185   HD12  LEU  25          2HD1      LEU  25  -0.521   2.235   0.458
  186   HD13  LEU  25          3HD1      LEU  25  -1.827   1.143  -0.054
  187   HD21  LEU  25          3HD2      LEU  25   0.944   2.698  -2.919
  188   HD22  LEU  25          1HD2      LEU  25   1.068   3.145  -1.198
  189   HD23  LEU  25          2HD2      LEU  25  -0.279   3.749  -2.183
  190    H    GLN  26           H        GLN  26  -0.299  -1.522  -3.633
  191    HA   GLN  26           HA       GLN  26  -2.794  -0.501  -4.486
  192    HB2  GLN  26           1HB      GLN  26  -1.084  -2.748  -5.620
  193    HB3  GLN  26           2HB      GLN  26  -2.501  -2.108  -6.440
  194    HG2  GLN  26           1HG      GLN  26  -0.030  -0.475  -5.712
  195    HG3  GLN  26           2HG      GLN  26  -0.396  -1.136  -7.302
  196   HE21  GLN  26          1HE2      GLN  26  -2.635  -0.362  -8.247
  197   HE22  GLN  26          2HE2      GLN  26  -3.004   1.327  -7.930
  198    H    ALA  27           H        ALA  27  -2.072  -3.707  -3.187
  199    HA   ALA  27           HA       ALA  27  -4.739  -4.795  -3.533
  200    HB1  ALA  27           1HB      ALA  27  -2.427  -5.509  -1.689
  201    HB2  ALA  27           2HB      ALA  27  -3.845  -6.538  -2.006
  202    HB3  ALA  27           3HB      ALA  27  -2.702  -6.165  -3.324
  203    H    HIS  28           H        HIS  28  -3.122  -2.988  -0.903
  204    HA   HIS  28           HA       HIS  28  -5.219  -3.294   1.059
  205    HB2  HIS  28           1HB      HIS  28  -3.059  -2.721   1.824
  206    HB3  HIS  28           2HB      HIS  28  -2.871  -1.411   0.674
  207    HD1  HIS  28           1HD      HIS  28  -4.747  -2.166   3.954
  208    HD2  HIS  28           2HD      HIS  28  -3.777   0.976   1.336
  209    HE1  HIS  28           1HE      HIS  28  -5.388  -0.032   5.170
  210    H    LEU  29           H        LEU  29  -4.752  -1.008  -1.653
  211    HA   LEU  29           HA       LEU  29  -6.713   0.901  -0.972
  212    HB2  LEU  29           1HB      LEU  29  -6.181  -0.146  -3.777
  213    HB3  LEU  29           2HB      LEU  29  -6.899   1.400  -3.340
  214    HG   LEU  29           HG       LEU  29  -4.043   0.519  -2.891
  215   HD11  LEU  29          1HD1      LEU  29  -4.607   1.159  -5.171
  216   HD12  LEU  29          2HD1      LEU  29  -3.508   2.332  -4.425
  217   HD13  LEU  29          3HD1      LEU  29  -5.237   2.726  -4.586
  218   HD21  LEU  29          3HD2      LEU  29  -5.462   3.079  -2.016
  219   HD22  LEU  29          1HD2      LEU  29  -3.694   2.917  -2.102
  220   HD23  LEU  29          2HD2      LEU  29  -4.614   1.920  -0.974
  221    H    ARG  30           H        ARG  30  -7.258  -2.365  -2.110
  222    HA   ARG  30           HA       ARG  30  -9.911  -2.091  -3.115
  223    HB2  ARG  30           1HB      ARG  30  -8.706  -4.515  -1.744
  224    HB3  ARG  30           2HB      ARG  30 -10.067  -4.480  -2.874
  225    HG2  ARG  30           1HG      ARG  30  -8.595  -3.758  -4.710
  226    HG3  ARG  30           2HG      ARG  30  -7.200  -3.730  -3.634
  227    HD2  ARG  30           1HD      ARG  30  -8.867  -6.190  -4.281
  228    HD3  ARG  30           2HD      ARG  30  -7.298  -5.785  -5.006
  229    HE   ARG  30           HE       ARG  30  -6.887  -5.741  -2.233
  230   HH11  ARG  30          2HH1      ARG  30  -7.731  -8.212  -4.574
  231   HH12  ARG  30          1HH1      ARG  30  -7.093  -9.496  -3.584
  232   HH21  ARG  30          2HH2      ARG  30  -6.155  -7.420  -1.000
  233   HH22  ARG  30          1HH2      ARG  30  -6.203  -9.048  -1.613
  234    H    ILE  31           H        ILE  31  -8.919  -1.894   0.187
  235    HA   ILE  31           HA       ILE  31 -11.620  -2.445   1.236
  236    HB   ILE  31           HB       ILE  31 -10.830  -2.116   3.351
  237   HG12  ILE  31          1HG1      ILE  31  -8.465  -0.547   2.293
  238   HG13  ILE  31          2HG1      ILE  31  -9.811   0.042   3.255
  239   HG21  ILE  31          1HG2      ILE  31  -9.904  -4.126   2.135
  240   HG22  ILE  31          2HG2      ILE  31  -8.367  -3.251   1.960
  241   HG23  ILE  31          3HG2      ILE  31  -8.995  -3.651   3.570
  242   HD11  ILE  31          3HD1      ILE  31  -7.618  -1.822   4.210
  243   HD12  ILE  31          1HD1      ILE  31  -7.925  -0.145   4.696
  244   HD13  ILE  31          2HD1      ILE  31  -9.077  -1.417   5.151
  245    H    HIS  32           H        HIS  32  -9.858   0.272   0.045
  246    HA   HIS  32           HA       HIS  32 -11.645   2.332   1.171
  247    HB2  HIS  32           1HB      HIS  32  -9.076   2.407  -0.469
  248    HB3  HIS  32           2HB      HIS  32  -9.918   3.814   0.093
  249    HD1  HIS  32           1HD      HIS  32 -10.271   3.587   3.069
  250    HD2  HIS  32           2HD      HIS  32  -7.028   1.922   0.985
  251    HE1  HIS  32           1HE      HIS  32  -8.381   3.409   4.759
  252    H    THR  33           H        THR  33 -10.923   0.775  -1.931
  253    HA   THR  33           HA       THR  33 -13.031   2.411  -3.285
  254    HB   THR  33           HB       THR  33 -10.662   3.162  -3.771
  255    HG1  THR  33           1HG      THR  33 -11.185   3.454  -5.918
  256   HG21  THR  33          3HG2      THR  33  -9.646   0.856  -4.026
  257   HG22  THR  33          1HG2      THR  33  -9.340   1.949  -5.380
  258   HG23  THR  33          2HG2      THR  33 -10.560   0.662  -5.526
  259    H    ASN  34           H        ASN  34 -13.652   1.465  -5.433
  260    HA   ASN  34           HA       ASN  34 -13.766  -1.500  -5.456
  261    HB2  ASN  34           1HB      ASN  34 -16.169  -1.547  -5.603
  262    HB3  ASN  34           2HB      ASN  34 -15.729  -0.667  -4.149
  263   HD21  ASN  34          1HD2      ASN  34 -17.267  -0.433  -7.309
  264   HD22  ASN  34          2HD2      ASN  34 -17.822   1.219  -7.092
  265    H    GLU  35           H        GLU  35 -14.686  -2.374  -7.472
  266    HA   GLU  35           HA       GLU  35 -14.441  -0.640  -9.874
  267    HB2  GLU  35           1HB      GLU  35 -12.208  -1.617  -9.350
  268    HB3  GLU  35           2HB      GLU  35 -12.903  -3.238  -9.458
  269    HG2  GLU  35           1HG      GLU  35 -13.421  -2.882 -11.839
  270    HG3  GLU  35           2HG      GLU  35 -12.890  -1.201 -11.729
  271    H    LYS  36           H        LYS  36 -15.554  -1.382 -11.687
  272    HA   LYS  36           HA       LYS  36 -17.146  -3.873 -11.573
  273    HB2  LYS  36           1HB      LYS  36 -18.536  -2.066 -10.561
  274    HB3  LYS  36           2HB      LYS  36 -18.387  -1.129 -12.055
  275    HG2  LYS  36           1HG      LYS  36 -19.493  -2.975 -13.313
  276    HG3  LYS  36           2HG      LYS  36 -19.646  -3.906 -11.824
  277    HD2  LYS  36           1HD      LYS  36 -20.916  -1.194 -12.404
  278    HD3  LYS  36           2HD      LYS  36 -21.750  -2.739 -12.482
  279    HE2  LYS  36           1HE      LYS  36 -20.536  -1.517  -9.959
  280    HE3  LYS  36           2HE      LYS  36 -22.236  -1.435 -10.416
  281    HZ1  LYS  36           3HZ      LYS  36 -21.866  -3.243  -8.865
  282    HZ2  LYS  36           1HZ      LYS  36 -20.763  -3.948  -9.835
  283    HZ3  LYS  36           2HZ      LYS  36 -22.330  -3.869 -10.295
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1  23.718  -0.642  16.975
    2    H2   GLY   1           2H       GLY   1  22.099  -0.436  17.123
    3    H3   GLY   1           3H       GLY   1  23.086   0.868  17.072
    4    HA2  GLY   1           1HA      GLY   1  23.729   0.375  14.802
    5    HA3  GLY   1           2HA      GLY   1  22.649  -1.028  14.858
    6    H    SER   2           H        SER   2  21.749   0.084  12.922
    7    HA   SER   2           HA       SER   2  19.392   1.705  13.653
    8    HB2  SER   2           1HB      SER   2  21.100   3.403  13.147
    9    HB3  SER   2           2HB      SER   2  21.430   2.630  11.585
   10    HG   SER   2           HG       SER   2  19.943   4.460  11.534
   11    H    SER   3           H        SER   3  17.706   1.563  12.167
   12    HA   SER   3           HA       SER   3  17.647  -0.701  10.320
   13    HB2  SER   3           1HB      SER   3  15.630   1.539  10.737
   14    HB3  SER   3           2HB      SER   3  15.340   0.001   9.910
   15    HG   SER   3           HG       SER   3  15.699  -1.078  11.890
   16    H    GLY   4           H        GLY   4  18.605   2.603  10.007
   17    HA2  GLY   4           1HA      GLY   4  19.370   3.809   8.193
   18    HA3  GLY   4           2HA      GLY   4  19.135   2.403   7.163
   19    H    SER   5           H        SER   5  18.633   4.541   5.889
   20    HA   SER   5           HA       SER   5  15.670   4.959   5.798
   21    HB2  SER   5           1HB      SER   5  16.115   7.328   5.298
   22    HB3  SER   5           2HB      SER   5  16.729   6.848   6.888
   23    HG   SER   5           HG       SER   5  18.259   8.099   5.706
   24    H    SER   6           H        SER   6  18.158   3.701   4.010
   25    HA   SER   6           HA       SER   6  17.757   4.959   1.465
   26    HB2  SER   6           1HB      SER   6  19.026   2.268   2.081
   27    HB3  SER   6           2HB      SER   6  19.256   3.246   0.618
   28    HG   SER   6           HG       SER   6  20.966   3.536   2.125
   29    H    GLY   7           H        GLY   7  15.938   2.427   2.986
   30    HA2  GLY   7           1HA      GLY   7  15.101   0.973   0.637
   31    HA3  GLY   7           2HA      GLY   7  14.348   0.914   2.226
   32    H    LYS   8           H        LYS   8  13.173   0.993  -0.484
   33    HA   LYS   8           HA       LYS   8  11.740   3.540  -0.728
   34    HB2  LYS   8           1HB      LYS   8  11.365   0.828  -2.076
   35    HB3  LYS   8           2HB      LYS   8  10.388   2.244  -2.440
   36    HG2  LYS   8           1HG      LYS   8  13.400   2.040  -2.853
   37    HG3  LYS   8           2HG      LYS   8  12.153   1.900  -4.098
   38    HD2  LYS   8           1HD      LYS   8  11.378   4.243  -3.464
   39    HD3  LYS   8           2HD      LYS   8  12.837   4.395  -2.475
   40    HE2  LYS   8           1HE      LYS   8  12.773   3.795  -5.462
   41    HE3  LYS   8           2HE      LYS   8  13.010   5.396  -4.757
   42    HZ1  LYS   8           3HZ      LYS   8  15.042   4.559  -3.689
   43    HZ2  LYS   8           1HZ      LYS   8  15.136   4.390  -5.308
   44    HZ3  LYS   8           2HZ      LYS   8  14.843   3.087  -4.375
   45    H    ILE   9           H        ILE   9   9.699   4.020  -0.255
   46    HA   ILE   9           HA       ILE   9   7.925   2.013   0.982
   47    HB   ILE   9           HB       ILE   9   7.128   3.594   2.681
   48   HG12  ILE   9          1HG1      ILE   9   9.048   5.452   3.185
   49   HG13  ILE   9          2HG1      ILE   9   9.145   5.461   1.441
   50   HG21  ILE   9          1HG2      ILE   9  10.108   3.079   2.948
   51   HG22  ILE   9          2HG2      ILE   9   8.924   3.300   4.249
   52   HG23  ILE   9          3HG2      ILE   9   8.824   1.875   3.206
   53   HD11  ILE   9          3HD1      ILE   9   6.627   5.939   3.102
   54   HD12  ILE   9          1HD1      ILE   9   7.588   7.173   2.268
   55   HD13  ILE   9          2HD1      ILE   9   6.691   5.972   1.326
   56    H    PHE  10           H        PHE  10   5.715   2.506   0.922
   57    HA   PHE  10           HA       PHE  10   4.777   4.485  -1.123
   58    HB2  PHE  10           1HB      PHE  10   4.095   1.525  -0.832
   59    HB3  PHE  10           2HB      PHE  10   3.159   2.650  -1.792
   60    HD1  PHE  10           2HD      PHE  10   6.496   0.997  -1.526
   61    HD2  PHE  10           1HD      PHE  10   3.828   3.340  -3.978
   62    HE1  PHE  10           2HE      PHE  10   7.954   0.597  -3.503
   63    HE2  PHE  10           1HE      PHE  10   5.271   2.915  -5.952
   64    HZ   PHE  10           HZ       PHE  10   7.308   1.521  -5.727
   65    H    THR  11           H        THR  11   2.935   5.617  -0.478
   66    HA   THR  11           HA       THR  11   1.792   4.929   2.212
   67    HB   THR  11           HB       THR  11   1.872   7.697   0.988
   68    HG1  THR  11           1HG      THR  11   3.988   7.148   1.209
   69   HG21  THR  11          3HG2      THR  11   0.316   7.465   2.826
   70   HG22  THR  11          1HG2      THR  11   1.747   8.318   3.425
   71   HG23  THR  11          2HG2      THR  11   1.527   6.596   3.812
   72    H    CYS  12           H        CYS  12  -0.319   4.692   2.460
   73    HA   CYS  12           HA       CYS  12  -2.211   4.729   0.292
   74    HB2  CYS  12           1HB      CYS  12  -2.261   3.204   2.234
   75    HB3  CYS  12           2HB      CYS  12  -2.513   4.588   3.314
   76    H    GLU  13           H        GLU  13  -3.277   6.386  -0.544
   77    HA   GLU  13           HA       GLU  13  -3.112   9.043   0.621
   78    HB2  GLU  13           1HB      GLU  13  -4.297   9.791  -1.339
   79    HB3  GLU  13           2HB      GLU  13  -3.029   8.659  -1.809
   80    HG2  GLU  13           1HG      GLU  13  -4.737   6.854  -2.029
   81    HG3  GLU  13           2HG      GLU  13  -6.001   8.011  -1.590
   82    H    TYR  14           H        TYR  14  -5.149   6.468   1.318
   83    HA   TYR  14           HA       TYR  14  -7.548   8.125   1.912
   84    HB2  TYR  14           1HB      TYR  14  -7.119   5.136   1.845
   85    HB3  TYR  14           2HB      TYR  14  -8.649   5.938   2.136
   86    HD1  TYR  14           1HD      TYR  14  -9.774   7.231   0.310
   87    HD2  TYR  14           2HD      TYR  14  -6.254   4.833  -0.419
   88    HE1  TYR  14           1HE      TYR  14 -10.270   7.232  -2.135
   89    HE2  TYR  14           2HE      TYR  14  -6.747   4.857  -2.854
   90    HH   TYR  14           HH       TYR  14  -8.172   5.555  -4.507
   91    H    CYS  15           H        CYS  15  -5.160   6.059   3.578
   92    HA   CYS  15           HA       CYS  15  -6.178   7.089   6.178
   93    HB2  CYS  15           1HB      CYS  15  -6.039   4.959   7.228
   94    HB3  CYS  15           2HB      CYS  15  -7.145   4.895   5.861
   95    H    ASN  16           H        ASN  16  -3.530   7.074   4.254
   96    HA   ASN  16           HA       ASN  16  -1.349   7.502   4.493
   97    HB2  ASN  16           1HB      ASN  16  -2.156   8.635   7.182
   98    HB3  ASN  16           2HB      ASN  16  -0.620   8.911   6.372
   99   HD21  ASN  16          1HD2      ASN  16  -4.066   9.683   6.293
  100   HD22  ASN  16          2HD2      ASN  16  -3.901  10.941   5.077
  101    H    LYS  17           H        LYS  17  -2.250   4.809   5.369
  102    HA   LYS  17           HA       LYS  17  -0.137   3.844   7.149
  103    HB2  LYS  17           1HB      LYS  17  -2.338   2.709   6.939
  104    HB3  LYS  17           2HB      LYS  17  -1.992   2.345   5.244
  105    HG2  LYS  17           1HG      LYS  17  -0.113   0.920   5.877
  106    HG3  LYS  17           2HG      LYS  17  -0.267   1.406   7.578
  107    HD2  LYS  17           1HD      LYS  17  -2.443   0.298   7.750
  108    HD3  LYS  17           2HD      LYS  17  -2.460  -0.017   6.014
  109    HE2  LYS  17           1HE      LYS  17  -1.872  -2.068   7.099
  110    HE3  LYS  17           2HE      LYS  17  -0.442  -1.468   6.254
  111    HZ1  LYS  17           3HZ      LYS  17  -0.947  -1.162   9.172
  112    HZ2  LYS  17           1HZ      LYS  17   0.401  -0.655   8.391
  113    HZ3  LYS  17           2HZ      LYS  17   0.073  -2.246   8.508
  114    H    VAL  18           H        VAL  18   1.764   2.880   6.551
  115    HA   VAL  18           HA       VAL  18   2.632   3.249   3.730
  116    HB   VAL  18           HB       VAL  18   4.994   3.216   4.824
  117   HG11  VAL  18          1HG1      VAL  18   3.177   5.636   5.013
  118   HG12  VAL  18          2HG1      VAL  18   4.951   5.654   4.963
  119   HG13  VAL  18          3HG1      VAL  18   4.043   5.072   3.561
  120   HG21  VAL  18          3HG2      VAL  18   3.391   4.416   7.109
  121   HG22  VAL  18          1HG2      VAL  18   4.161   2.802   7.172
  122   HG23  VAL  18          2HG2      VAL  18   5.153   4.263   6.985
  123    H    PHE  19           H        PHE  19   3.792   1.845   2.665
  124    HA   PHE  19           HA       PHE  19   4.153  -0.936   3.694
  125    HB2  PHE  19           1HB      PHE  19   3.094  -0.097   0.963
  126    HB3  PHE  19           2HB      PHE  19   3.384  -1.738   1.525
  127    HD1  PHE  19           2HD      PHE  19   1.220   1.266   1.969
  128    HD2  PHE  19           1HD      PHE  19   1.765  -2.913   2.866
  129    HE1  PHE  19           2HE      PHE  19  -1.046   1.191   2.994
  130    HE2  PHE  19           1HE      PHE  19  -0.520  -3.002   3.840
  131    HZ   PHE  19           HZ       PHE  19  -1.906  -0.943   3.932
  132    H    LYS  20           H        LYS  20   5.647  -2.205   2.329
  133    HA   LYS  20           HA       LYS  20   8.060  -0.620   1.723
  134    HB2  LYS  20           1HB      LYS  20   7.588  -3.605   1.977
  135    HB3  LYS  20           2HB      LYS  20   9.161  -2.819   1.713
  136    HG2  LYS  20           1HG      LYS  20   8.765  -1.452   3.811
  137    HG3  LYS  20           2HG      LYS  20   7.283  -2.377   4.082
  138    HD2  LYS  20           1HD      LYS  20   9.022  -3.263   5.464
  139    HD3  LYS  20           2HD      LYS  20   8.611  -4.461   4.221
  140    HE2  LYS  20           1HE      LYS  20  10.617  -3.796   2.917
  141    HE3  LYS  20           2HE      LYS  20  10.994  -2.550   4.114
  142    HZ1  LYS  20           3HZ      LYS  20  11.295  -4.322   5.762
  143    HZ2  LYS  20           1HZ      LYS  20  12.289  -4.570   4.493
  144    HZ3  LYS  20           2HZ      LYS  20  10.940  -5.474   4.658
  145    H    PHE  21           H        PHE  21   5.650  -2.288  -0.142
  146    HA   PHE  21           HA       PHE  21   7.199  -1.863  -2.650
  147    HB2  PHE  21           1HB      PHE  21   5.546  -4.326  -1.992
  148    HB3  PHE  21           2HB      PHE  21   6.495  -4.036  -3.436
  149    HD1  PHE  21           2HD      PHE  21   9.081  -3.759  -3.150
  150    HD2  PHE  21           1HD      PHE  21   6.499  -5.444  -0.134
  151    HE1  PHE  21           2HE      PHE  21  11.046  -4.819  -2.059
  152    HE2  PHE  21           1HE      PHE  21   8.466  -6.501   0.957
  153    HZ   PHE  21           HZ       PHE  21  10.741  -6.188  -0.002
  154    H    LYS  22           H        LYS  22   5.938  -1.625  -4.546
  155    HA   LYS  22           HA       LYS  22   3.633  -0.010  -4.290
  156    HB2  LYS  22           1HB      LYS  22   5.225  -0.078  -6.241
  157    HB3  LYS  22           2HB      LYS  22   4.526  -1.625  -6.727
  158    HG2  LYS  22           1HG      LYS  22   2.304  -0.540  -6.912
  159    HG3  LYS  22           2HG      LYS  22   3.021   1.020  -6.463
  160    HD2  LYS  22           1HD      LYS  22   4.502   0.911  -8.462
  161    HD3  LYS  22           2HD      LYS  22   3.762  -0.638  -8.921
  162    HE2  LYS  22           1HE      LYS  22   1.543   0.476  -9.081
  163    HE3  LYS  22           2HE      LYS  22   2.282   2.017  -8.626
  164    HZ1  LYS  22           3HZ      LYS  22   2.952   0.466 -11.074
  165    HZ2  LYS  22           1HZ      LYS  22   3.634   1.890 -10.653
  166    HZ3  LYS  22           2HZ      LYS  22   2.051   1.825 -11.036
  167    H    HIS  23           H        HIS  23   3.807  -3.452  -5.254
  168    HA   HIS  23           HA       HIS  23   1.010  -3.794  -5.614
  169    HB2  HIS  23           1HB      HIS  23   1.539  -6.217  -5.568
  170    HB3  HIS  23           2HB      HIS  23   2.577  -5.287  -6.637
  171    HD1  HIS  23           1HD      HIS  23   5.155  -5.612  -6.273
  172    HD2  HIS  23           2HD      HIS  23   2.736  -6.977  -3.108
  173    HE1  HIS  23           1HE      HIS  23   6.711  -6.806  -4.645
  174    H    SER  24           H        SER  24   2.864  -3.758  -2.680
  175    HA   SER  24           HA       SER  24   0.976  -5.201  -0.993
  176    HB2  SER  24           1HB      SER  24   3.135  -3.168  -0.311
  177    HB3  SER  24           2HB      SER  24   2.211  -4.100   0.857
  178    HG   SER  24           HG       SER  24   3.114  -6.004  -0.007
  179    H    LEU  25           H        LEU  25   1.611  -1.728  -1.619
  180    HA   LEU  25           HA       LEU  25  -0.611  -0.751  -0.062
  181    HB2  LEU  25           1HB      LEU  25   1.234   0.726  -0.607
  182    HB3  LEU  25           2HB      LEU  25   1.045   0.422  -2.335
  183    HG   LEU  25           HG       LEU  25  -1.155   1.558  -2.331
  184   HD11  LEU  25          1HD1      LEU  25  -1.782   1.117   0.066
  185   HD12  LEU  25          2HD1      LEU  25  -1.947   2.790  -0.421
  186   HD13  LEU  25          3HD1      LEU  25  -0.549   2.296   0.563
  187   HD21  LEU  25          3HD2      LEU  25   1.026   3.235  -1.070
  188   HD22  LEU  25          1HD2      LEU  25  -0.348   3.822  -2.029
  189   HD23  LEU  25          2HD2      LEU  25   0.898   2.822  -2.799
  190    H    GLN  26           H        GLN  26  -0.193  -1.567  -3.503
  191    HA   GLN  26           HA       GLN  26  -2.705  -0.545  -4.407
  192    HB2  GLN  26           1HB      GLN  26  -0.839  -2.644  -5.529
  193    HB3  GLN  26           2HB      GLN  26  -2.321  -2.203  -6.359
  194    HG2  GLN  26           1HG      GLN  26  -0.185  -0.170  -5.574
  195    HG3  GLN  26           2HG      GLN  26  -0.239  -0.976  -7.137
  196   HE21  GLN  26          1HE2      GLN  26  -0.461   1.936  -6.562
  197   HE22  GLN  26          2HE2      GLN  26  -2.013   2.392  -7.247
  198    H    ALA  27           H        ALA  27  -1.931  -3.724  -3.074
  199    HA   ALA  27           HA       ALA  27  -4.586  -4.861  -3.417
  200    HB1  ALA  27           1HB      ALA  27  -2.536  -6.206  -3.148
  201    HB2  ALA  27           2HB      ALA  27  -2.285  -5.502  -1.531
  202    HB3  ALA  27           3HB      ALA  27  -3.694  -6.546  -1.836
  203    H    HIS  28           H        HIS  28  -2.993  -2.980  -0.799
  204    HA   HIS  28           HA       HIS  28  -5.122  -3.266   1.124
  205    HB2  HIS  28           1HB      HIS  28  -2.993  -2.626   1.908
  206    HB3  HIS  28           2HB      HIS  28  -2.825  -1.326   0.746
  207    HD1  HIS  28           1HD      HIS  28  -4.778  -2.094   3.985
  208    HD2  HIS  28           2HD      HIS  28  -3.739   1.045   1.388
  209    HE1  HIS  28           1HE      HIS  28  -5.464   0.041   5.173
  210    H    LEU  29           H        LEU  29  -4.691  -1.026  -1.628
  211    HA   LEU  29           HA       LEU  29  -6.736   0.825  -1.014
  212    HB2  LEU  29           1HB      LEU  29  -6.123  -0.232  -3.796
  213    HB3  LEU  29           2HB      LEU  29  -6.864   1.310  -3.380
  214    HG   LEU  29           HG       LEU  29  -4.010   0.454  -2.886
  215   HD11  LEU  29          1HD1      LEU  29  -5.163   2.655  -4.609
  216   HD12  LEU  29          2HD1      LEU  29  -4.570   1.069  -5.177
  217   HD13  LEU  29          3HD1      LEU  29  -3.443   2.221  -4.439
  218   HD21  LEU  29          3HD2      LEU  29  -5.431   3.026  -2.062
  219   HD22  LEU  29          1HD2      LEU  29  -3.664   2.847  -2.112
  220   HD23  LEU  29          2HD2      LEU  29  -4.614   1.870  -0.990
  221    H    ARG  30           H        ARG  30  -7.134  -2.484  -2.082
  222    HA   ARG  30           HA       ARG  30  -9.737  -2.399  -3.203
  223    HB2  ARG  30           1HB      ARG  30  -8.427  -4.623  -1.577
  224    HB3  ARG  30           2HB      ARG  30  -9.846  -4.806  -2.609
  225    HG2  ARG  30           1HG      ARG  30  -8.515  -4.157  -4.601
  226    HG3  ARG  30           2HG      ARG  30  -7.072  -3.990  -3.599
  227    HD2  ARG  30           1HD      ARG  30  -7.209  -6.360  -2.946
  228    HD3  ARG  30           2HD      ARG  30  -8.676  -6.569  -3.898
  229    HE   ARG  30           HE       ARG  30  -5.917  -6.455  -4.865
  230   HH11  ARG  30          2HH1      ARG  30  -9.246  -6.132  -5.924
  231   HH12  ARG  30          1HH1      ARG  30  -8.836  -6.452  -7.586
  232   HH21  ARG  30          2HH2      ARG  30  -5.473  -6.842  -7.001
  233   HH22  ARG  30          1HH2      ARG  30  -6.759  -6.843  -8.171
  234    H    ILE  31           H        ILE  31  -8.880  -2.113   0.190
  235    HA   ILE  31           HA       ILE  31 -11.619  -2.611   1.116
  236    HB   ILE  31           HB       ILE  31 -10.902  -2.255   3.267
  237   HG12  ILE  31          1HG1      ILE  31  -8.527  -0.674   2.245
  238   HG13  ILE  31          2HG1      ILE  31  -9.889  -0.095   3.188
  239   HG21  ILE  31          1HG2      ILE  31  -8.390  -3.384   1.964
  240   HG22  ILE  31          2HG2      ILE  31  -9.071  -3.775   3.554
  241   HG23  ILE  31          3HG2      ILE  31  -9.927  -4.269   2.094
  242   HD11  ILE  31          3HD1      ILE  31  -8.014  -0.255   4.647
  243   HD12  ILE  31          1HD1      ILE  31  -9.157  -1.533   5.101
  244   HD13  ILE  31          2HD1      ILE  31  -7.686  -1.931   4.175
  245    H    HIS  32           H        HIS  32  -9.793   0.157   0.048
  246    HA   HIS  32           HA       HIS  32 -11.562   2.173   1.230
  247    HB2  HIS  32           1HB      HIS  32  -9.075   2.250  -0.527
  248    HB3  HIS  32           2HB      HIS  32  -9.935   3.681  -0.037
  249    HD1  HIS  32           1HD      HIS  32 -10.286   3.585   2.950
  250    HD2  HIS  32           2HD      HIS  32  -7.002   1.890   0.955
  251    HE1  HIS  32           1HE      HIS  32  -8.412   3.493   4.662
  252    H    THR  33           H        THR  33 -10.876   0.877  -2.025
  253    HA   THR  33           HA       THR  33 -13.115   2.507  -3.134
  254    HB   THR  33           HB       THR  33 -10.976   2.831  -4.192
  255    HG1  THR  33           1HG      THR  33 -12.922   1.562  -5.788
  256   HG21  THR  33          3HG2      THR  33 -11.128  -0.102  -4.972
  257   HG22  THR  33          1HG2      THR  33  -9.853   0.743  -4.064
  258   HG23  THR  33          2HG2      THR  33 -10.093   1.107  -5.771
  259    H    ASN  34           H        ASN  34 -13.514   0.125  -1.466
  260    HA   ASN  34           HA       ASN  34 -14.669  -1.979  -3.065
  261    HB2  ASN  34           1HB      ASN  34 -13.957  -2.186  -0.672
  262    HB3  ASN  34           2HB      ASN  34 -15.253  -1.086  -0.208
  263   HD21  ASN  34          1HD2      ASN  34 -15.786  -2.985   1.213
  264   HD22  ASN  34          2HD2      ASN  34 -16.828  -4.214   0.515
  265    H    GLU  35           H        GLU  35 -16.763  -2.286  -3.741
  266    HA   GLU  35           HA       GLU  35 -18.678   0.009  -3.582
  267    HB2  GLU  35           1HB      GLU  35 -19.397  -0.485  -5.825
  268    HB3  GLU  35           2HB      GLU  35 -17.658  -0.207  -5.799
  269    HG2  GLU  35           1HG      GLU  35 -17.255  -2.662  -5.882
  270    HG3  GLU  35           2HG      GLU  35 -18.994  -2.953  -5.882
  271    H    LYS  36           H        LYS  36 -18.290  -2.983  -2.353
  272    HA   LYS  36           HA       LYS  36 -20.995  -4.070  -2.780
  273    HB2  LYS  36           1HB      LYS  36 -18.653  -5.053  -1.113
  274    HB3  LYS  36           2HB      LYS  36 -20.173  -5.922  -1.349
  275    HG2  LYS  36           1HG      LYS  36 -19.784  -6.010  -3.788
  276    HG3  LYS  36           2HG      LYS  36 -18.250  -5.158  -3.602
  277    HD2  LYS  36           1HD      LYS  36 -18.896  -7.870  -2.372
  278    HD3  LYS  36           2HD      LYS  36 -17.989  -7.609  -3.870
  279    HE2  LYS  36           1HE      LYS  36 -16.297  -6.275  -2.600
  280    HE3  LYS  36           2HE      LYS  36 -17.170  -6.618  -1.102
  281    HZ1  LYS  36           3HZ      LYS  36 -15.342  -8.176  -1.427
  282    HZ2  LYS  36           1HZ      LYS  36 -15.942  -8.676  -2.859
  283    HZ3  LYS  36           2HZ      LYS  36 -16.755  -8.991  -1.476
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1   9.966   3.243  10.007
    2    H2   GLY   1           2H       GLY   1  10.290   4.822   9.717
    3    H3   GLY   1           3H       GLY   1  10.845   3.669   8.692
    4    HA2  GLY   1           1HA      GLY   1   8.602   3.074   8.039
    5    HA3  GLY   1           2HA      GLY   1   8.003   4.333   9.134
    6    H    SER   2           H        SER   2   7.352   6.092   8.010
    7    HA   SER   2           HA       SER   2   8.305   6.781   5.364
    8    HB2  SER   2           1HB      SER   2   6.895   8.804   5.698
    9    HB3  SER   2           2HB      SER   2   6.039   7.282   5.983
   10    HG   SER   2           HG       SER   2   5.623   8.853   7.620
   11    H    SER   3           H        SER   3   9.260   8.829   4.784
   12    HA   SER   3           HA       SER   3  11.012  10.195   4.673
   13    HB2  SER   3           1HB      SER   3  11.206  11.938   6.258
   14    HB3  SER   3           2HB      SER   3   9.506  11.499   6.095
   15    HG   SER   3           HG       SER   3  10.013  10.082   8.035
   16    H    GLY   4           H        GLY   4  11.682   7.429   5.688
   17    HA2  GLY   4           1HA      GLY   4  14.012   7.569   7.341
   18    HA3  GLY   4           2HA      GLY   4  13.572   6.238   6.276
   19    H    SER   5           H        SER   5  16.222   7.188   6.798
   20    HA   SER   5           HA       SER   5  17.171   8.821   4.593
   21    HB2  SER   5           1HB      SER   5  19.394   8.384   5.608
   22    HB3  SER   5           2HB      SER   5  18.200   9.015   6.752
   23    HG   SER   5           HG       SER   5  19.389   7.234   7.612
   24    H    SER   6           H        SER   6  16.493   5.486   4.772
   25    HA   SER   6           HA       SER   6  17.864   4.987   2.200
   26    HB2  SER   6           1HB      SER   6  18.798   2.865   2.967
   27    HB3  SER   6           2HB      SER   6  19.458   4.218   3.895
   28    HG   SER   6           HG       SER   6  18.859   2.466   5.247
   29    H    GLY   7           H        GLY   7  17.139   2.988   1.145
   30    HA2  GLY   7           1HA      GLY   7  15.534   1.479   0.423
   31    HA3  GLY   7           2HA      GLY   7  14.707   1.638   1.968
   32    H    LYS   8           H        LYS   8  12.855   1.404   0.504
   33    HA   LYS   8           HA       LYS   8  11.701   4.027  -0.262
   34    HB2  LYS   8           1HB      LYS   8  12.684   3.118  -2.344
   35    HB3  LYS   8           2HB      LYS   8  11.881   1.577  -2.081
   36    HG2  LYS   8           1HG      LYS   8  10.755   2.800  -3.815
   37    HG3  LYS   8           2HG      LYS   8   9.675   2.630  -2.435
   38    HD2  LYS   8           1HD      LYS   8  10.082   4.986  -1.794
   39    HD3  LYS   8           2HD      LYS   8  11.327   5.125  -3.036
   40    HE2  LYS   8           1HE      LYS   8   9.308   6.201  -3.803
   41    HE3  LYS   8           2HE      LYS   8   9.651   4.795  -4.811
   42    HZ1  LYS   8           3HZ      LYS   8   7.695   4.780  -2.564
   43    HZ2  LYS   8           1HZ      LYS   8   7.923   3.579  -3.649
   44    HZ3  LYS   8           2HZ      LYS   8   7.282   4.998  -4.136
   45    H    ILE   9           H        ILE   9   9.650   4.234   0.224
   46    HA   ILE   9           HA       ILE   9   7.956   1.891   0.872
   47    HB   ILE   9           HB       ILE   9   6.950   3.308   2.720
   48   HG12  ILE   9          1HG1      ILE   9   8.635   4.889   3.813
   49   HG13  ILE   9          2HG1      ILE   9   9.480   4.987   2.303
   50   HG21  ILE   9          1HG2      ILE   9   8.593   2.583   4.345
   51   HG22  ILE   9          2HG2      ILE   9   8.423   1.357   3.087
   52   HG23  ILE   9          3HG2      ILE   9   9.839   2.433   3.092
   53   HD11  ILE   9          3HD1      ILE   9   7.892   6.876   2.734
   54   HD12  ILE   9          1HD1      ILE   9   7.531   6.029   1.229
   55   HD13  ILE   9          2HD1      ILE   9   6.539   5.731   2.677
   56    H    PHE  10           H        PHE  10   5.665   2.397   0.913
   57    HA   PHE  10           HA       PHE  10   4.796   4.426  -1.121
   58    HB2  PHE  10           1HB      PHE  10   4.103   1.464  -0.890
   59    HB3  PHE  10           2HB      PHE  10   3.217   2.597  -1.886
   60    HD1  PHE  10           2HD      PHE  10   6.487   0.871  -1.487
   61    HD2  PHE  10           1HD      PHE  10   4.031   3.361  -4.012
   62    HE1  PHE  10           2HE      PHE  10   8.009   0.431  -3.405
   63    HE2  PHE  10           1HE      PHE  10   5.543   2.908  -5.929
   64    HZ   PHE  10           HZ       PHE  10   7.501   1.414  -5.642
   65    H    THR  11           H        THR  11   3.047   5.622  -0.466
   66    HA   THR  11           HA       THR  11   1.806   4.911   2.157
   67    HB   THR  11           HB       THR  11   1.894   7.667   0.916
   68    HG1  THR  11           1HG      THR  11   3.726   8.038   2.118
   69   HG21  THR  11          3HG2      THR  11   0.351   7.486   2.764
   70   HG22  THR  11          1HG2      THR  11   1.795   8.303   3.369
   71   HG23  THR  11          2HG2      THR  11   1.542   6.586   3.752
   72    H    CYS  12           H        CYS  12  -0.312   4.720   2.443
   73    HA   CYS  12           HA       CYS  12  -2.235   4.761   0.311
   74    HB2  CYS  12           1HB      CYS  12  -2.294   3.321   2.312
   75    HB3  CYS  12           2HB      CYS  12  -2.501   4.754   3.335
   76    H    GLU  13           H        GLU  13  -3.410   6.368  -0.502
   77    HA   GLU  13           HA       GLU  13  -3.118   9.076   0.585
   78    HB2  GLU  13           1HB      GLU  13  -4.329   9.817  -1.362
   79    HB3  GLU  13           2HB      GLU  13  -3.071   8.679  -1.841
   80    HG2  GLU  13           1HG      GLU  13  -4.788   6.879  -2.032
   81    HG3  GLU  13           2HG      GLU  13  -6.041   8.045  -1.586
   82    H    TYR  14           H        TYR  14  -5.172   6.499   1.291
   83    HA   TYR  14           HA       TYR  14  -7.545   8.178   1.922
   84    HB2  TYR  14           1HB      TYR  14  -7.178   5.179   1.796
   85    HB3  TYR  14           2HB      TYR  14  -8.683   6.012   2.108
   86    HD1  TYR  14           1HD      TYR  14  -9.743   7.415   0.295
   87    HD2  TYR  14           2HD      TYR  14  -6.349   4.848  -0.463
   88    HE1  TYR  14           1HE      TYR  14 -10.247   7.462  -2.142
   89    HE2  TYR  14           2HE      TYR  14  -6.860   4.908  -2.899
   90    HH   TYR  14           HH       TYR  14  -9.635   6.739  -4.229
   91    H    CYS  15           H        CYS  15  -5.181   6.058   3.550
   92    HA   CYS  15           HA       CYS  15  -6.132   7.131   6.159
   93    HB2  CYS  15           1HB      CYS  15  -6.047   5.017   7.240
   94    HB3  CYS  15           2HB      CYS  15  -7.161   4.951   5.880
   95    H    ASN  16           H        ASN  16  -3.533   6.980   4.179
   96    HA   ASN  16           HA       ASN  16  -1.334   7.308   4.346
   97    HB2  ASN  16           1HB      ASN  16  -1.871   8.624   6.995
   98    HB3  ASN  16           2HB      ASN  16  -0.556   8.947   5.863
   99   HD21  ASN  16          1HD2      ASN  16  -2.051   9.073   3.380
  100   HD22  ASN  16          2HD2      ASN  16  -3.024  10.528   3.524
  101    H    LYS  17           H        LYS  17  -2.198   4.722   5.344
  102    HA   LYS  17           HA       LYS  17  -0.043   3.841   7.124
  103    HB2  LYS  17           1HB      LYS  17  -2.231   2.665   6.989
  104    HB3  LYS  17           2HB      LYS  17  -1.913   2.256   5.300
  105    HG2  LYS  17           1HG      LYS  17  -0.017   0.867   5.923
  106    HG3  LYS  17           2HG      LYS  17  -0.095   1.426   7.605
  107    HD2  LYS  17           1HD      LYS  17  -2.261   0.334   7.918
  108    HD3  LYS  17           2HD      LYS  17  -2.303  -0.152   6.210
  109    HE2  LYS  17           1HE      LYS  17  -0.252  -1.501   6.526
  110    HE3  LYS  17           2HE      LYS  17  -0.151  -0.981   8.212
  111    HZ1  LYS  17           3HZ      LYS  17  -1.188  -3.166   8.031
  112    HZ2  LYS  17           1HZ      LYS  17  -2.373  -2.594   7.067
  113    HZ3  LYS  17           2HZ      LYS  17  -2.274  -2.105   8.624
  114    H    VAL  18           H        VAL  18   1.845   2.826   6.491
  115    HA   VAL  18           HA       VAL  18   2.657   3.196   3.653
  116    HB   VAL  18           HB       VAL  18   5.038   3.186   4.697
  117   HG11  VAL  18          1HG1      VAL  18   3.236   5.609   4.897
  118   HG12  VAL  18          2HG1      VAL  18   5.008   5.607   4.771
  119   HG13  VAL  18          3HG1      VAL  18   4.039   5.005   3.424
  120   HG21  VAL  18          3HG2      VAL  18   3.482   4.405   7.010
  121   HG22  VAL  18          1HG2      VAL  18   4.273   2.802   7.073
  122   HG23  VAL  18          2HG2      VAL  18   5.242   4.272   6.844
  123    H    PHE  19           H        PHE  19   3.755   1.770   2.557
  124    HA   PHE  19           HA       PHE  19   4.085  -1.006   3.616
  125    HB2  PHE  19           1HB      PHE  19   3.064  -0.143   0.885
  126    HB3  PHE  19           2HB      PHE  19   3.285  -1.793   1.445
  127    HD1  PHE  19           2HD      PHE  19   1.232   1.287   1.873
  128    HD2  PHE  19           1HD      PHE  19   1.643  -2.895   2.831
  129    HE1  PHE  19           2HE      PHE  19  -1.006   1.317   2.951
  130    HE2  PHE  19           1HE      PHE  19  -0.612  -2.875   3.876
  131    HZ   PHE  19           HZ       PHE  19  -1.912  -0.761   3.972
  132    H    LYS  20           H        LYS  20   5.558  -2.330   2.368
  133    HA   LYS  20           HA       LYS  20   8.041  -0.868   1.774
  134    HB2  LYS  20           1HB      LYS  20   7.401  -3.841   1.986
  135    HB3  LYS  20           2HB      LYS  20   9.027  -3.142   1.850
  136    HG2  LYS  20           1HG      LYS  20   8.622  -1.853   3.953
  137    HG3  LYS  20           2HG      LYS  20   7.038  -2.639   4.115
  138    HD2  LYS  20           1HD      LYS  20   8.112  -4.849   4.232
  139    HD3  LYS  20           2HD      LYS  20   9.714  -4.127   4.044
  140    HE2  LYS  20           1HE      LYS  20   7.794  -3.435   6.314
  141    HE3  LYS  20           2HE      LYS  20   8.986  -4.738   6.419
  142    HZ1  LYS  20           3HZ      LYS  20  10.739  -3.089   6.058
  143    HZ2  LYS  20           1HZ      LYS  20   9.861  -2.701   7.373
  144    HZ3  LYS  20           2HZ      LYS  20   9.647  -1.874   5.986
  145    H    PHE  21           H        PHE  21   5.608  -2.405  -0.137
  146    HA   PHE  21           HA       PHE  21   7.210  -2.057  -2.618
  147    HB2  PHE  21           1HB      PHE  21   5.515  -4.489  -1.922
  148    HB3  PHE  21           2HB      PHE  21   6.390  -4.214  -3.417
  149    HD1  PHE  21           2HD      PHE  21   8.961  -4.089  -3.352
  150    HD2  PHE  21           1HD      PHE  21   6.587  -5.508  -0.041
  151    HE1  PHE  21           2HE      PHE  21  10.971  -5.172  -2.370
  152    HE2  PHE  21           1HE      PHE  21   8.602  -6.574   0.946
  153    HZ   PHE  21           HZ       PHE  21  10.795  -6.410  -0.219
  154    H    LYS  22           H        LYS  22   5.966  -1.709  -4.507
  155    HA   LYS  22           HA       LYS  22   3.707  -0.047  -4.175
  156    HB2  LYS  22           1HB      LYS  22   5.313  -0.091  -6.132
  157    HB3  LYS  22           2HB      LYS  22   4.509  -1.554  -6.709
  158    HG2  LYS  22           1HG      LYS  22   2.359  -0.315  -6.781
  159    HG3  LYS  22           2HG      LYS  22   3.183   1.159  -6.238
  160    HD2  LYS  22           1HD      LYS  22   4.619   1.103  -8.267
  161    HD3  LYS  22           2HD      LYS  22   3.775  -0.361  -8.821
  162    HE2  LYS  22           1HE      LYS  22   1.628   0.895  -8.854
  163    HE3  LYS  22           2HE      LYS  22   2.466   2.349  -8.297
  164    HZ1  LYS  22           3HZ      LYS  22   3.776   2.303 -10.355
  165    HZ2  LYS  22           1HZ      LYS  22   2.186   2.361 -10.709
  166    HZ3  LYS  22           2HZ      LYS  22   3.003   0.958 -10.871
  167    H    HIS  23           H        HIS  23   3.773  -3.448  -5.294
  168    HA   HIS  23           HA       HIS  23   0.978  -3.704  -5.685
  169    HB2  HIS  23           1HB      HIS  23   1.436  -6.150  -5.644
  170    HB3  HIS  23           2HB      HIS  23   2.492  -5.235  -6.707
  171    HD1  HIS  23           1HD      HIS  23   5.042  -5.692  -6.397
  172    HD2  HIS  23           2HD      HIS  23   2.645  -6.885  -3.146
  173    HE1  HIS  23           1HE      HIS  23   6.584  -6.919  -4.781
  174    H    SER  24           H        SER  24   2.771  -3.753  -2.710
  175    HA   SER  24           HA       SER  24   0.774  -5.156  -1.099
  176    HB2  SER  24           1HB      SER  24   3.089  -3.342  -0.337
  177    HB3  SER  24           2HB      SER  24   2.020  -4.157   0.803
  178    HG   SER  24           HG       SER  24   3.829  -5.463   0.446
  179    H    LEU  25           H        LEU  25   1.587  -1.703  -1.670
  180    HA   LEU  25           HA       LEU  25  -0.617  -0.651  -0.138
  181    HB2  LEU  25           1HB      LEU  25   1.247   0.784  -0.699
  182    HB3  LEU  25           2HB      LEU  25   1.068   0.450  -2.423
  183    HG   LEU  25           HG       LEU  25  -1.111   1.624  -2.461
  184   HD11  LEU  25          1HD1      LEU  25  -1.887   2.920  -0.584
  185   HD12  LEU  25          2HD1      LEU  25  -0.522   2.391   0.429
  186   HD13  LEU  25          3HD1      LEU  25  -1.786   1.248  -0.071
  187   HD21  LEU  25          3HD2      LEU  25   0.971   2.839  -2.931
  188   HD22  LEU  25          1HD2      LEU  25   1.085   3.284  -1.208
  189   HD23  LEU  25          2HD2      LEU  25  -0.266   3.877  -2.195
  190    H    GLN  26           H        GLN  26  -0.230  -1.526  -3.581
  191    HA   GLN  26           HA       GLN  26  -2.749  -0.480  -4.457
  192    HB2  GLN  26           1HB      GLN  26  -1.006  -2.688  -5.598
  193    HB3  GLN  26           2HB      GLN  26  -2.446  -2.098  -6.407
  194    HG2  GLN  26           1HG      GLN  26  -0.065  -0.333  -5.686
  195    HG3  GLN  26           2HG      GLN  26  -0.321  -1.087  -7.254
  196   HE21  GLN  26          1HE2      GLN  26  -2.568  -0.498  -8.320
  197   HE22  GLN  26          2HE2      GLN  26  -3.047   1.179  -8.100
  198    H    ALA  27           H        ALA  27  -1.978  -3.669  -3.148
  199    HA   ALA  27           HA       ALA  27  -4.641  -4.785  -3.436
  200    HB1  ALA  27           1HB      ALA  27  -3.740  -6.475  -1.869
  201    HB2  ALA  27           2HB      ALA  27  -2.599  -6.140  -3.199
  202    HB3  ALA  27           3HB      ALA  27  -2.319  -5.441  -1.584
  203    H    HIS  28           H        HIS  28  -3.002  -2.925  -0.831
  204    HA   HIS  28           HA       HIS  28  -5.094  -3.190   1.122
  205    HB2  HIS  28           1HB      HIS  28  -2.952  -2.534   1.862
  206    HB3  HIS  28           2HB      HIS  28  -2.815  -1.241   0.687
  207    HD1  HIS  28           1HD      HIS  28  -4.727  -2.003   3.951
  208    HD2  HIS  28           2HD      HIS  28  -3.725   1.131   1.335
  209    HE1  HIS  28           1HE      HIS  28  -5.409   0.133   5.140
  210    H    LEU  29           H        LEU  29  -4.717  -0.950  -1.641
  211    HA   LEU  29           HA       LEU  29  -6.760   0.892  -1.008
  212    HB2  LEU  29           1HB      LEU  29  -6.206  -0.209  -3.784
  213    HB3  LEU  29           2HB      LEU  29  -6.955   1.333  -3.378
  214    HG   LEU  29           HG       LEU  29  -4.078   0.513  -2.939
  215   HD11  LEU  29          1HD1      LEU  29  -5.327   2.652  -4.678
  216   HD12  LEU  29          2HD1      LEU  29  -4.664   1.082  -5.223
  217   HD13  LEU  29          3HD1      LEU  29  -3.589   2.301  -4.517
  218   HD21  LEU  29          3HD2      LEU  29  -4.664   1.953  -1.048
  219   HD22  LEU  29          1HD2      LEU  29  -5.503   3.089  -2.126
  220   HD23  LEU  29          2HD2      LEU  29  -3.735   2.914  -2.201
  221    H    ARG  30           H        ARG  30  -7.155  -2.430  -2.014
  222    HA   ARG  30           HA       ARG  30  -9.832  -2.331  -3.003
  223    HB2  ARG  30           1HB      ARG  30  -8.423  -4.630  -1.593
  224    HB3  ARG  30           2HB      ARG  30  -9.846  -4.740  -2.632
  225    HG2  ARG  30           1HG      ARG  30  -8.564  -4.042  -4.592
  226    HG3  ARG  30           2HG      ARG  30  -7.123  -3.759  -3.609
  227    HD2  ARG  30           1HD      ARG  30  -7.097  -6.147  -2.952
  228    HD3  ARG  30           2HD      ARG  30  -8.486  -6.445  -4.020
  229    HE   ARG  30           HE       ARG  30  -6.654  -5.241  -5.690
  230   HH11  ARG  30          2HH1      ARG  30  -6.473  -8.112  -3.689
  231   HH12  ARG  30          1HH1      ARG  30  -5.270  -8.856  -4.705
  232   HH21  ARG  30          2HH2      ARG  30  -5.127  -6.253  -6.949
  233   HH22  ARG  30          1HH2      ARG  30  -4.538  -7.828  -6.505
  234    H    ILE  31           H        ILE  31  -8.822  -1.928   0.273
  235    HA   ILE  31           HA       ILE  31 -11.509  -2.536   1.345
  236    HB   ILE  31           HB       ILE  31 -10.741  -2.110   3.444
  237   HG12  ILE  31          1HG1      ILE  31  -8.389  -0.539   2.359
  238   HG13  ILE  31          2HG1      ILE  31  -9.763   0.068   3.267
  239   HG21  ILE  31          1HG2      ILE  31  -8.246  -3.240   2.115
  240   HG22  ILE  31          2HG2      ILE  31  -8.876  -3.595   3.734
  241   HG23  ILE  31          3HG2      ILE  31  -9.765  -4.142   2.313
  242   HD11  ILE  31          3HD1      ILE  31  -7.910  -0.029   4.754
  243   HD12  ILE  31          1HD1      ILE  31  -9.049  -1.298   5.237
  244   HD13  ILE  31          2HD1      ILE  31  -7.563  -1.717   4.346
  245    H    HIS  32           H        HIS  32  -9.816   0.193   0.067
  246    HA   HIS  32           HA       HIS  32 -11.617   2.235   1.191
  247    HB2  HIS  32           1HB      HIS  32  -9.101   2.317  -0.525
  248    HB3  HIS  32           2HB      HIS  32  -9.975   3.731  -0.016
  249    HD1  HIS  32           1HD      HIS  32 -10.298   3.612   2.970
  250    HD2  HIS  32           2HD      HIS  32  -7.011   1.974   0.932
  251    HE1  HIS  32           1HE      HIS  32  -8.400   3.547   4.658
  252    H    THR  33           H        THR  33 -11.047   0.595  -1.892
  253    HA   THR  33           HA       THR  33 -13.283   2.153  -3.129
  254    HB   THR  33           HB       THR  33 -11.063   2.866  -3.981
  255    HG1  THR  33           1HG      THR  33 -11.763   2.826  -6.096
  256   HG21  THR  33          3HG2      THR  33  -9.851   0.720  -4.014
  257   HG22  THR  33          1HG2      THR  33  -9.890   1.455  -5.616
  258   HG23  THR  33          2HG2      THR  33 -10.958   0.084  -5.242
  259    H    ASN  34           H        ASN  34 -14.284   1.062  -5.004
  260    HA   ASN  34           HA       ASN  34 -14.423  -1.888  -4.825
  261    HB2  ASN  34           1HB      ASN  34 -15.997  -0.831  -3.100
  262    HB3  ASN  34           2HB      ASN  34 -16.885  -0.126  -4.451
  263   HD21  ASN  34          1HD2      ASN  34 -18.685  -1.388  -3.401
  264   HD22  ASN  34          2HD2      ASN  34 -18.839  -3.082  -3.847
  265    H    GLU  35           H        GLU  35 -15.871  -2.793  -6.547
  266    HA   GLU  35           HA       GLU  35 -15.274  -1.565  -9.118
  267    HB2  GLU  35           1HB      GLU  35 -16.255  -3.529 -10.098
  268    HB3  GLU  35           2HB      GLU  35 -15.148  -3.977  -8.804
  269    HG2  GLU  35           1HG      GLU  35 -17.092  -4.354  -7.282
  270    HG3  GLU  35           2HG      GLU  35 -18.194  -3.911  -8.589
  271    H    LYS  36           H        LYS  36 -16.800  -1.163 -10.816
  272    HA   LYS  36           HA       LYS  36 -19.546  -0.347 -10.088
  273    HB2  LYS  36           1HB      LYS  36 -18.095   1.628  -9.656
  274    HB3  LYS  36           2HB      LYS  36 -17.460   1.523 -11.295
  275    HG2  LYS  36           1HG      LYS  36 -19.091   3.294 -11.156
  276    HG3  LYS  36           2HG      LYS  36 -19.708   2.027 -12.214
  277    HD2  LYS  36           1HD      LYS  36 -21.176   1.201 -10.394
  278    HD3  LYS  36           2HD      LYS  36 -20.493   2.412  -9.285
  279    HE2  LYS  36           1HE      LYS  36 -21.316   4.223 -10.777
  280    HE3  LYS  36           2HE      LYS  36 -21.984   3.015 -11.883
  281    HZ1  LYS  36           3HZ      LYS  36 -23.684   3.871 -10.377
  282    HZ2  LYS  36           1HZ      LYS  36 -22.843   3.398  -9.062
  283    HZ3  LYS  36           2HZ      LYS  36 -23.460   2.282 -10.085
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1   8.125  10.851   9.933
    2    H2   GLY   1           2H       GLY   1   7.223  12.079   9.332
    3    H3   GLY   1           3H       GLY   1   6.498  10.688   9.806
    4    HA2  GLY   1           1HA      GLY   1   6.115  12.397  11.447
    5    HA3  GLY   1           2HA      GLY   1   7.102  11.080  12.104
    6    H    SER   2           H        SER   2   8.407  12.126  13.561
    7    HA   SER   2           HA       SER   2   9.508  14.735  13.221
    8    HB2  SER   2           1HB      SER   2  10.465  12.497  15.041
    9    HB3  SER   2           2HB      SER   2  10.794  14.230  15.227
   10    HG   SER   2           HG       SER   2   9.042  13.537  16.546
   11    H    SER   3           H        SER   3  10.661  11.683  12.032
   12    HA   SER   3           HA       SER   3  12.971  13.009  10.745
   13    HB2  SER   3           1HB      SER   3  14.426  11.076  11.219
   14    HB3  SER   3           2HB      SER   3  13.944  11.930  12.692
   15    HG   SER   3           HG       SER   3  13.766   9.652  12.922
   16    H    GLY   4           H        GLY   4  13.786  11.797   8.881
   17    HA2  GLY   4           1HA      GLY   4  11.612  10.692   7.256
   18    HA3  GLY   4           2HA      GLY   4  13.257  11.032   6.736
   19    H    SER   5           H        SER   5  11.458   8.647   6.390
   20    HA   SER   5           HA       SER   5  12.770   6.427   7.768
   21    HB2  SER   5           1HB      SER   5  10.818   6.428   5.437
   22    HB3  SER   5           2HB      SER   5  11.339   5.009   6.365
   23    HG   SER   5           HG       SER   5   9.345   5.846   7.137
   24    H    SER   6           H        SER   6  14.085   4.819   6.867
   25    HA   SER   6           HA       SER   6  15.770   5.593   4.585
   26    HB2  SER   6           1HB      SER   6  17.070   3.577   5.204
   27    HB3  SER   6           2HB      SER   6  16.902   4.755   6.514
   28    HG   SER   6           HG       SER   6  16.528   2.598   7.226
   29    H    GLY   7           H        GLY   7  16.187   4.233   2.782
   30    HA2  GLY   7           1HA      GLY   7  15.640   2.878   0.993
   31    HA3  GLY   7           2HA      GLY   7  14.631   1.923   2.074
   32    H    LYS   8           H        LYS   8  13.342   1.760   0.073
   33    HA   LYS   8           HA       LYS   8  11.621   4.087  -0.585
   34    HB2  LYS   8           1HB      LYS   8  12.527   2.876  -2.471
   35    HB3  LYS   8           2HB      LYS   8  11.942   1.341  -1.838
   36    HG2  LYS   8           1HG      LYS   8  10.558   2.074  -3.689
   37    HG3  LYS   8           2HG      LYS   8   9.619   2.008  -2.204
   38    HD2  LYS   8           1HD      LYS   8   9.856   4.513  -1.995
   39    HD3  LYS   8           2HD      LYS   8  10.707   4.531  -3.548
   40    HE2  LYS   8           1HE      LYS   8   8.775   3.798  -4.738
   41    HE3  LYS   8           2HE      LYS   8   7.987   3.217  -3.266
   42    HZ1  LYS   8           3HZ      LYS   8   7.653   5.437  -2.529
   43    HZ2  LYS   8           1HZ      LYS   8   7.050   5.327  -4.044
   44    HZ3  LYS   8           2HZ      LYS   8   8.477   6.088  -3.800
   45    H    ILE   9           H        ILE   9   9.607   4.317   0.027
   46    HA   ILE   9           HA       ILE   9   7.986   2.041   0.996
   47    HB   ILE   9           HB       ILE   9   6.902   3.535   2.683
   48   HG12  ILE   9          1HG1      ILE   9   9.402   5.262   2.570
   49   HG13  ILE   9          2HG1      ILE   9   7.959   5.684   1.649
   50   HG21  ILE   9          1HG2      ILE   9   9.833   2.915   3.225
   51   HG22  ILE   9          2HG2      ILE   9   8.536   3.076   4.423
   52   HG23  ILE   9          3HG2      ILE   9   8.508   1.736   3.271
   53   HD11  ILE   9          3HD1      ILE   9   8.011   6.867   3.790
   54   HD12  ILE   9          1HD1      ILE   9   6.607   5.795   3.664
   55   HD13  ILE   9          2HD1      ILE   9   8.005   5.326   4.669
   56    H    PHE  10           H        PHE  10   5.739   2.375   0.855
   57    HA   PHE  10           HA       PHE  10   4.778   4.394  -1.142
   58    HB2  PHE  10           1HB      PHE  10   4.054   1.447  -0.828
   59    HB3  PHE  10           2HB      PHE  10   3.200   2.577  -1.857
   60    HD1  PHE  10           2HD      PHE  10   6.423   0.777  -1.399
   61    HD2  PHE  10           1HD      PHE  10   4.028   3.230  -4.015
   62    HE1  PHE  10           2HE      PHE  10   7.922   0.213  -3.302
   63    HE2  PHE  10           1HE      PHE  10   5.520   2.658  -5.915
   64    HZ   PHE  10           HZ       PHE  10   7.437   1.121  -5.574
   65    H    THR  11           H        THR  11   2.977   5.549  -0.459
   66    HA   THR  11           HA       THR  11   1.817   4.829   2.215
   67    HB   THR  11           HB       THR  11   2.038   7.618   1.049
   68    HG1  THR  11           1HG      THR  11   4.108   6.950   1.339
   69   HG21  THR  11          3HG2      THR  11   1.855   8.192   3.510
   70   HG22  THR  11          1HG2      THR  11   1.482   6.482   3.824
   71   HG23  THR  11          2HG2      THR  11   0.400   7.476   2.802
   72    H    CYS  12           H        CYS  12  -0.317   4.683   2.461
   73    HA   CYS  12           HA       CYS  12  -2.191   4.784   0.297
   74    HB2  CYS  12           1HB      CYS  12  -2.312   3.325   2.278
   75    HB3  CYS  12           2HB      CYS  12  -2.509   4.750   3.316
   76    H    GLU  13           H        GLU  13  -3.333   6.416  -0.520
   77    HA   GLU  13           HA       GLU  13  -3.020   9.111   0.594
   78    HB2  GLU  13           1HB      GLU  13  -4.186   9.884  -1.367
   79    HB3  GLU  13           2HB      GLU  13  -2.939   8.728  -1.834
   80    HG2  GLU  13           1HG      GLU  13  -4.686   6.959  -2.061
   81    HG3  GLU  13           2HG      GLU  13  -5.925   8.147  -1.633
   82    H    TYR  14           H        TYR  14  -5.126   6.558   1.240
   83    HA   TYR  14           HA       TYR  14  -7.486   8.267   1.840
   84    HB2  TYR  14           1HB      TYR  14  -7.157   5.263   1.704
   85    HB3  TYR  14           2HB      TYR  14  -8.656   6.115   1.994
   86    HD1  TYR  14           1HD      TYR  14  -9.652   7.556   0.169
   87    HD2  TYR  14           2HD      TYR  14  -6.295   4.929  -0.538
   88    HE1  TYR  14           1HE      TYR  14 -10.102   7.628  -2.285
   89    HE2  TYR  14           2HE      TYR  14  -6.752   5.007  -2.979
   90    HH   TYR  14           HH       TYR  14  -8.094   5.828  -4.645
   91    H    CYS  15           H        CYS  15  -5.179   6.111   3.498
   92    HA   CYS  15           HA       CYS  15  -6.152   7.189   6.097
   93    HB2  CYS  15           1HB      CYS  15  -6.141   5.067   7.166
   94    HB3  CYS  15           2HB      CYS  15  -7.232   5.037   5.786
   95    H    ASN  16           H        ASN  16  -3.523   6.980   4.162
   96    HA   ASN  16           HA       ASN  16  -1.316   7.231   4.368
   97    HB2  ASN  16           1HB      ASN  16  -1.842   8.529   7.029
   98    HB3  ASN  16           2HB      ASN  16  -0.504   8.823   5.917
   99   HD21  ASN  16          1HD2      ASN  16  -1.968   9.039   3.420
  100   HD22  ASN  16          2HD2      ASN  16  -2.887  10.529   3.577
  101    H    LYS  17           H        LYS  17  -2.274   4.662   5.296
  102    HA   LYS  17           HA       LYS  17  -0.194   3.689   7.116
  103    HB2  LYS  17           1HB      LYS  17  -2.430   2.590   6.876
  104    HB3  LYS  17           2HB      LYS  17  -2.024   2.152   5.212
  105    HG2  LYS  17           1HG      LYS  17  -0.202   0.728   5.965
  106    HG3  LYS  17           2HG      LYS  17  -0.354   1.322   7.629
  107    HD2  LYS  17           1HD      LYS  17  -2.564   0.291   7.844
  108    HD3  LYS  17           2HD      LYS  17  -2.515  -0.246   6.153
  109    HE2  LYS  17           1HE      LYS  17  -0.514  -1.623   6.633
  110    HE3  LYS  17           2HE      LYS  17  -0.503  -1.052   8.305
  111    HZ1  LYS  17           3HZ      LYS  17  -1.572  -3.220   8.132
  112    HZ2  LYS  17           1HZ      LYS  17  -2.685  -2.660   7.079
  113    HZ3  LYS  17           2HZ      LYS  17  -2.670  -2.121   8.623
  114    H    VAL  18           H        VAL  18   1.666   2.598   6.510
  115    HA   VAL  18           HA       VAL  18   2.602   3.087   3.727
  116    HB   VAL  18           HB       VAL  18   4.935   3.073   4.891
  117   HG11  VAL  18          1HG1      VAL  18   4.802   5.518   5.113
  118   HG12  VAL  18          2HG1      VAL  18   4.023   4.922   3.640
  119   HG13  VAL  18          3HG1      VAL  18   3.034   5.426   5.037
  120   HG21  VAL  18          3HG2      VAL  18   3.247   4.209   7.147
  121   HG22  VAL  18          1HG2      VAL  18   4.036   2.602   7.211
  122   HG23  VAL  18          2HG2      VAL  18   5.014   4.077   7.071
  123    H    PHE  19           H        PHE  19   3.799   1.734   2.646
  124    HA   PHE  19           HA       PHE  19   4.141  -1.072   3.607
  125    HB2  PHE  19           1HB      PHE  19   3.084  -0.174   0.899
  126    HB3  PHE  19           2HB      PHE  19   3.316  -1.829   1.444
  127    HD1  PHE  19           2HD      PHE  19   1.227   1.216   1.810
  128    HD2  PHE  19           1HD      PHE  19   1.722  -2.912   2.941
  129    HE1  PHE  19           2HE      PHE  19  -1.018   1.243   2.890
  130    HE2  PHE  19           1HE      PHE  19  -0.540  -2.901   3.972
  131    HZ   PHE  19           HZ       PHE  19  -1.888  -0.814   3.972
  132    H    LYS  20           H        LYS  20   5.642  -2.324   2.315
  133    HA   LYS  20           HA       LYS  20   8.057  -0.757   1.680
  134    HB2  LYS  20           1HB      LYS  20   7.582  -3.760   1.853
  135    HB3  LYS  20           2HB      LYS  20   9.158  -2.947   1.745
  136    HG2  LYS  20           1HG      LYS  20   8.538  -1.713   3.901
  137    HG3  LYS  20           2HG      LYS  20   7.133  -2.792   4.022
  138    HD2  LYS  20           1HD      LYS  20   8.705  -4.758   3.965
  139    HD3  LYS  20           2HD      LYS  20  10.071  -3.615   3.963
  140    HE2  LYS  20           1HE      LYS  20   9.268  -2.669   6.119
  141    HE3  LYS  20           2HE      LYS  20   7.922  -3.819   6.121
  142    HZ1  LYS  20           3HZ      LYS  20   9.770  -4.618   7.479
  143    HZ2  LYS  20           1HZ      LYS  20  10.798  -4.568   6.215
  144    HZ3  LYS  20           2HZ      LYS  20   9.554  -5.628   6.216
  145    H    PHE  21           H        PHE  21   5.644  -2.431  -0.153
  146    HA   PHE  21           HA       PHE  21   7.200  -2.107  -2.676
  147    HB2  PHE  21           1HB      PHE  21   5.464  -4.495  -1.958
  148    HB3  PHE  21           2HB      PHE  21   6.449  -4.282  -3.394
  149    HD1  PHE  21           2HD      PHE  21   9.037  -4.080  -3.064
  150    HD2  PHE  21           1HD      PHE  21   6.345  -5.583  -0.046
  151    HE1  PHE  21           2HE      PHE  21  10.946  -5.160  -1.895
  152    HE2  PHE  21           1HE      PHE  21   8.257  -6.648   1.128
  153    HZ   PHE  21           HZ       PHE  21  10.559  -6.441   0.204
  154    H    LYS  22           H        LYS  22   5.953  -1.813  -4.572
  155    HA   LYS  22           HA       LYS  22   3.698  -0.138  -4.301
  156    HB2  LYS  22           1HB      LYS  22   5.285  -0.243  -6.259
  157    HB3  LYS  22           2HB      LYS  22   4.515  -1.752  -6.762
  158    HG2  LYS  22           1HG      LYS  22   2.345  -0.572  -6.942
  159    HG3  LYS  22           2HG      LYS  22   3.096   0.928  -6.392
  160    HD2  LYS  22           1HD      LYS  22   2.841   1.035  -8.784
  161    HD3  LYS  22           2HD      LYS  22   4.565   0.938  -8.399
  162    HE2  LYS  22           1HE      LYS  22   4.550  -1.489  -8.937
  163    HE3  LYS  22           2HE      LYS  22   2.814  -1.413  -9.267
  164    HZ1  LYS  22           3HZ      LYS  22   4.117  -1.268 -11.313
  165    HZ2  LYS  22           1HZ      LYS  22   4.905   0.059 -10.786
  166    HZ3  LYS  22           2HZ      LYS  22   3.301   0.127 -11.096
  167    H    HIS  23           H        HIS  23   3.757  -3.584  -5.254
  168    HA   HIS  23           HA       HIS  23   0.955  -3.851  -5.626
  169    HB2  HIS  23           1HB      HIS  23   1.379  -6.254  -5.601
  170    HB3  HIS  23           2HB      HIS  23   2.591  -5.410  -6.554
  171    HD1  HIS  23           1HD      HIS  23   5.115  -5.821  -5.821
  172    HD2  HIS  23           2HD      HIS  23   2.203  -7.180  -3.099
  173    HE1  HIS  23           1HE      HIS  23   6.368  -7.104  -4.012
  174    H    SER  24           H        SER  24   2.786  -3.766  -2.686
  175    HA   SER  24           HA       SER  24   0.832  -5.157  -0.993
  176    HB2  SER  24           1HB      SER  24   3.234  -3.399  -0.392
  177    HB3  SER  24           2HB      SER  24   2.156  -4.015   0.850
  178    HG   SER  24           HG       SER  24   3.509  -5.652  -1.065
  179    H    LEU  25           H        LEU  25   1.621  -1.712  -1.677
  180    HA   LEU  25           HA       LEU  25  -0.578  -0.653  -0.127
  181    HB2  LEU  25           1HB      LEU  25   1.285   0.782  -0.710
  182    HB3  LEU  25           2HB      LEU  25   1.088   0.441  -2.430
  183    HG   LEU  25           HG       LEU  25  -1.092   1.610  -2.451
  184   HD11  LEU  25          1HD1      LEU  25  -1.755   1.236  -0.060
  185   HD12  LEU  25          2HD1      LEU  25  -1.858   2.911  -0.569
  186   HD13  LEU  25          3HD1      LEU  25  -0.489   2.379   0.436
  187   HD21  LEU  25          3HD2      LEU  25   0.987   2.833  -2.929
  188   HD22  LEU  25          1HD2      LEU  25   1.100   3.286  -1.210
  189   HD23  LEU  25          2HD2      LEU  25  -0.255   3.867  -2.197
  190    H    GLN  26           H        GLN  26  -0.187  -1.541  -3.563
  191    HA   GLN  26           HA       GLN  26  -2.702  -0.511  -4.456
  192    HB2  GLN  26           1HB      GLN  26  -0.866  -2.648  -5.564
  193    HB3  GLN  26           2HB      GLN  26  -2.339  -2.186  -6.395
  194    HG2  GLN  26           1HG      GLN  26  -0.167  -0.181  -5.632
  195    HG3  GLN  26           2HG      GLN  26  -0.219  -1.017  -7.179
  196   HE21  GLN  26          1HE2      GLN  26  -0.302   1.847  -6.907
  197   HE22  GLN  26          2HE2      GLN  26  -1.873   2.349  -7.511
  198    H    ALA  27           H        ALA  27  -1.934  -3.686  -3.103
  199    HA   ALA  27           HA       ALA  27  -4.593  -4.811  -3.406
  200    HB1  ALA  27           1HB      ALA  27  -2.283  -5.425  -1.527
  201    HB2  ALA  27           2HB      ALA  27  -3.700  -6.470  -1.799
  202    HB3  ALA  27           3HB      ALA  27  -2.553  -6.158  -3.130
  203    H    HIS  28           H        HIS  28  -2.970  -2.926  -0.804
  204    HA   HIS  28           HA       HIS  28  -5.082  -3.164   1.130
  205    HB2  HIS  28           1HB      HIS  28  -2.949  -2.508   1.889
  206    HB3  HIS  28           2HB      HIS  28  -2.788  -1.230   0.701
  207    HD1  HIS  28           1HD      HIS  28  -4.724  -1.940   3.957
  208    HD2  HIS  28           2HD      HIS  28  -3.744   1.150   1.282
  209    HE1  HIS  28           1HE      HIS  28  -5.449   0.212   5.093
  210    H    LEU  29           H        LEU  29  -4.670  -0.951  -1.648
  211    HA   LEU  29           HA       LEU  29  -6.716   0.902  -1.047
  212    HB2  LEU  29           1HB      LEU  29  -6.111  -0.204  -3.810
  213    HB3  LEU  29           2HB      LEU  29  -6.873   1.336  -3.424
  214    HG   LEU  29           HG       LEU  29  -4.005   0.531  -2.907
  215   HD11  LEU  29          1HD1      LEU  29  -3.465   2.264  -4.507
  216   HD12  LEU  29          2HD1      LEU  29  -5.191   2.672  -4.684
  217   HD13  LEU  29          3HD1      LEU  29  -4.579   1.081  -5.213
  218   HD21  LEU  29          3HD2      LEU  29  -5.481   3.098  -2.150
  219   HD22  LEU  29          1HD2      LEU  29  -3.708   2.956  -2.191
  220   HD23  LEU  29          2HD2      LEU  29  -4.642   1.988  -1.047
  221    H    ARG  30           H        ARG  30  -7.105  -2.422  -2.013
  222    HA   ARG  30           HA       ARG  30  -9.760  -2.331  -3.049
  223    HB2  ARG  30           1HB      ARG  30  -8.381  -4.617  -1.596
  224    HB3  ARG  30           2HB      ARG  30  -9.797  -4.734  -2.644
  225    HG2  ARG  30           1HG      ARG  30  -8.502  -4.044  -4.600
  226    HG3  ARG  30           2HG      ARG  30  -7.065  -3.768  -3.611
  227    HD2  ARG  30           1HD      ARG  30  -7.052  -6.155  -2.952
  228    HD3  ARG  30           2HD      ARG  30  -8.441  -6.447  -4.022
  229    HE   ARG  30           HE       ARG  30  -6.567  -5.236  -5.666
  230   HH11  ARG  30          2HH1      ARG  30  -6.515  -8.163  -3.740
  231   HH12  ARG  30          1HH1      ARG  30  -5.335  -8.929  -4.769
  232   HH21  ARG  30          2HH2      ARG  30  -5.074  -6.275  -6.943
  233   HH22  ARG  30          1HH2      ARG  30  -4.551  -7.883  -6.537
  234    H    ILE  31           H        ILE  31  -8.790  -1.893   0.235
  235    HA   ILE  31           HA       ILE  31 -11.487  -2.479   1.287
  236    HB   ILE  31           HB       ILE  31 -10.742  -2.026   3.388
  237   HG12  ILE  31          1HG1      ILE  31  -8.368  -0.481   2.315
  238   HG13  ILE  31          2HG1      ILE  31  -9.754   0.146   3.191
  239   HG21  ILE  31          1HG2      ILE  31  -9.761  -4.076   2.293
  240   HG22  ILE  31          2HG2      ILE  31  -8.237  -3.181   2.099
  241   HG23  ILE  31          3HG2      ILE  31  -8.884  -3.514   3.717
  242   HD11  ILE  31          3HD1      ILE  31  -7.582  -1.633   4.333
  243   HD12  ILE  31          1HD1      ILE  31  -7.930   0.063   4.713
  244   HD13  ILE  31          2HD1      ILE  31  -9.083  -1.196   5.191
  245    H    HIS  32           H        HIS  32  -9.779   0.239  -0.005
  246    HA   HIS  32           HA       HIS  32 -11.629   2.278   1.038
  247    HB2  HIS  32           1HB      HIS  32  -9.103   2.380  -0.664
  248    HB3  HIS  32           2HB      HIS  32 -10.003   3.782  -0.155
  249    HD1  HIS  32           1HD      HIS  32 -10.321   3.713   2.808
  250    HD2  HIS  32           2HD      HIS  32  -7.030   2.019   0.825
  251    HE1  HIS  32           1HE      HIS  32  -8.443   3.650   4.519
  252    H    THR  33           H        THR  33 -11.082   0.469  -1.952
  253    HA   THR  33           HA       THR  33 -12.689   2.118  -3.699
  254    HB   THR  33           HB       THR  33 -12.840   0.039  -5.097
  255    HG1  THR  33           1HG      THR  33 -12.718  -1.529  -3.494
  256   HG21  THR  33          3HG2      THR  33 -10.452  -0.119  -5.635
  257   HG22  THR  33          1HG2      THR  33 -10.033   0.728  -4.137
  258   HG23  THR  33          2HG2      THR  33 -10.944   1.573  -5.406
  259    H    ASN  34           H        ASN  34 -14.795   1.601  -4.581
  260    HA   ASN  34           HA       ASN  34 -16.742   0.807  -2.559
  261    HB2  ASN  34           1HB      ASN  34 -18.407   1.497  -4.099
  262    HB3  ASN  34           2HB      ASN  34 -17.109   2.673  -4.204
  263   HD21  ASN  34          1HD2      ASN  34 -16.102   2.970  -6.260
  264   HD22  ASN  34          2HD2      ASN  34 -16.557   2.010  -7.657
  265    H    GLU  35           H        GLU  35 -18.470  -0.777  -3.020
  266    HA   GLU  35           HA       GLU  35 -17.285  -3.339  -3.982
  267    HB2  GLU  35           1HB      GLU  35 -19.514  -2.813  -1.990
  268    HB3  GLU  35           2HB      GLU  35 -18.894  -4.404  -2.452
  269    HG2  GLU  35           1HG      GLU  35 -16.630  -3.752  -1.631
  270    HG3  GLU  35           2HG      GLU  35 -17.295  -2.221  -1.055
  271    H    LYS  36           H        LYS  36 -18.880  -1.239  -5.603
  272    HA   LYS  36           HA       LYS  36 -20.513  -1.035  -7.131
  273    HB2  LYS  36           1HB      LYS  36 -18.873  -2.635  -8.158
  274    HB3  LYS  36           2HB      LYS  36 -19.985  -3.952  -7.764
  275    HG2  LYS  36           1HG      LYS  36 -21.752  -2.814  -9.151
  276    HG3  LYS  36           2HG      LYS  36 -20.593  -1.526  -9.527
  277    HD2  LYS  36           1HD      LYS  36 -19.098  -3.181 -10.613
  278    HD3  LYS  36           2HD      LYS  36 -20.246  -4.480 -10.215
  279    HE2  LYS  36           1HE      LYS  36 -22.001  -3.327 -11.552
  280    HE3  LYS  36           2HE      LYS  36 -20.853  -2.045 -11.956
  281    HZ1  LYS  36           3HZ      LYS  36 -20.548  -4.905 -12.710
  282    HZ2  LYS  36           1HZ      LYS  36 -19.485  -3.721 -13.085
  283    HZ3  LYS  36           2HZ      LYS  36 -20.986  -3.704 -13.723
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1  25.606  -3.523  12.253
    2    H2   GLY   1           2H       GLY   1  25.732  -3.660  10.627
    3    H3   GLY   1           3H       GLY   1  25.687  -5.006  11.562
    4    HA2  GLY   1           1HA      GLY   1  23.566  -4.710  10.483
    5    HA3  GLY   1           2HA      GLY   1  23.428  -4.539  12.243
    6    H    SER   2           H        SER   2  21.487  -3.313  11.884
    7    HA   SER   2           HA       SER   2  21.960  -0.423  11.459
    8    HB2  SER   2           1HB      SER   2  20.019  -0.220   9.966
    9    HB3  SER   2           2HB      SER   2  21.293  -1.216   9.249
   10    HG   SER   2           HG       SER   2  19.166  -2.124   9.025
   11    H    SER   3           H        SER   3  20.224   0.934  12.232
   12    HA   SER   3           HA       SER   3  19.177  -0.009  14.766
   13    HB2  SER   3           1HB      SER   3  18.774   2.665  13.384
   14    HB3  SER   3           2HB      SER   3  18.525   2.314  15.102
   15    HG   SER   3           HG       SER   3  20.752   1.907  15.303
   16    H    GLY   4           H        GLY   4  17.772  -0.084  11.652
   17    HA2  GLY   4           1HA      GLY   4  15.277  -1.125  12.395
   18    HA3  GLY   4           2HA      GLY   4  15.051   0.619  12.254
   19    H    SER   5           H        SER   5  13.511  -0.159  10.580
   20    HA   SER   5           HA       SER   5  14.410  -1.267   8.078
   21    HB2  SER   5           1HB      SER   5  12.072  -1.358   8.988
   22    HB3  SER   5           2HB      SER   5  11.903   0.366   8.594
   23    HG   SER   5           HG       SER   5  11.128  -0.994   6.912
   24    H    SER   6           H        SER   6  14.498  -0.259   6.010
   25    HA   SER   6           HA       SER   6  14.954   2.651   5.812
   26    HB2  SER   6           1HB      SER   6  17.225   2.398   4.945
   27    HB3  SER   6           2HB      SER   6  17.114   1.776   6.596
   28    HG   SER   6           HG       SER   6  18.275   0.356   5.212
   29    H    GLY   7           H        GLY   7  15.590   3.274   3.539
   30    HA2  GLY   7           1HA      GLY   7  15.450   3.091   1.212
   31    HA3  GLY   7           2HA      GLY   7  14.769   1.478   1.353
   32    H    LYS   8           H        LYS   8  13.573   2.627  -0.482
   33    HA   LYS   8           HA       LYS   8  11.590   4.638   0.110
   34    HB2  LYS   8           1HB      LYS   8  12.763   4.366  -2.042
   35    HB3  LYS   8           2HB      LYS   8  11.953   2.834  -2.333
   36    HG2  LYS   8           1HG      LYS   8  10.340   5.370  -1.900
   37    HG3  LYS   8           2HG      LYS   8  11.147   5.083  -3.440
   38    HD2  LYS   8           1HD      LYS   8   9.960   2.894  -3.660
   39    HD3  LYS   8           2HD      LYS   8   9.016   3.271  -2.224
   40    HE2  LYS   8           1HE      LYS   8   9.083   4.865  -4.825
   41    HE3  LYS   8           2HE      LYS   8   7.801   3.772  -4.298
   42    HZ1  LYS   8           3HZ      LYS   8   7.469   5.263  -2.357
   43    HZ2  LYS   8           1HZ      LYS   8   7.156   6.006  -3.786
   44    HZ3  LYS   8           2HZ      LYS   8   8.541   6.327  -2.987
   45    H    ILE   9           H        ILE   9   9.505   4.567   0.474
   46    HA   ILE   9           HA       ILE   9   8.054   1.979   0.716
   47    HB   ILE   9           HB       ILE   9   6.870   3.097   2.677
   48   HG12  ILE   9          1HG1      ILE   9   8.215   4.678   4.019
   49   HG13  ILE   9          2HG1      ILE   9   9.350   4.893   2.715
   50   HG21  ILE   9          1HG2      ILE   9   8.555   2.315   4.254
   51   HG22  ILE   9          2HG2      ILE   9   8.464   1.224   2.867
   52   HG23  ILE   9          3HG2      ILE   9   9.810   2.377   3.000
   53   HD11  ILE   9          3HD1      ILE   9   7.689   6.044   1.370
   54   HD12  ILE   9          1HD1      ILE   9   6.383   5.576   2.489
   55   HD13  ILE   9          2HD1      ILE   9   7.635   6.727   2.996
   56    H    PHE  10           H        PHE  10   5.706   2.263   0.804
   57    HA   PHE  10           HA       PHE  10   4.730   4.298  -1.180
   58    HB2  PHE  10           1HB      PHE  10   4.050   1.347  -0.864
   59    HB3  PHE  10           2HB      PHE  10   3.189   2.459  -1.909
   60    HD1  PHE  10           2HD      PHE  10   6.448   0.734  -1.397
   61    HD2  PHE  10           1HD      PHE  10   4.043   3.150  -4.042
   62    HE1  PHE  10           2HE      PHE  10   8.011   0.246  -3.270
   63    HE2  PHE  10           1HE      PHE  10   5.594   2.643  -5.913
   64    HZ   PHE  10           HZ       PHE  10   7.549   1.163  -5.542
   65    H    THR  11           H        THR  11   3.098   5.566  -0.445
   66    HA   THR  11           HA       THR  11   1.824   4.859   2.160
   67    HB   THR  11           HB       THR  11   1.936   7.619   0.934
   68    HG1  THR  11           1HG      THR  11   3.782   7.959   2.135
   69   HG21  THR  11          3HG2      THR  11   1.850   8.253   3.376
   70   HG22  THR  11          1HG2      THR  11   1.635   6.535   3.775
   71   HG23  THR  11          2HG2      THR  11   0.408   7.402   2.814
   72    H    CYS  12           H        CYS  12  -0.287   4.657   2.416
   73    HA   CYS  12           HA       CYS  12  -2.188   4.743   0.249
   74    HB2  CYS  12           1HB      CYS  12  -2.266   3.194   2.161
   75    HB3  CYS  12           2HB      CYS  12  -2.484   4.564   3.268
   76    H    GLU  13           H        GLU  13  -3.223   6.435  -0.564
   77    HA   GLU  13           HA       GLU  13  -3.007   9.071   0.648
   78    HB2  GLU  13           1HB      GLU  13  -4.166   9.879  -1.300
   79    HB3  GLU  13           2HB      GLU  13  -2.917   8.734  -1.786
   80    HG2  GLU  13           1HG      GLU  13  -4.658   6.966  -2.052
   81    HG3  GLU  13           2HG      GLU  13  -5.901   8.137  -1.597
   82    H    TYR  14           H        TYR  14  -5.088   6.522   1.297
   83    HA   TYR  14           HA       TYR  14  -7.459   8.211   1.916
   84    HB2  TYR  14           1HB      TYR  14  -7.085   5.217   1.798
   85    HB3  TYR  14           2HB      TYR  14  -8.600   6.041   2.103
   86    HD1  TYR  14           1HD      TYR  14  -9.692   7.401   0.298
   87    HD2  TYR  14           2HD      TYR  14  -6.223   4.942  -0.470
   88    HE1  TYR  14           1HE      TYR  14 -10.174   7.472  -2.148
   89    HE2  TYR  14           2HE      TYR  14  -6.707   5.026  -2.906
   90    HH   TYR  14           HH       TYR  14  -8.105   5.797  -4.549
   91    H    CYS  15           H        CYS  15  -5.108   6.077   3.547
   92    HA   CYS  15           HA       CYS  15  -6.097   7.094   6.162
   93    HB2  CYS  15           1HB      CYS  15  -6.005   4.950   7.186
   94    HB3  CYS  15           2HB      CYS  15  -7.116   4.928   5.822
   95    H    ASN  16           H        ASN  16  -3.457   7.049   4.233
   96    HA   ASN  16           HA       ASN  16  -1.274   7.467   4.476
   97    HB2  ASN  16           1HB      ASN  16  -2.074   8.566   7.180
   98    HB3  ASN  16           2HB      ASN  16  -0.542   8.855   6.366
   99   HD21  ASN  16          1HD2      ASN  16  -3.979   9.645   6.341
  100   HD22  ASN  16          2HD2      ASN  16  -3.827  10.910   5.130
  101    H    LYS  17           H        LYS  17  -2.182   4.758   5.352
  102    HA   LYS  17           HA       LYS  17  -0.030   3.803   7.092
  103    HB2  LYS  17           1HB      LYS  17  -2.244   2.680   6.943
  104    HB3  LYS  17           2HB      LYS  17  -1.925   2.272   5.254
  105    HG2  LYS  17           1HG      LYS  17  -0.058   0.845   5.882
  106    HG3  LYS  17           2HG      LYS  17  -0.127   1.406   7.563
  107    HD2  LYS  17           1HD      LYS  17  -2.313   0.356   7.876
  108    HD3  LYS  17           2HD      LYS  17  -2.364  -0.132   6.170
  109    HE2  LYS  17           1HE      LYS  17  -0.340  -1.520   6.489
  110    HE3  LYS  17           2HE      LYS  17  -0.227  -0.996   8.174
  111    HZ1  LYS  17           3HZ      LYS  17  -1.305  -3.160   8.004
  112    HZ2  LYS  17           1HZ      LYS  17  -2.481  -2.569   7.039
  113    HZ3  LYS  17           2HZ      LYS  17  -2.369  -2.076   8.594
  114    H    VAL  18           H        VAL  18   1.834   2.781   6.461
  115    HA   VAL  18           HA       VAL  18   2.681   3.154   3.631
  116    HB   VAL  18           HB       VAL  18   5.051   3.069   4.707
  117   HG11  VAL  18          1HG1      VAL  18   4.130   4.932   3.442
  118   HG12  VAL  18          2HG1      VAL  18   3.313   5.537   4.907
  119   HG13  VAL  18          3HG1      VAL  18   5.086   5.492   4.819
  120   HG21  VAL  18          3HG2      VAL  18   3.491   4.292   7.013
  121   HG22  VAL  18          1HG2      VAL  18   4.235   2.668   7.060
  122   HG23  VAL  18          2HG2      VAL  18   5.249   4.114   6.874
  123    H    PHE  19           H        PHE  19   3.763   1.697   2.532
  124    HA   PHE  19           HA       PHE  19   4.072  -1.070   3.621
  125    HB2  PHE  19           1HB      PHE  19   3.047  -0.249   0.885
  126    HB3  PHE  19           2HB      PHE  19   3.255  -1.889   1.462
  127    HD1  PHE  19           2HD      PHE  19   1.211   1.199   1.863
  128    HD2  PHE  19           1HD      PHE  19   1.629  -2.970   2.874
  129    HE1  PHE  19           2HE      PHE  19  -1.031   1.237   2.938
  130    HE2  PHE  19           1HE      PHE  19  -0.629  -2.944   3.910
  131    HZ   PHE  19           HZ       PHE  19  -1.937  -0.833   3.973
  132    H    LYS  20           H        LYS  20   5.548  -2.412   2.464
  133    HA   LYS  20           HA       LYS  20   8.045  -1.010   1.866
  134    HB2  LYS  20           1HB      LYS  20   7.378  -3.981   1.987
  135    HB3  LYS  20           2HB      LYS  20   9.004  -3.272   1.941
  136    HG2  LYS  20           1HG      LYS  20   8.467  -2.056   4.090
  137    HG3  LYS  20           2HG      LYS  20   6.923  -2.932   4.149
  138    HD2  LYS  20           1HD      LYS  20   8.167  -5.102   4.182
  139    HD3  LYS  20           2HD      LYS  20   9.692  -4.218   4.079
  140    HE2  LYS  20           1HE      LYS  20   9.421  -4.844   6.354
  141    HE3  LYS  20           2HE      LYS  20   9.180  -3.099   6.255
  142    HZ1  LYS  20           3HZ      LYS  20   7.502  -4.189   7.650
  143    HZ2  LYS  20           1HZ      LYS  20   6.998  -5.120   6.411
  144    HZ3  LYS  20           2HZ      LYS  20   6.773  -3.498   6.367
  145    H    PHE  21           H        PHE  21   5.613  -2.541  -0.076
  146    HA   PHE  21           HA       PHE  21   7.233  -2.192  -2.547
  147    HB2  PHE  21           1HB      PHE  21   5.529  -4.619  -1.859
  148    HB3  PHE  21           2HB      PHE  21   6.428  -4.354  -3.342
  149    HD1  PHE  21           2HD      PHE  21   9.014  -4.157  -3.194
  150    HD2  PHE  21           1HD      PHE  21   6.557  -5.703  -0.004
  151    HE1  PHE  21           2HE      PHE  21  11.008  -5.239  -2.178
  152    HE2  PHE  21           1HE      PHE  21   8.555  -6.772   1.017
  153    HZ   PHE  21           HZ       PHE  21  10.782  -6.542  -0.069
  154    H    LYS  22           H        LYS  22   6.001  -1.901  -4.462
  155    HA   LYS  22           HA       LYS  22   3.770  -0.196  -4.190
  156    HB2  LYS  22           1HB      LYS  22   5.382  -0.315  -6.134
  157    HB3  LYS  22           2HB      LYS  22   4.575  -1.791  -6.670
  158    HG2  LYS  22           1HG      LYS  22   2.435  -0.546  -6.816
  159    HG3  LYS  22           2HG      LYS  22   3.255   0.942  -6.305
  160    HD2  LYS  22           1HD      LYS  22   4.726   0.819  -8.308
  161    HD3  LYS  22           2HD      LYS  22   3.888  -0.660  -8.829
  162    HE2  LYS  22           1HE      LYS  22   1.745   0.598  -8.941
  163    HE3  LYS  22           2HE      LYS  22   2.577   2.068  -8.415
  164    HZ1  LYS  22           3HZ      LYS  22   3.925   1.953 -10.446
  165    HZ2  LYS  22           1HZ      LYS  22   2.341   2.002 -10.832
  166    HZ3  LYS  22           2HZ      LYS  22   3.158   0.594 -10.933
  167    H    HIS  23           H        HIS  23   3.773  -3.615  -5.249
  168    HA   HIS  23           HA       HIS  23   0.978  -3.822  -5.653
  169    HB2  HIS  23           1HB      HIS  23   1.393  -6.280  -5.564
  170    HB3  HIS  23           2HB      HIS  23   2.466  -5.401  -6.641
  171    HD1  HIS  23           1HD      HIS  23   5.013  -5.871  -6.306
  172    HD2  HIS  23           2HD      HIS  23   2.584  -7.000  -3.058
  173    HE1  HIS  23           1HE      HIS  23   6.535  -7.085  -4.663
  174    H    SER  24           H        SER  24   2.761  -3.892  -2.667
  175    HA   SER  24           HA       SER  24   0.734  -5.230  -1.050
  176    HB2  SER  24           1HB      SER  24   3.069  -3.434  -0.305
  177    HB3  SER  24           2HB      SER  24   1.987  -4.219   0.844
  178    HG   SER  24           HG       SER  24   3.786  -5.550   0.506
  179    H    LEU  25           H        LEU  25   1.585  -1.783  -1.655
  180    HA   LEU  25           HA       LEU  25  -0.613  -0.710  -0.128
  181    HB2  LEU  25           1HB      LEU  25   1.259   0.715  -0.689
  182    HB3  LEU  25           2HB      LEU  25   1.082   0.377  -2.413
  183    HG   LEU  25           HG       LEU  25  -1.091   1.559  -2.460
  184   HD11  LEU  25          1HD1      LEU  25  -0.514   2.322   0.434
  185   HD12  LEU  25          2HD1      LEU  25  -1.780   1.184  -0.074
  186   HD13  LEU  25          3HD1      LEU  25  -1.873   2.857  -0.584
  187   HD21  LEU  25          3HD2      LEU  25   0.994   2.775  -2.917
  188   HD22  LEU  25          1HD2      LEU  25   1.102   3.213  -1.193
  189   HD23  LEU  25          2HD2      LEU  25  -0.244   3.813  -2.185
  190    H    GLN  26           H        GLN  26  -0.208  -1.585  -3.569
  191    HA   GLN  26           HA       GLN  26  -2.698  -0.487  -4.464
  192    HB2  GLN  26           1HB      GLN  26  -0.965  -2.705  -5.609
  193    HB3  GLN  26           2HB      GLN  26  -2.386  -2.084  -6.433
  194    HG2  GLN  26           1HG      GLN  26   0.010  -0.365  -5.650
  195    HG3  GLN  26           2HG      GLN  26  -0.239  -1.088  -7.235
  196   HE21  GLN  26          1HE2      GLN  26  -2.448  -0.440  -8.328
  197   HE22  GLN  26          2HE2      GLN  26  -2.911   1.236  -8.079
  198    H    ALA  27           H        ALA  27  -1.998  -3.696  -3.180
  199    HA   ALA  27           HA       ALA  27  -4.672  -4.774  -3.511
  200    HB1  ALA  27           1HB      ALA  27  -2.639  -6.143  -3.270
  201    HB2  ALA  27           2HB      ALA  27  -2.366  -5.454  -1.651
  202    HB3  ALA  27           3HB      ALA  27  -3.788  -6.485  -1.949
  203    H    HIS  28           H        HIS  28  -3.011  -3.015  -0.839
  204    HA   HIS  28           HA       HIS  28  -5.131  -3.242   1.079
  205    HB2  HIS  28           1HB      HIS  28  -2.993  -2.626   1.860
  206    HB3  HIS  28           2HB      HIS  28  -2.809  -1.334   0.689
  207    HD1  HIS  28           1HD      HIS  28  -4.761  -2.058   3.937
  208    HD2  HIS  28           2HD      HIS  28  -3.748   1.050   1.291
  209    HE1  HIS  28           1HE      HIS  28  -5.470   0.091   5.089
  210    H    LEU  29           H        LEU  29  -4.669  -0.961  -1.641
  211    HA   LEU  29           HA       LEU  29  -6.670   0.919  -1.010
  212    HB2  LEU  29           1HB      LEU  29  -6.094  -0.181  -3.786
  213    HB3  LEU  29           2HB      LEU  29  -6.865   1.352  -3.397
  214    HG   LEU  29           HG       LEU  29  -3.989   0.572  -2.888
  215   HD11  LEU  29          1HD1      LEU  29  -3.492   2.360  -4.468
  216   HD12  LEU  29          2HD1      LEU  29  -5.230   2.685  -4.670
  217   HD13  LEU  29          3HD1      LEU  29  -4.535   1.124  -5.192
  218   HD21  LEU  29          3HD2      LEU  29  -5.522   3.099  -2.099
  219   HD22  LEU  29          1HD2      LEU  29  -3.745   3.020  -2.170
  220   HD23  LEU  29          2HD2      LEU  29  -4.627   2.011  -1.021
  221    H    ARG  30           H        ARG  30  -7.154  -2.382  -2.076
  222    HA   ARG  30           HA       ARG  30  -9.784  -2.134  -3.122
  223    HB2  ARG  30           1HB      ARG  30  -8.569  -4.552  -1.744
  224    HB3  ARG  30           2HB      ARG  30  -9.952  -4.530  -2.854
  225    HG2  ARG  30           1HG      ARG  30  -8.541  -3.824  -4.717
  226    HG3  ARG  30           2HG      ARG  30  -7.133  -3.680  -3.664
  227    HD2  ARG  30           1HD      ARG  30  -7.266  -6.091  -3.135
  228    HD3  ARG  30           2HD      ARG  30  -8.638  -6.253  -4.254
  229    HE   ARG  30           HE       ARG  30  -6.624  -5.057  -5.762
  230   HH11  ARG  30          2HH2      ARG  30  -6.894  -8.111  -4.069
  231   HH12  ARG  30          1HH2      ARG  30  -5.756  -8.903  -5.126
  232   HH21  ARG  30          2HH1      ARG  30  -5.188  -6.129  -7.080
  233   HH22  ARG  30          1HH1      ARG  30  -4.824  -7.803  -6.786
  234    H    ILE  31           H        ILE  31  -8.828  -2.006   0.231
  235    HA   ILE  31           HA       ILE  31 -11.537  -2.535   1.229
  236    HB   ILE  31           HB       ILE  31 -10.791  -2.143   3.359
  237   HG12  ILE  31          1HG1      ILE  31  -8.407  -0.591   2.311
  238   HG13  ILE  31          2HG1      ILE  31  -9.778   0.024   3.219
  239   HG21  ILE  31          1HG2      ILE  31  -8.954  -3.659   3.637
  240   HG22  ILE  31          2HG2      ILE  31  -9.839  -4.170   2.199
  241   HG23  ILE  31          3HG2      ILE  31  -8.304  -3.287   2.029
  242   HD11  ILE  31          3HD1      ILE  31  -7.939  -0.122   4.718
  243   HD12  ILE  31          1HD1      ILE  31  -9.098  -1.384   5.173
  244   HD13  ILE  31          2HD1      ILE  31  -7.612  -1.810   4.285
  245    H    HIS  32           H        HIS  32  -9.803   0.215   0.047
  246    HA   HIS  32           HA       HIS  32 -11.661   2.230   1.103
  247    HB2  HIS  32           1HB      HIS  32  -9.133   2.376  -0.593
  248    HB3  HIS  32           2HB      HIS  32 -10.027   3.759  -0.048
  249    HD1  HIS  32           1HD      HIS  32 -10.309   3.645   2.916
  250    HD2  HIS  32           2HD      HIS  32  -7.049   1.980   0.862
  251    HE1  HIS  32           1HE      HIS  32  -8.405   3.564   4.595
  252    H    THR  33           H        THR  33 -10.973   0.556  -1.986
  253    HA   THR  33           HA       THR  33 -12.617   2.296  -3.621
  254    HB   THR  33           HB       THR  33 -12.536   0.496  -5.293
  255    HG1  THR  33           1HG      THR  33 -11.511  -1.394  -4.847
  256   HG21  THR  33          3HG2      THR  33 -10.134   0.393  -5.680
  257   HG22  THR  33          1HG2      THR  33  -9.802   0.907  -4.021
  258   HG23  THR  33          2HG2      THR  33 -10.591   2.027  -5.153
  259    H    ASN  34           H        ASN  34 -13.330  -0.629  -1.750
  260    HA   ASN  34           HA       ASN  34 -16.020  -0.901  -2.897
  261    HB2  ASN  34           1HB      ASN  34 -14.430  -2.486  -0.851
  262    HB3  ASN  34           2HB      ASN  34 -16.125  -2.811  -1.199
  263   HD21  ASN  34          1HD2      ASN  34 -12.849  -3.057  -2.500
  264   HD22  ASN  34          2HD2      ASN  34 -13.335  -3.996  -3.907
  265    H    GLU  35           H        GLU  35 -17.935  -0.522  -1.985
  266    HA   GLU  35           HA       GLU  35 -18.070   1.234   0.394
  267    HB2  GLU  35           1HB      GLU  35 -20.341   1.671  -0.255
  268    HB3  GLU  35           2HB      GLU  35 -19.246   1.994  -1.585
  269    HG2  GLU  35           1HG      GLU  35 -20.800  -0.623  -1.390
  270    HG3  GLU  35           2HG      GLU  35 -21.511   0.836  -2.054
  271    H    LYS  36           H        LYS  36 -19.870   0.914   1.937
  272    HA   LYS  36           HA       LYS  36 -20.436  -1.926   2.649
  273    HB2  LYS  36           1HB      LYS  36 -19.257   0.164   4.529
  274    HB3  LYS  36           2HB      LYS  36 -19.854  -1.432   4.999
  275    HG2  LYS  36           1HG      LYS  36 -18.134  -2.500   3.538
  276    HG3  LYS  36           2HG      LYS  36 -17.507  -0.891   3.130
  277    HD2  LYS  36           1HD      LYS  36 -17.024  -0.486   5.556
  278    HD3  LYS  36           2HD      LYS  36 -17.617  -2.112   5.918
  279    HE2  LYS  36           1HE      LYS  36 -15.235  -2.243   5.846
  280    HE3  LYS  36           2HE      LYS  36 -15.855  -3.070   4.415
  281    HZ1  LYS  36           3HZ      LYS  36 -13.980  -1.604   3.882
  282    HZ2  LYS  36           1HZ      LYS  36 -14.769  -0.298   4.452
  283    HZ3  LYS  36           2HZ      LYS  36 -15.312  -1.067   3.115
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1   9.930   5.666  11.077
    2    H2   GLY   1           2H       GLY   1   9.339   6.070  12.551
    3    H3   GLY   1           3H       GLY   1  10.921   6.318  12.203
    4    HA2  GLY   1           1HA      GLY   1   8.656   7.698  10.914
    5    HA3  GLY   1           2HA      GLY   1   9.712   8.406  12.150
    6    H    SER   2           H        SER   2   9.313   9.517   9.572
    7    HA   SER   2           HA       SER   2  11.092   8.742   7.568
    8    HB2  SER   2           1HB      SER   2  10.072  11.552   8.119
    9    HB3  SER   2           2HB      SER   2  10.631  10.908   6.562
   10    HG   SER   2           HG       SER   2   8.339  10.856   6.749
   11    H    SER   3           H        SER   3  11.923  10.590  10.422
   12    HA   SER   3           HA       SER   3  14.392  11.721   9.417
   13    HB2  SER   3           1HB      SER   3  13.529  11.210  12.284
   14    HB3  SER   3           2HB      SER   3  14.821  12.297  11.741
   15    HG   SER   3           HG       SER   3  12.864  13.427  12.149
   16    H    GLY   4           H        GLY   4  13.635   8.494  10.156
   17    HA2  GLY   4           1HA      GLY   4  16.208   7.608  11.226
   18    HA3  GLY   4           2HA      GLY   4  14.876   6.613  10.649
   19    H    SER   5           H        SER   5  16.612   5.294   9.753
   20    HA   SER   5           HA       SER   5  18.319   6.173   7.617
   21    HB2  SER   5           1HB      SER   5  18.659   4.139   9.050
   22    HB3  SER   5           2HB      SER   5  17.350   3.345   8.150
   23    HG   SER   5           HG       SER   5  19.459   2.901   7.293
   24    H    SER   6           H        SER   6  18.189   5.834   5.370
   25    HA   SER   6           HA       SER   6  15.532   6.321   4.293
   26    HB2  SER   6           1HB      SER   6  16.746   6.741   2.177
   27    HB3  SER   6           2HB      SER   6  17.333   7.697   3.545
   28    HG   SER   6           HG       SER   6  19.052   6.787   2.317
   29    H    GLY   7           H        GLY   7  14.570   5.306   2.500
   30    HA2  GLY   7           1HA      GLY   7  15.350   2.958   1.178
   31    HA3  GLY   7           2HA      GLY   7  14.420   2.444   2.589
   32    H    LYS   8           H        LYS   8  13.481   1.815   0.114
   33    HA   LYS   8           HA       LYS   8  11.563   3.756  -0.906
   34    HB2  LYS   8           1HB      LYS   8  12.641   2.065  -2.356
   35    HB3  LYS   8           2HB      LYS   8  11.891   0.775  -1.429
   36    HG2  LYS   8           1HG      LYS   8  10.693   1.090  -3.505
   37    HG3  LYS   8           2HG      LYS   8   9.652   1.478  -2.146
   38    HD2  LYS   8           1HD      LYS   8   9.296   3.042  -3.967
   39    HD3  LYS   8           2HD      LYS   8   9.960   3.906  -2.582
   40    HE2  LYS   8           1HE      LYS   8  12.220   3.846  -3.623
   41    HE3  LYS   8           2HE      LYS   8  11.571   2.923  -4.985
   42    HZ1  LYS   8           3HZ      LYS   8  11.720   5.289  -5.508
   43    HZ2  LYS   8           1HZ      LYS   8  10.751   5.689  -4.260
   44    HZ3  LYS   8           2HZ      LYS   8  10.154   4.834  -5.519
   45    H    ILE   9           H        ILE   9   9.561   4.122  -0.297
   46    HA   ILE   9           HA       ILE   9   7.913   2.031   0.944
   47    HB   ILE   9           HB       ILE   9   6.896   3.657   2.538
   48   HG12  ILE   9          1HG1      ILE   9   9.404   5.350   2.216
   49   HG13  ILE   9          2HG1      ILE   9   7.915   5.719   1.346
   50   HG21  ILE   9          1HG2      ILE   9   8.511   1.892   3.225
   51   HG22  ILE   9          2HG2      ILE   9   9.826   3.083   3.112
   52   HG23  ILE   9          3HG2      ILE   9   8.517   3.303   4.288
   53   HD11  ILE   9          3HD1      ILE   9   8.055   7.048   3.380
   54   HD12  ILE   9          1HD1      ILE   9   6.672   5.944   3.438
   55   HD13  ILE   9          2HD1      ILE   9   8.145   5.583   4.375
   56    H    PHE  10           H        PHE  10   5.669   2.433   0.839
   57    HA   PHE  10           HA       PHE  10   4.694   4.398  -1.198
   58    HB2  PHE  10           1HB      PHE  10   4.047   1.432  -0.900
   59    HB3  PHE  10           2HB      PHE  10   3.091   2.547  -1.852
   60    HD1  PHE  10           2HD      PHE  10   6.429   0.910  -1.621
   61    HD2  PHE  10           1HD      PHE  10   3.746   3.268  -4.038
   62    HE1  PHE  10           2HE      PHE  10   7.854   0.491  -3.616
   63    HE2  PHE  10           1HE      PHE  10   5.169   2.845  -6.028
   64    HZ   PHE  10           HZ       PHE  10   7.202   1.438  -5.828
   65    H    THR  11           H        THR  11   2.980   5.590  -0.453
   66    HA   THR  11           HA       THR  11   1.801   4.861   2.204
   67    HB   THR  11           HB       THR  11   1.952   7.631   0.994
   68    HG1  THR  11           1HG      THR  11   3.770   7.947   2.227
   69   HG21  THR  11          3HG2      THR  11   1.550   6.546   3.823
   70   HG22  THR  11          1HG2      THR  11   0.372   7.445   2.829
   71   HG23  THR  11          2HG2      THR  11   1.817   8.261   3.437
   72    H    CYS  12           H        CYS  12  -0.317   4.641   2.454
   73    HA   CYS  12           HA       CYS  12  -2.205   4.711   0.291
   74    HB2  CYS  12           1HB      CYS  12  -2.275   3.186   2.235
   75    HB3  CYS  12           2HB      CYS  12  -2.518   4.576   3.312
   76    H    GLU  13           H        GLU  13  -3.242   6.389  -0.549
   77    HA   GLU  13           HA       GLU  13  -3.052   9.040   0.630
   78    HB2  GLU  13           1HB      GLU  13  -4.221   9.810  -1.330
   79    HB3  GLU  13           2HB      GLU  13  -2.958   8.673  -1.798
   80    HG2  GLU  13           1HG      GLU  13  -4.676   6.883  -2.048
   81    HG3  GLU  13           2HG      GLU  13  -5.935   8.042  -1.604
   82    H    TYR  14           H        TYR  14  -5.115   6.487   1.314
   83    HA   TYR  14           HA       TYR  14  -7.499   8.168   1.902
   84    HB2  TYR  14           1HB      TYR  14  -7.113   5.173   1.820
   85    HB3  TYR  14           2HB      TYR  14  -8.633   6.000   2.090
   86    HD1  TYR  14           1HD      TYR  14  -9.686   7.347   0.246
   87    HD2  TYR  14           2HD      TYR  14  -6.227   4.846  -0.427
   88    HE1  TYR  14           1HE      TYR  14 -10.142   7.368  -2.201
   89    HE2  TYR  14           2HE      TYR  14  -6.691   4.878  -2.873
   90    HH   TYR  14           HH       TYR  14  -9.473   6.647  -4.271
   91    H    CYS  15           H        CYS  15  -5.151   6.051   3.562
   92    HA   CYS  15           HA       CYS  15  -6.162   7.082   6.165
   93    HB2  CYS  15           1HB      CYS  15  -6.065   4.948   7.205
   94    HB3  CYS  15           2HB      CYS  15  -7.163   4.905   5.830
   95    H    ASN  16           H        ASN  16  -3.507   7.039   4.252
   96    HA   ASN  16           HA       ASN  16  -1.323   7.440   4.501
   97    HB2  ASN  16           1HB      ASN  16  -2.121   8.557   7.198
   98    HB3  ASN  16           2HB      ASN  16  -0.584   8.828   6.390
   99   HD21  ASN  16          1HD2      ASN  16  -4.019   9.639   6.333
  100   HD22  ASN  16          2HD2      ASN  16  -3.847  10.903   5.124
  101    H    LYS  17           H        LYS  17  -2.247   4.743   5.353
  102    HA   LYS  17           HA       LYS  17  -0.135   3.764   7.129
  103    HB2  LYS  17           1HB      LYS  17  -2.347   2.641   6.924
  104    HB3  LYS  17           2HB      LYS  17  -1.992   2.252   5.237
  105    HG2  LYS  17           1HG      LYS  17  -0.129   0.829   5.890
  106    HG3  LYS  17           2HG      LYS  17  -0.245   1.364   7.577
  107    HD2  LYS  17           1HD      LYS  17  -2.436   0.298   7.812
  108    HD3  LYS  17           2HD      LYS  17  -2.426  -0.175   6.099
  109    HE2  LYS  17           1HE      LYS  17  -0.401  -1.547   6.471
  110    HE3  LYS  17           2HE      LYS  17  -0.343  -1.035   8.161
  111    HZ1  LYS  17           3HZ      LYS  17  -2.545  -2.624   6.949
  112    HZ2  LYS  17           1HZ      LYS  17  -2.485  -2.140   8.510
  113    HZ3  LYS  17           2HZ      LYS  17  -1.392  -3.208   7.945
  114    H    VAL  18           H        VAL  18   1.752   2.776   6.526
  115    HA   VAL  18           HA       VAL  18   2.633   3.172   3.709
  116    HB   VAL  18           HB       VAL  18   4.988   3.131   4.812
  117   HG11  VAL  18          1HG1      VAL  18   4.922   5.576   5.006
  118   HG12  VAL  18          2HG1      VAL  18   4.054   4.999   3.575
  119   HG13  VAL  18          3HG1      VAL  18   3.150   5.534   5.017
  120   HG21  VAL  18          3HG2      VAL  18   4.149   2.689   7.154
  121   HG22  VAL  18          1HG2      VAL  18   5.144   4.150   6.983
  122   HG23  VAL  18          2HG2      VAL  18   3.381   4.306   7.107
  123    H    PHE  19           H        PHE  19   3.752   1.771   2.629
  124    HA   PHE  19           HA       PHE  19   4.164  -1.004   3.654
  125    HB2  PHE  19           1HB      PHE  19   3.092  -0.180   0.926
  126    HB3  PHE  19           2HB      PHE  19   3.371  -1.817   1.496
  127    HD1  PHE  19           2HD      PHE  19   1.226   1.199   1.921
  128    HD2  PHE  19           1HD      PHE  19   1.746  -2.972   2.858
  129    HE1  PHE  19           2HE      PHE  19  -1.031   1.156   2.972
  130    HE2  PHE  19           1HE      PHE  19  -0.529  -3.032   3.856
  131    HZ   PHE  19           HZ       PHE  19  -1.899  -0.958   3.940
  132    H    LYS  20           H        LYS  20   5.716  -2.231   2.317
  133    HA   LYS  20           HA       LYS  20   8.066  -0.561   1.696
  134    HB2  LYS  20           1HB      LYS  20   7.720  -3.583   1.792
  135    HB3  LYS  20           2HB      LYS  20   9.257  -2.700   1.683
  136    HG2  LYS  20           1HG      LYS  20   8.626  -1.550   3.876
  137    HG3  LYS  20           2HG      LYS  20   7.262  -2.680   3.991
  138    HD2  LYS  20           1HD      LYS  20   8.889  -4.591   3.880
  139    HD3  LYS  20           2HD      LYS  20  10.222  -3.411   3.855
  140    HE2  LYS  20           1HE      LYS  20   9.455  -2.511   6.044
  141    HE3  LYS  20           2HE      LYS  20   8.142  -3.697   6.070
  142    HZ1  LYS  20           3HZ      LYS  20   9.824  -5.462   6.097
  143    HZ2  LYS  20           1HZ      LYS  20  10.049  -4.462   7.365
  144    HZ3  LYS  20           2HZ      LYS  20  11.039  -4.368   6.073
  145    H    PHE  21           H        PHE  21   5.716  -2.330  -0.158
  146    HA   PHE  21           HA       PHE  21   7.230  -1.850  -2.682
  147    HB2  PHE  21           1HB      PHE  21   5.638  -4.347  -2.023
  148    HB3  PHE  21           2HB      PHE  21   6.638  -4.057  -3.434
  149    HD1  PHE  21           2HD      PHE  21   9.213  -3.612  -2.977
  150    HD2  PHE  21           1HD      PHE  21   6.534  -5.508  -0.179
  151    HE1  PHE  21           2HE      PHE  21  11.156  -4.594  -1.778
  152    HE2  PHE  21           1HE      PHE  21   8.479  -6.481   1.022
  153    HZ   PHE  21           HZ       PHE  21  10.792  -6.025   0.224
  154    H    LYS  22           H        LYS  22   5.928  -1.766  -4.603
  155    HA   LYS  22           HA       LYS  22   3.647  -0.113  -4.343
  156    HB2  LYS  22           1HB      LYS  22   5.171  -0.191  -6.318
  157    HB3  LYS  22           2HB      LYS  22   4.520  -1.775  -6.753
  158    HG2  LYS  22           1HG      LYS  22   2.270  -0.792  -6.984
  159    HG3  LYS  22           2HG      LYS  22   2.881   0.789  -6.483
  160    HD2  LYS  22           1HD      LYS  22   2.627   0.789  -8.879
  161    HD3  LYS  22           2HD      LYS  22   4.351   0.861  -8.488
  162    HE2  LYS  22           1HE      LYS  22   4.559  -1.574  -8.941
  163    HE3  LYS  22           2HE      LYS  22   2.825  -1.668  -9.276
  164    HZ1  LYS  22           3HZ      LYS  22   4.116  -1.475 -11.323
  165    HZ2  LYS  22           1HZ      LYS  22   4.777  -0.064 -10.843
  166    HZ3  LYS  22           2HZ      LYS  22   3.176  -0.154 -11.155
  167    H    HIS  23           H        HIS  23   3.726  -3.550  -5.341
  168    HA   HIS  23           HA       HIS  23   0.942  -3.866  -5.624
  169    HB2  HIS  23           1HB      HIS  23   1.358  -6.228  -5.674
  170    HB3  HIS  23           2HB      HIS  23   2.668  -5.412  -6.515
  171    HD1  HIS  23           1HD      HIS  23   2.021  -7.681  -3.542
  172    HD2  HIS  23           2HD      HIS  23   5.115  -5.347  -5.178
  173    HE1  HIS  23           1HE      HIS  23   4.164  -8.410  -2.371
  174    H    SER  24           H        SER  24   2.878  -3.966  -2.723
  175    HA   SER  24           HA       SER  24   1.003  -5.246  -0.949
  176    HB2  SER  24           1HB      SER  24   3.191  -3.208  -0.382
  177    HB3  SER  24           2HB      SER  24   2.309  -4.114   0.836
  178    HG   SER  24           HG       SER  24   3.167  -6.040  -0.033
  179    H    LEU  25           H        LEU  25   1.604  -1.771  -1.656
  180    HA   LEU  25           HA       LEU  25  -0.593  -0.805  -0.046
  181    HB2  LEU  25           1HB      LEU  25   1.235   0.689  -0.613
  182    HB3  LEU  25           2HB      LEU  25   1.024   0.386  -2.338
  183    HG   LEU  25           HG       LEU  25  -1.193   1.501  -2.292
  184   HD11  LEU  25          1HD1      LEU  25  -1.955   2.731  -0.367
  185   HD12  LEU  25          2HD1      LEU  25  -0.533   2.253   0.586
  186   HD13  LEU  25          3HD1      LEU  25  -1.764   1.058   0.120
  187   HD21  LEU  25          3HD2      LEU  25  -0.401   3.771  -2.010
  188   HD22  LEU  25          1HD2      LEU  25   0.836   2.780  -2.807
  189   HD23  LEU  25          2HD2      LEU  25   1.000   3.198  -1.082
  190    H    GLN  26           H        GLN  26  -0.204  -1.623  -3.488
  191    HA   GLN  26           HA       GLN  26  -2.717  -0.594  -4.388
  192    HB2  GLN  26           1HB      GLN  26  -0.896  -2.741  -5.496
  193    HB3  GLN  26           2HB      GLN  26  -2.368  -2.273  -6.323
  194    HG2  GLN  26           1HG      GLN  26  -0.184  -0.278  -5.572
  195    HG3  GLN  26           2HG      GLN  26  -0.245  -1.119  -7.116
  196   HE21  GLN  26          1HE2      GLN  26  -0.326   1.759  -6.813
  197   HE22  GLN  26          2HE2      GLN  26  -1.892   2.261  -7.432
  198    H    ALA  27           H        ALA  27  -1.935  -3.787  -3.086
  199    HA   ALA  27           HA       ALA  27  -4.573  -4.943  -3.368
  200    HB1  ALA  27           1HB      ALA  27  -2.494  -6.240  -3.088
  201    HB2  ALA  27           2HB      ALA  27  -2.248  -5.497  -1.486
  202    HB3  ALA  27           3HB      ALA  27  -3.632  -6.582  -1.756
  203    H    HIS  28           H        HIS  28  -3.027  -2.952  -0.822
  204    HA   HIS  28           HA       HIS  28  -5.151  -3.284   1.129
  205    HB2  HIS  28           1HB      HIS  28  -3.032  -2.666   1.943
  206    HB3  HIS  28           2HB      HIS  28  -2.821  -1.379   0.774
  207    HD1  HIS  28           1HD      HIS  28  -4.779  -2.082   4.013
  208    HD2  HIS  28           2HD      HIS  28  -3.780   1.010   1.347
  209    HE1  HIS  28           1HE      HIS  28  -5.467   0.074   5.165
  210    H    LEU  29           H        LEU  29  -4.668  -1.044  -1.617
  211    HA   LEU  29           HA       LEU  29  -6.682   0.836  -1.008
  212    HB2  LEU  29           1HB      LEU  29  -6.061  -0.224  -3.786
  213    HB3  LEU  29           2HB      LEU  29  -6.802   1.320  -3.379
  214    HG   LEU  29           HG       LEU  29  -3.956   0.459  -2.832
  215   HD11  LEU  29          1HD1      LEU  29  -3.357   2.209  -4.391
  216   HD12  LEU  29          2HD1      LEU  29  -5.071   2.655  -4.591
  217   HD13  LEU  29          3HD1      LEU  29  -4.482   1.062  -5.141
  218   HD21  LEU  29          3HD2      LEU  29  -3.642   2.875  -2.078
  219   HD22  LEU  29          1HD2      LEU  29  -4.594   1.893  -0.960
  220   HD23  LEU  29          2HD2      LEU  29  -5.413   3.028  -2.051
  221    H    ARG  30           H        ARG  30  -7.135  -2.454  -2.078
  222    HA   ARG  30           HA       ARG  30  -9.772  -2.309  -3.130
  223    HB2  ARG  30           1HB      ARG  30  -8.517  -4.609  -1.593
  224    HB3  ARG  30           2HB      ARG  30  -9.885  -4.701  -2.709
  225    HG2  ARG  30           1HG      ARG  30  -8.442  -4.033  -4.600
  226    HG3  ARG  30           2HG      ARG  30  -7.044  -3.928  -3.532
  227    HD2  ARG  30           1HD      ARG  30  -8.676  -6.443  -4.055
  228    HD3  ARG  30           2HD      ARG  30  -7.110  -6.053  -4.793
  229    HE   ARG  30           HE       ARG  30  -6.709  -5.869  -2.025
  230   HH11  ARG  30          2HH1      ARG  30  -7.513  -8.462  -4.246
  231   HH12  ARG  30          1HH1      ARG  30  -6.853  -9.687  -3.195
  232   HH21  ARG  30          2HH2      ARG  30  -5.949  -7.472  -0.716
  233   HH22  ARG  30          1HH2      ARG  30  -5.971  -9.129  -1.249
  234    H    ILE  31           H        ILE  31  -8.830  -1.920   0.187
  235    HA   ILE  31           HA       ILE  31 -11.540  -2.479   1.209
  236    HB   ILE  31           HB       ILE  31 -10.791  -2.092   3.322
  237   HG12  ILE  31          1HG1      ILE  31  -8.409  -0.532   2.287
  238   HG13  ILE  31          2HG1      ILE  31  -9.789   0.078   3.183
  239   HG21  ILE  31          1HG2      ILE  31  -8.290  -3.233   2.002
  240   HG22  ILE  31          2HG2      ILE  31  -8.940  -3.602   3.609
  241   HG23  ILE  31          3HG2      ILE  31  -9.819  -4.120   2.171
  242   HD11  ILE  31          3HD1      ILE  31  -7.625  -1.745   4.271
  243   HD12  ILE  31          1HD1      ILE  31  -7.960  -0.057   4.696
  244   HD13  ILE  31          2HD1      ILE  31  -9.120  -1.321   5.145
  245    H    HIS  32           H        HIS  32  -9.803   0.229  -0.034
  246    HA   HIS  32           HA       HIS  32 -11.622   2.286   1.039
  247    HB2  HIS  32           1HB      HIS  32  -9.055   2.368  -0.600
  248    HB3  HIS  32           2HB      HIS  32  -9.929   3.777  -0.075
  249    HD1  HIS  32           1HD      HIS  32 -10.302   3.641   2.886
  250    HD2  HIS  32           2HD      HIS  32  -7.016   1.941   0.902
  251    HE1  HIS  32           1HE      HIS  32  -8.440   3.522   4.611
  252    H    THR  33           H        THR  33 -11.021   0.567  -1.999
  253    HA   THR  33           HA       THR  33 -12.284   2.390  -3.798
  254    HB   THR  33           HB       THR  33 -12.608   0.327  -5.242
  255    HG1  THR  33           1HG      THR  33 -12.698  -1.209  -3.558
  256   HG21  THR  33          3HG2      THR  33 -10.594   1.677  -5.482
  257   HG22  THR  33          1HG2      THR  33 -10.192  -0.048  -5.615
  258   HG23  THR  33          2HG2      THR  33  -9.824   0.837  -4.122
  259    H    ASN  34           H        ASN  34 -14.316   2.431  -4.758
  260    HA   ASN  34           HA       ASN  34 -16.509   0.787  -3.682
  261    HB2  ASN  34           1HB      ASN  34 -16.247   2.884  -2.232
  262    HB3  ASN  34           2HB      ASN  34 -16.651   3.834  -3.662
  263   HD21  ASN  34          1HD2      ASN  34 -18.405   4.571  -2.109
  264   HD22  ASN  34          2HD2      ASN  34 -19.868   3.598  -2.057
  265    H    GLU  35           H        GLU  35 -18.499   1.031  -4.976
  266    HA   GLU  35           HA       GLU  35 -17.894   1.209  -7.846
  267    HB2  GLU  35           1HB      GLU  35 -20.090   0.286  -8.193
  268    HB3  GLU  35           2HB      GLU  35 -19.200  -0.659  -7.005
  269    HG2  GLU  35           1HG      GLU  35 -20.477   0.453  -5.170
  270    HG3  GLU  35           2HG      GLU  35 -21.374   1.388  -6.369
  271    H    LYS  36           H        LYS  36 -19.260   2.334  -9.362
  272    HA   LYS  36           HA       LYS  36 -20.512   4.881  -8.463
  273    HB2  LYS  36           1HB      LYS  36 -18.368   4.594 -10.614
  274    HB3  LYS  36           2HB      LYS  36 -19.344   6.036 -10.369
  275    HG2  LYS  36           1HG      LYS  36 -17.400   4.886  -8.315
  276    HG3  LYS  36           2HG      LYS  36 -17.065   6.215  -9.422
  277    HD2  LYS  36           1HD      LYS  36 -18.890   7.555  -8.404
  278    HD3  LYS  36           2HD      LYS  36 -19.212   6.242  -7.253
  279    HE2  LYS  36           1HE      LYS  36 -16.894   6.406  -6.399
  280    HE3  LYS  36           2HE      LYS  36 -16.559   7.713  -7.543
  281    HZ1  LYS  36           3HZ      LYS  36 -18.586   7.833  -5.372
  282    HZ2  LYS  36           1HZ      LYS  36 -18.272   9.040  -6.428
  283    HZ3  LYS  36           2HZ      LYS  36 -17.137   8.583  -5.350
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  25.939   5.354  -1.220
    2    H2   GLY   1           2H       GLY   1  26.543   6.619  -0.374
    3    H3   GLY   1           3H       GLY   1  25.704   6.884  -1.756
    4    HA2  GLY   1           1HA      GLY   1  24.337   7.412   0.153
    5    HA3  GLY   1           2HA      GLY   1  23.675   6.057  -0.780
    6    H    SER   2           H        SER   2  23.404   6.796   2.125
    7    HA   SER   2           HA       SER   2  24.890   4.831   3.666
    8    HB2  SER   2           1HB      SER   2  23.451   5.666   5.527
    9    HB3  SER   2           2HB      SER   2  24.348   6.929   4.667
   10    HG   SER   2           HG       SER   2  22.141   7.501   5.026
   11    H    SER   3           H        SER   3  21.833   4.732   2.002
   12    HA   SER   3           HA       SER   3  21.316   1.971   3.013
   13    HB2  SER   3           1HB      SER   3  19.241   4.178   2.716
   14    HB3  SER   3           2HB      SER   3  18.880   2.467   3.004
   15    HG   SER   3           HG       SER   3  18.908   3.710   4.947
   16    H    GLY   4           H        GLY   4  20.350   0.571   1.566
   17    HA2  GLY   4           1HA      GLY   4  20.590   1.163  -1.305
   18    HA3  GLY   4           2HA      GLY   4  20.167  -0.373  -0.561
   19    H    SER   5           H        SER   5  18.737  -0.080  -2.608
   20    HA   SER   5           HA       SER   5  16.510   1.598  -2.739
   21    HB2  SER   5           1HB      SER   5  16.701  -1.264  -3.749
   22    HB3  SER   5           2HB      SER   5  15.607   0.000  -4.344
   23    HG   SER   5           HG       SER   5  17.489  -0.212  -5.654
   24    H    SER   6           H        SER   6  16.853  -1.244  -0.704
   25    HA   SER   6           HA       SER   6  14.152  -1.841  -0.117
   26    HB2  SER   6           1HB      SER   6  16.545  -1.970   1.757
   27    HB3  SER   6           2HB      SER   6  15.029  -2.880   1.904
   28    HG   SER   6           HG       SER   6  16.698  -4.126   0.929
   29    H    GLY   7           H        GLY   7  15.914   1.031   0.737
   30    HA2  GLY   7           1HA      GLY   7  14.364   1.829   3.056
   31    HA3  GLY   7           2HA      GLY   7  15.385   2.850   2.040
   32    H    LYS   8           H        LYS   8  13.467   1.658  -0.278
   33    HA   LYS   8           HA       LYS   8  11.728   3.934  -0.476
   34    HB2  LYS   8           1HB      LYS   8  12.531   2.695  -2.435
   35    HB3  LYS   8           2HB      LYS   8  11.722   1.233  -1.880
   36    HG2  LYS   8           1HG      LYS   8  10.484   2.202  -3.696
   37    HG3  LYS   8           2HG      LYS   8   9.516   2.278  -2.230
   38    HD2  LYS   8           1HD      LYS   8  10.153   4.698  -1.973
   39    HD3  LYS   8           2HD      LYS   8  11.060   4.607  -3.482
   40    HE2  LYS   8           1HE      LYS   8   8.081   3.966  -3.220
   41    HE3  LYS   8           2HE      LYS   8   8.695   5.579  -3.587
   42    HZ1  LYS   8           3HZ      LYS   8   8.120   4.387  -5.609
   43    HZ2  LYS   8           1HZ      LYS   8   9.169   3.181  -5.274
   44    HZ3  LYS   8           2HZ      LYS   8   9.724   4.686  -5.597
   45    H    ILE   9           H        ILE   9   9.650   4.253   0.011
   46    HA   ILE   9           HA       ILE   9   7.958   2.047   1.025
   47    HB   ILE   9           HB       ILE   9   6.893   3.608   2.648
   48   HG12  ILE   9          1HG1      ILE   9   9.388   5.338   2.431
   49   HG13  ILE   9          2HG1      ILE   9   7.921   5.716   1.529
   50   HG21  ILE   9          1HG2      ILE   9   8.500   1.844   3.314
   51   HG22  ILE   9          2HG2      ILE   9   9.826   3.021   3.211
   52   HG23  ILE   9          3HG2      ILE   9   8.530   3.233   4.405
   53   HD11  ILE   9          3HD1      ILE   9   8.004   6.989   3.608
   54   HD12  ILE   9          1HD1      ILE   9   6.618   5.886   3.582
   55   HD13  ILE   9          2HD1      ILE   9   8.058   5.492   4.559
   56    H    PHE  10           H        PHE  10   5.716   2.417   0.881
   57    HA   PHE  10           HA       PHE  10   4.769   4.400  -1.157
   58    HB2  PHE  10           1HB      PHE  10   4.105   1.437  -0.859
   59    HB3  PHE  10           2HB      PHE  10   3.185   2.551  -1.845
   60    HD1  PHE  10           2HD      PHE  10   6.509   0.896  -1.503
   61    HD2  PHE  10           1HD      PHE  10   3.899   3.223  -4.027
   62    HE1  PHE  10           2HE      PHE  10   7.962   0.407  -3.459
   63    HE2  PHE  10           1HE      PHE  10   5.340   2.720  -5.982
   64    HZ   PHE  10           HZ       PHE  10   7.342   1.277  -5.715
   65    H    THR  11           H        THR  11   3.022   5.581  -0.450
   66    HA   THR  11           HA       THR  11   1.815   4.859   2.198
   67    HB   THR  11           HB       THR  11   2.000   7.627   0.989
   68    HG1  THR  11           1HG      THR  11   3.800   7.931   2.252
   69   HG21  THR  11          3HG2      THR  11   1.532   6.544   3.807
   70   HG22  THR  11          1HG2      THR  11   0.390   7.468   2.793
   71   HG23  THR  11          2HG2      THR  11   1.837   8.255   3.435
   72    H    CYS  12           H        CYS  12  -0.313   4.673   2.437
   73    HA   CYS  12           HA       CYS  12  -2.192   4.766   0.269
   74    HB2  CYS  12           1HB      CYS  12  -2.286   3.256   2.222
   75    HB3  CYS  12           2HB      CYS  12  -2.508   4.656   3.289
   76    H    GLU  13           H        GLU  13  -3.293   6.417  -0.544
   77    HA   GLU  13           HA       GLU  13  -3.043   9.088   0.615
   78    HB2  GLU  13           1HB      GLU  13  -4.214   9.865  -1.341
   79    HB3  GLU  13           2HB      GLU  13  -2.958   8.722  -1.816
   80    HG2  GLU  13           1HG      GLU  13  -4.690   6.941  -2.056
   81    HG3  GLU  13           2HG      GLU  13  -5.939   8.113  -1.614
   82    H    TYR  14           H        TYR  14  -5.129   6.523   1.257
   83    HA   TYR  14           HA       TYR  14  -7.501   8.211   1.864
   84    HB2  TYR  14           1HB      TYR  14  -7.122   5.215   1.760
   85    HB3  TYR  14           2HB      TYR  14  -8.638   6.038   2.055
   86    HD1  TYR  14           1HD      TYR  14  -9.711   7.400   0.234
   87    HD2  TYR  14           2HD      TYR  14  -6.254   4.914  -0.495
   88    HE1  TYR  14           1HE      TYR  14 -10.180   7.451  -2.217
   89    HE2  TYR  14           2HE      TYR  14  -6.725   4.979  -2.934
   90    HH   TYR  14           HH       TYR  14  -8.111   5.742  -4.591
   91    H    CYS  15           H        CYS  15  -5.151   6.105   3.526
   92    HA   CYS  15           HA       CYS  15  -6.161   7.137   6.128
   93    HB2  CYS  15           1HB      CYS  15  -6.096   5.002   7.170
   94    HB3  CYS  15           2HB      CYS  15  -7.189   4.969   5.790
   95    H    ASN  16           H        ASN  16  -3.517   7.050   4.211
   96    HA   ASN  16           HA       ASN  16  -1.326   7.407   4.447
   97    HB2  ASN  16           1HB      ASN  16  -1.930   8.494   7.196
   98    HB3  ASN  16           2HB      ASN  16  -0.577   8.907   6.144
   99   HD21  ASN  16          1HD2      ASN  16  -1.485   9.611   3.759
  100   HD22  ASN  16          2HD2      ASN  16  -2.728  10.843   3.895
  101    H    LYS  17           H        LYS  17  -2.260   4.740   5.313
  102    HA   LYS  17           HA       LYS  17  -0.172   3.742   7.102
  103    HB2  LYS  17           1HB      LYS  17  -2.400   2.644   6.843
  104    HB3  LYS  17           2HB      LYS  17  -2.003   2.252   5.166
  105    HG2  LYS  17           1HG      LYS  17  -0.169   0.810   5.878
  106    HG3  LYS  17           2HG      LYS  17  -0.349   1.340   7.563
  107    HD2  LYS  17           1HD      LYS  17  -2.546   0.269   7.720
  108    HD3  LYS  17           2HD      LYS  17  -2.533  -0.093   5.994
  109    HE2  LYS  17           1HE      LYS  17  -1.995  -2.121   7.139
  110    HE3  LYS  17           2HE      LYS  17  -0.537  -1.561   6.318
  111    HZ1  LYS  17           3HZ      LYS  17   0.260  -0.706   8.459
  112    HZ2  LYS  17           1HZ      LYS  17  -0.091  -2.290   8.603
  113    HZ3  LYS  17           2HZ      LYS  17  -1.115  -1.178   9.213
  114    H    VAL  18           H        VAL  18   1.704   2.710   6.506
  115    HA   VAL  18           HA       VAL  18   2.639   3.159   3.715
  116    HB   VAL  18           HB       VAL  18   4.972   3.149   4.873
  117   HG11  VAL  18          1HG1      VAL  18   3.075   5.510   5.046
  118   HG12  VAL  18          2HG1      VAL  18   4.845   5.595   5.090
  119   HG13  VAL  18          3HG1      VAL  18   4.034   5.009   3.628
  120   HG21  VAL  18          3HG2      VAL  18   4.077   2.680   7.196
  121   HG22  VAL  18          1HG2      VAL  18   5.055   4.157   7.056
  122   HG23  VAL  18          2HG2      VAL  18   3.288   4.286   7.134
  123    H    PHE  19           H        PHE  19   3.804   1.773   2.642
  124    HA   PHE  19           HA       PHE  19   4.178  -1.011   3.658
  125    HB2  PHE  19           1HB      PHE  19   3.117  -0.173   0.929
  126    HB3  PHE  19           2HB      PHE  19   3.385  -1.812   1.510
  127    HD1  PHE  19           2HD      PHE  19   1.248   1.212   1.857
  128    HD2  PHE  19           1HD      PHE  19   1.771  -2.926   2.937
  129    HE1  PHE  19           2HE      PHE  19  -1.019   1.195   2.889
  130    HE2  PHE  19           1HE      PHE  19  -0.514  -2.959   3.913
  131    HZ   PHE  19           HZ       PHE  19  -1.890  -0.892   3.913
  132    H    LYS  20           H        LYS  20   5.662  -2.280   2.305
  133    HA   LYS  20           HA       LYS  20   8.080  -0.709   1.685
  134    HB2  LYS  20           1HB      LYS  20   7.589  -3.691   1.949
  135    HB3  LYS  20           2HB      LYS  20   9.166  -2.918   1.679
  136    HG2  LYS  20           1HG      LYS  20   8.780  -1.540   3.776
  137    HG3  LYS  20           2HG      LYS  20   7.295  -2.461   4.051
  138    HD2  LYS  20           1HD      LYS  20   9.031  -3.348   5.432
  139    HD3  LYS  20           2HD      LYS  20   8.622  -4.548   4.189
  140    HE2  LYS  20           1HE      LYS  20  10.630  -3.886   2.888
  141    HE3  LYS  20           2HE      LYS  20  11.004  -2.635   4.082
  142    HZ1  LYS  20           3HZ      LYS  20  12.299  -4.654   4.472
  143    HZ2  LYS  20           1HZ      LYS  20  10.951  -5.557   4.638
  144    HZ3  LYS  20           2HZ      LYS  20  11.303  -4.400   5.737
  145    H    PHE  21           H        PHE  21   5.656  -2.368  -0.166
  146    HA   PHE  21           HA       PHE  21   7.205  -1.983  -2.682
  147    HB2  PHE  21           1HB      PHE  21   5.508  -4.409  -2.007
  148    HB3  PHE  21           2HB      PHE  21   6.477  -4.152  -3.446
  149    HD1  PHE  21           2HD      PHE  21   9.070  -3.895  -3.119
  150    HD2  PHE  21           1HD      PHE  21   6.417  -5.548  -0.145
  151    HE1  PHE  21           2HE      PHE  21  11.002  -4.978  -1.995
  152    HE2  PHE  21           1HE      PHE  21   8.353  -6.629   0.978
  153    HZ   PHE  21           HZ       PHE  21  10.648  -6.343   0.056
  154    H    LYS  22           H        LYS  22   5.939  -1.762  -4.585
  155    HA   LYS  22           HA       LYS  22   3.667  -0.095  -4.345
  156    HB2  LYS  22           1HB      LYS  22   5.245  -0.219  -6.300
  157    HB3  LYS  22           2HB      LYS  22   4.525  -1.764  -6.758
  158    HG2  LYS  22           1HG      LYS  22   2.314  -0.653  -6.962
  159    HG3  LYS  22           2HG      LYS  22   3.054   0.904  -6.532
  160    HD2  LYS  22           1HD      LYS  22   4.545   0.727  -8.530
  161    HD3  LYS  22           2HD      LYS  22   3.749  -0.800  -8.972
  162    HE2  LYS  22           1HE      LYS  22   1.568   0.398  -9.123
  163    HE3  LYS  22           2HE      LYS  22   2.377   1.914  -8.698
  164    HZ1  LYS  22           3HZ      LYS  22   3.701   1.702 -10.736
  165    HZ2  LYS  22           1HZ      LYS  22   2.111   1.698 -11.103
  166    HZ3  LYS  22           2HZ      LYS  22   2.954   0.302 -11.130
  167    H    HIS  23           H        HIS  23   3.769  -3.552  -5.262
  168    HA   HIS  23           HA       HIS  23   0.967  -3.847  -5.610
  169    HB2  HIS  23           1HB      HIS  23   1.446  -6.277  -5.527
  170    HB3  HIS  23           2HB      HIS  23   2.506  -5.386  -6.609
  171    HD1  HIS  23           1HD      HIS  23   5.078  -5.752  -6.229
  172    HD2  HIS  23           2HD      HIS  23   2.620  -7.033  -3.059
  173    HE1  HIS  23           1HE      HIS  23   6.603  -6.955  -4.581
  174    H    SER  24           H        SER  24   2.836  -3.813  -2.683
  175    HA   SER  24           HA       SER  24   0.929  -5.184  -0.964
  176    HB2  SER  24           1HB      SER  24   3.128  -3.179  -0.333
  177    HB3  SER  24           2HB      SER  24   2.193  -4.066   0.860
  178    HG   SER  24           HG       SER  24   3.052  -6.007   0.031
  179    H    LEU  25           H        LEU  25   1.614  -1.725  -1.651
  180    HA   LEU  25           HA       LEU  25  -0.592  -0.703  -0.098
  181    HB2  LEU  25           1HB      LEU  25   1.261   0.750  -0.670
  182    HB3  LEU  25           2HB      LEU  25   1.066   0.422  -2.394
  183    HG   LEU  25           HG       LEU  25  -1.122   1.579  -2.404
  184   HD11  LEU  25          1HD1      LEU  25  -0.514   2.340   0.484
  185   HD12  LEU  25          2HD1      LEU  25  -1.766   1.180  -0.008
  186   HD13  LEU  25          3HD1      LEU  25  -1.898   2.852  -0.512
  187   HD21  LEU  25          3HD2      LEU  25  -0.295   3.841  -2.131
  188   HD22  LEU  25          1HD2      LEU  25   0.943   2.818  -2.886
  189   HD23  LEU  25          2HD2      LEU  25   1.072   3.254  -1.163
  190    H    GLN  26           H        GLN  26  -0.190  -1.566  -3.532
  191    HA   GLN  26           HA       GLN  26  -2.700  -0.522  -4.431
  192    HB2  GLN  26           1HB      GLN  26  -0.848  -2.633  -5.559
  193    HB3  GLN  26           2HB      GLN  26  -2.325  -2.174  -6.389
  194    HG2  GLN  26           1HG      GLN  26  -0.161  -0.170  -5.596
  195    HG3  GLN  26           2HG      GLN  26  -0.232  -0.967  -7.164
  196   HE21  GLN  26          1HE2      GLN  26  -0.412   1.946  -6.570
  197   HE22  GLN  26          2HE2      GLN  26  -1.960   2.426  -7.249
  198    H    ALA  27           H        ALA  27  -1.940  -3.705  -3.104
  199    HA   ALA  27           HA       ALA  27  -4.597  -4.831  -3.435
  200    HB1  ALA  27           1HB      ALA  27  -2.295  -5.455  -1.548
  201    HB2  ALA  27           2HB      ALA  27  -3.706  -6.503  -1.839
  202    HB3  ALA  27           3HB      ALA  27  -2.552  -6.176  -3.158
  203    H    HIS  28           H        HIS  28  -2.985  -2.967  -0.810
  204    HA   HIS  28           HA       HIS  28  -5.112  -3.222   1.111
  205    HB2  HIS  28           1HB      HIS  28  -2.985  -2.585   1.898
  206    HB3  HIS  28           2HB      HIS  28  -2.802  -1.301   0.721
  207    HD1  HIS  28           1HD      HIS  28  -4.725  -2.006   3.982
  208    HD2  HIS  28           2HD      HIS  28  -3.770   1.081   1.292
  209    HE1  HIS  28           1HE      HIS  28  -5.441   0.148   5.118
  210    H    LEU  29           H        LEU  29  -4.675  -0.981  -1.641
  211    HA   LEU  29           HA       LEU  29  -6.708   0.881  -1.032
  212    HB2  LEU  29           1HB      LEU  29  -6.097  -0.214  -3.800
  213    HB3  LEU  29           2HB      LEU  29  -6.861   1.325  -3.412
  214    HG   LEU  29           HG       LEU  29  -3.996   0.518  -2.883
  215   HD11  LEU  29          1HD1      LEU  29  -3.450   2.265  -4.471
  216   HD12  LEU  29          2HD1      LEU  29  -5.177   2.665  -4.658
  217   HD13  LEU  29          3HD1      LEU  29  -4.556   1.079  -5.191
  218   HD21  LEU  29          3HD2      LEU  29  -3.714   2.948  -2.158
  219   HD22  LEU  29          1HD2      LEU  29  -4.638   1.964  -1.020
  220   HD23  LEU  29          2HD2      LEU  29  -5.487   3.073  -2.115
  221    H    ARG  30           H        ARG  30  -7.124  -2.431  -2.032
  222    HA   ARG  30           HA       ARG  30  -9.768  -2.293  -3.091
  223    HB2  ARG  30           1HB      ARG  30  -8.433  -4.623  -1.667
  224    HB3  ARG  30           2HB      ARG  30  -9.831  -4.695  -2.749
  225    HG2  ARG  30           1HG      ARG  30  -8.481  -3.982  -4.660
  226    HG3  ARG  30           2HG      ARG  30  -7.062  -3.754  -3.633
  227    HD2  ARG  30           1HD      ARG  30  -7.104  -6.156  -3.033
  228    HD3  ARG  30           2HD      ARG  30  -8.478  -6.398  -4.133
  229    HE   ARG  30           HE       ARG  30  -6.528  -5.176  -5.698
  230   HH11  ARG  30          2HH1      ARG  30  -6.651  -8.180  -3.898
  231   HH12  ARG  30          1HH1      ARG  30  -5.486  -8.955  -4.936
  232   HH21  ARG  30          2HH2      ARG  30  -5.057  -6.229  -6.989
  233   HH22  ARG  30          1HH2      ARG  30  -4.615  -7.874  -6.641
  234    H    ILE  31           H        ILE  31  -8.811  -1.945   0.212
  235    HA   ILE  31           HA       ILE  31 -11.513  -2.527   1.244
  236    HB   ILE  31           HB       ILE  31 -10.772  -2.101   3.356
  237   HG12  ILE  31          1HG1      ILE  31  -8.403  -0.540   2.296
  238   HG13  ILE  31          2HG1      ILE  31  -9.781   0.069   3.194
  239   HG21  ILE  31          1HG2      ILE  31  -8.920  -3.596   3.669
  240   HG22  ILE  31          2HG2      ILE  31  -9.796  -4.139   2.237
  241   HG23  ILE  31          3HG2      ILE  31  -8.269  -3.246   2.056
  242   HD11  ILE  31          3HD1      ILE  31  -7.939  -0.036   4.695
  243   HD12  ILE  31          1HD1      ILE  31  -9.087  -1.304   5.166
  244   HD13  ILE  31          2HD1      ILE  31  -7.595  -1.725   4.286
  245    H    HIS  32           H        HIS  32  -9.788   0.211   0.003
  246    HA   HIS  32           HA       HIS  32 -11.635   2.237   1.072
  247    HB2  HIS  32           1HB      HIS  32  -9.109   2.357  -0.628
  248    HB3  HIS  32           2HB      HIS  32 -10.003   3.754  -0.099
  249    HD1  HIS  32           1HD      HIS  32 -10.318   3.646   2.865
  250    HD2  HIS  32           2HD      HIS  32  -7.030   1.989   0.847
  251    HE1  HIS  32           1HE      HIS  32  -8.429   3.578   4.562
  252    H    THR  33           H        THR  33 -11.091   0.478  -1.955
  253    HA   THR  33           HA       THR  33 -12.610   2.220  -3.680
  254    HB   THR  33           HB       THR  33 -12.801   0.183  -5.144
  255    HG1  THR  33           1HG      THR  33 -12.687  -1.357  -3.423
  256   HG21  THR  33          3HG2      THR  33  -9.991   0.796  -4.142
  257   HG22  THR  33          1HG2      THR  33 -10.873   1.686  -5.403
  258   HG23  THR  33          2HG2      THR  33 -10.410  -0.009  -5.665
  259    H    ASN  34           H        ASN  34 -14.741   2.330  -4.165
  260    HA   ASN  34           HA       ASN  34 -16.669   0.532  -2.742
  261    HB2  ASN  34           1HB      ASN  34 -17.003   3.247  -4.081
  262    HB3  ASN  34           2HB      ASN  34 -18.347   2.254  -3.526
  263   HD21  ASN  34          1HD2      ASN  34 -18.119   4.778  -2.526
  264   HD22  ASN  34          2HD2      ASN  34 -17.637   4.678  -0.839
  265    H    GLU  35           H        GLU  35 -16.250   1.978  -6.013
  266    HA   GLU  35           HA       GLU  35 -16.618  -0.629  -7.293
  267    HB2  GLU  35           1HB      GLU  35 -18.953   0.211  -6.977
  268    HB3  GLU  35           2HB      GLU  35 -18.540   1.670  -7.884
  269    HG2  GLU  35           1HG      GLU  35 -18.084   0.304  -9.895
  270    HG3  GLU  35           2HG      GLU  35 -18.358  -1.176  -8.974
  271    H    LYS  36           H        LYS  36 -15.474  -0.732  -9.165
  272    HA   LYS  36           HA       LYS  36 -14.698   1.646 -10.714
  273    HB2  LYS  36           1HB      LYS  36 -12.697  -0.263  -9.423
  274    HB3  LYS  36           2HB      LYS  36 -12.292   0.720 -10.823
  275    HG2  LYS  36           1HG      LYS  36 -13.222   1.885  -8.169
  276    HG3  LYS  36           2HG      LYS  36 -11.545   1.649  -8.605
  277    HD2  LYS  36           1HD      LYS  36 -11.522   3.289 -10.237
  278    HD3  LYS  36           2HD      LYS  36 -13.258   3.254 -10.521
  279    HE2  LYS  36           1HE      LYS  36 -12.134   4.154  -7.852
  280    HE3  LYS  36           2HE      LYS  36 -12.221   5.267  -9.221
  281    HZ1  LYS  36           3HZ      LYS  36 -14.575   5.011  -9.314
  282    HZ2  LYS  36           1HZ      LYS  36 -14.226   5.304  -7.748
  283    HZ3  LYS  36           2HZ      LYS  36 -14.604   3.782  -8.252
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  17.718   0.821  21.158
    2    H2   GLY   1           2H       GLY   1  18.536   2.225  21.368
    3    H3   GLY   1           3H       GLY   1  18.691   1.383  19.970
    4    HA2  GLY   1           1HA      GLY   1  16.217   2.681  20.910
    5    HA3  GLY   1           2HA      GLY   1  17.278   3.309  19.636
    6    H    SER   2           H        SER   2  14.449   2.606  19.425
    7    HA   SER   2           HA       SER   2  14.253   0.088  17.949
    8    HB2  SER   2           1HB      SER   2  11.869   0.747  17.739
    9    HB3  SER   2           2HB      SER   2  12.459   0.725  19.408
   10    HG   SER   2           HG       SER   2  11.223   2.614  18.938
   11    H    SER   3           H        SER   3  14.916   3.370  17.024
   12    HA   SER   3           HA       SER   3  13.816   3.391  14.400
   13    HB2  SER   3           1HB      SER   3  16.235   4.900  15.459
   14    HB3  SER   3           2HB      SER   3  15.302   5.295  14.002
   15    HG   SER   3           HG       SER   3  14.641   6.544  15.816
   16    H    GLY   4           H        GLY   4  14.695   3.074  12.359
   17    HA2  GLY   4           1HA      GLY   4  17.391   2.397  11.751
   18    HA3  GLY   4           2HA      GLY   4  16.457   0.906  11.890
   19    H    SER   5           H        SER   5  17.656   1.555   9.514
   20    HA   SER   5           HA       SER   5  16.003   3.028   7.687
   21    HB2  SER   5           1HB      SER   5  18.158   0.963   7.112
   22    HB3  SER   5           2HB      SER   5  17.474   2.117   5.949
   23    HG   SER   5           HG       SER   5  19.449   2.866   6.873
   24    H    SER   6           H        SER   6  14.458   2.439   6.277
   25    HA   SER   6           HA       SER   6  13.569  -0.414   6.119
   26    HB2  SER   6           1HB      SER   6  11.264   0.471   6.049
   27    HB3  SER   6           2HB      SER   6  12.110   0.865   7.553
   28    HG   SER   6           HG       SER   6  11.000   2.683   6.707
   29    H    GLY   7           H        GLY   7  14.929   1.911   4.202
   30    HA2  GLY   7           1HA      GLY   7  15.192   2.071   1.901
   31    HA3  GLY   7           2HA      GLY   7  14.147   0.668   1.699
   32    H    LYS   8           H        LYS   8  13.376   1.904  -0.181
   33    HA   LYS   8           HA       LYS   8  11.694   4.263   0.186
   34    HB2  LYS   8           1HB      LYS   8  12.881   3.777  -1.915
   35    HB3  LYS   8           2HB      LYS   8  11.931   2.317  -2.164
   36    HG2  LYS   8           1HG      LYS   8  10.513   4.980  -1.839
   37    HG3  LYS   8           2HG      LYS   8  11.356   4.630  -3.346
   38    HD2  LYS   8           1HD      LYS   8   9.990   2.648  -3.759
   39    HD3  LYS   8           2HD      LYS   8   9.204   2.806  -2.194
   40    HE2  LYS   8           1HE      LYS   8   7.669   3.659  -3.771
   41    HE3  LYS   8           2HE      LYS   8   8.302   5.039  -2.877
   42    HZ1  LYS   8           3HZ      LYS   8   8.230   5.459  -5.275
   43    HZ2  LYS   8           1HZ      LYS   8   9.217   4.197  -5.584
   44    HZ3  LYS   8           2HZ      LYS   8   9.778   5.500  -4.769
   45    H    ILE   9           H        ILE   9   9.568   4.436   0.449
   46    HA   ILE   9           HA       ILE   9   7.924   1.986   0.799
   47    HB   ILE   9           HB       ILE   9   6.781   3.254   2.673
   48   HG12  ILE   9          1HG1      ILE   9   8.216   4.838   3.954
   49   HG13  ILE   9          2HG1      ILE   9   9.319   4.969   2.613
   50   HG21  ILE   9          1HG2      ILE   9   8.394   2.489   4.322
   51   HG22  ILE   9          2HG2      ILE   9   8.307   1.334   2.986
   52   HG23  ILE   9          3HG2      ILE   9   9.685   2.450   3.105
   53   HD11  ILE   9          3HD1      ILE   9   7.656   6.854   2.861
   54   HD12  ILE   9          1HD1      ILE   9   7.649   6.104   1.266
   55   HD13  ILE   9          2HD1      ILE   9   6.364   5.714   2.437
   56    H    PHE  10           H        PHE  10   5.650   2.346   0.797
   57    HA   PHE  10           HA       PHE  10   4.710   4.362  -1.219
   58    HB2  PHE  10           1HB      PHE  10   4.032   1.408  -0.884
   59    HB3  PHE  10           2HB      PHE  10   3.153   2.506  -1.924
   60    HD1  PHE  10           2HD      PHE  10   6.411   0.781  -1.447
   61    HD2  PHE  10           1HD      PHE  10   3.989   3.201  -4.070
   62    HE1  PHE  10           2HE      PHE  10   7.939   0.263  -3.340
   63    HE2  PHE  10           1HE      PHE  10   5.507   2.669  -5.961
   64    HZ   PHE  10           HZ       PHE  10   7.452   1.171  -5.612
   65    H    THR  11           H        THR  11   3.077   5.639  -0.463
   66    HA   THR  11           HA       THR  11   1.812   4.921   2.143
   67    HB   THR  11           HB       THR  11   1.885   7.677   0.908
   68    HG1  THR  11           1HG      THR  11   3.733   8.046   2.096
   69   HG21  THR  11          3HG2      THR  11   1.808   8.318   3.351
   70   HG22  THR  11          1HG2      THR  11   1.603   6.599   3.755
   71   HG23  THR  11          2HG2      THR  11   0.369   7.458   2.792
   72    H    CYS  12           H        CYS  12  -0.294   4.700   2.420
   73    HA   CYS  12           HA       CYS  12  -2.225   4.759   0.289
   74    HB2  CYS  12           1HB      CYS  12  -2.264   3.258   2.248
   75    HB3  CYS  12           2HB      CYS  12  -2.477   4.659   3.316
   76    H    GLU  13           H        GLU  13  -3.336   6.406  -0.514
   77    HA   GLU  13           HA       GLU  13  -3.087   9.078   0.637
   78    HB2  GLU  13           1HB      GLU  13  -4.302   9.845  -1.298
   79    HB3  GLU  13           2HB      GLU  13  -3.044   8.713  -1.793
   80    HG2  GLU  13           1HG      GLU  13  -4.760   6.915  -2.005
   81    HG3  GLU  13           2HG      GLU  13  -6.013   8.073  -1.537
   82    H    TYR  14           H        TYR  14  -5.139   6.504   1.332
   83    HA   TYR  14           HA       TYR  14  -7.511   8.179   1.977
   84    HB2  TYR  14           1HB      TYR  14  -7.123   5.185   1.856
   85    HB3  TYR  14           2HB      TYR  14  -8.637   6.004   2.166
   86    HD1  TYR  14           1HD      TYR  14  -9.716   7.388   0.356
   87    HD2  TYR  14           2HD      TYR  14  -6.292   4.866  -0.409
   88    HE1  TYR  14           1HE      TYR  14 -10.223   7.435  -2.081
   89    HE2  TYR  14           2HE      TYR  14  -6.805   4.924  -2.845
   90    HH   TYR  14           HH       TYR  14  -9.603   6.724  -4.169
   91    H    CYS  15           H        CYS  15  -5.130   6.069   3.592
   92    HA   CYS  15           HA       CYS  15  -6.104   7.087   6.212
   93    HB2  CYS  15           1HB      CYS  15  -6.000   4.957   7.254
   94    HB3  CYS  15           2HB      CYS  15  -7.113   4.909   5.891
   95    H    ASN  16           H        ASN  16  -3.496   7.039   4.253
   96    HA   ASN  16           HA       ASN  16  -1.312   7.449   4.452
   97    HB2  ASN  16           1HB      ASN  16  -1.899   8.521   7.210
   98    HB3  ASN  16           2HB      ASN  16  -0.575   8.969   6.137
   99   HD21  ASN  16          1HD2      ASN  16  -1.529   9.656   3.771
  100   HD22  ASN  16          2HD2      ASN  16  -2.808  10.848   3.922
  101    H    LYS  17           H        LYS  17  -2.171   4.755   5.367
  102    HA   LYS  17           HA       LYS  17   0.007   3.836   7.093
  103    HB2  LYS  17           1HB      LYS  17  -2.193   2.682   6.970
  104    HB3  LYS  17           2HB      LYS  17  -1.887   2.276   5.276
  105    HG2  LYS  17           1HG      LYS  17   0.002   0.873   5.882
  106    HG3  LYS  17           2HG      LYS  17  -0.053   1.433   7.565
  107    HD2  LYS  17           1HD      LYS  17  -2.221   0.355   7.905
  108    HD3  LYS  17           2HD      LYS  17  -2.289  -0.130   6.199
  109    HE2  LYS  17           1HE      LYS  17  -0.243  -1.495   6.487
  110    HE3  LYS  17           2HE      LYS  17  -0.115  -0.974   8.172
  111    HZ1  LYS  17           3HZ      LYS  17  -2.364  -2.571   7.060
  112    HZ2  LYS  17           1HZ      LYS  17  -2.238  -2.081   8.615
  113    HZ3  LYS  17           2HZ      LYS  17  -1.170  -3.151   8.007
  114    H    VAL  18           H        VAL  18   1.874   2.825   6.444
  115    HA   VAL  18           HA       VAL  18   2.691   3.209   3.607
  116    HB   VAL  18           HB       VAL  18   5.069   3.180   4.657
  117   HG11  VAL  18          1HG1      VAL  18   4.075   5.037   3.422
  118   HG12  VAL  18          2HG1      VAL  18   3.269   5.604   4.906
  119   HG13  VAL  18          3HG1      VAL  18   5.040   5.609   4.788
  120   HG21  VAL  18          3HG2      VAL  18   3.511   4.364   6.986
  121   HG22  VAL  18          1HG2      VAL  18   4.288   2.754   7.023
  122   HG23  VAL  18          2HG2      VAL  18   5.270   4.220   6.826
  123    H    PHE  19           H        PHE  19   3.744   1.753   2.494
  124    HA   PHE  19           HA       PHE  19   4.112  -1.004   3.597
  125    HB2  PHE  19           1HB      PHE  19   3.029  -0.208   0.872
  126    HB3  PHE  19           2HB      PHE  19   3.285  -1.841   1.459
  127    HD1  PHE  19           2HD      PHE  19   1.191   1.211   1.862
  128    HD2  PHE  19           1HD      PHE  19   1.691  -2.940   2.903
  129    HE1  PHE  19           2HE      PHE  19  -1.044   1.219   2.951
  130    HE2  PHE  19           1HE      PHE  19  -0.562  -2.947   3.950
  131    HZ   PHE  19           HZ       PHE  19  -1.910  -0.861   4.003
  132    H    LYS  20           H        LYS  20   5.578  -2.346   2.381
  133    HA   LYS  20           HA       LYS  20   8.033  -0.891   1.716
  134    HB2  LYS  20           1HB      LYS  20   7.453  -3.855   1.996
  135    HB3  LYS  20           2HB      LYS  20   9.053  -3.113   1.787
  136    HG2  LYS  20           1HG      LYS  20   8.571  -1.706   3.868
  137    HG3  LYS  20           2HG      LYS  20   7.097  -2.655   4.087
  138    HD2  LYS  20           1HD      LYS  20   8.769  -3.562   5.521
  139    HD3  LYS  20           2HD      LYS  20   8.494  -4.727   4.211
  140    HE2  LYS  20           1HE      LYS  20  10.543  -3.914   3.063
  141    HE3  LYS  20           2HE      LYS  20  10.787  -2.708   4.332
  142    HZ1  LYS  20           3HZ      LYS  20  12.149  -4.685   4.708
  143    HZ2  LYS  20           1HZ      LYS  20  10.836  -5.653   4.747
  144    HZ3  LYS  20           2HZ      LYS  20  11.067  -4.539   5.920
  145    H    PHE  21           H        PHE  21   5.581  -2.477  -0.147
  146    HA   PHE  21           HA       PHE  21   7.165  -2.163  -2.649
  147    HB2  PHE  21           1HB      PHE  21   5.382  -4.530  -1.981
  148    HB3  PHE  21           2HB      PHE  21   6.357  -4.305  -3.418
  149    HD1  PHE  21           2HD      PHE  21   8.947  -4.186  -3.128
  150    HD2  PHE  21           1HD      PHE  21   6.262  -5.658  -0.089
  151    HE1  PHE  21           2HE      PHE  21  10.841  -5.344  -2.011
  152    HE2  PHE  21           1HE      PHE  21   8.159  -6.811   1.027
  153    HZ   PHE  21           HZ       PHE  21  10.452  -6.653   0.069
  154    H    LYS  22           H        LYS  22   5.922  -1.864  -4.553
  155    HA   LYS  22           HA       LYS  22   3.693  -0.141  -4.292
  156    HB2  LYS  22           1HB      LYS  22   5.298  -0.277  -6.236
  157    HB3  LYS  22           2HB      LYS  22   4.508  -1.772  -6.745
  158    HG2  LYS  22           1HG      LYS  22   2.354  -0.552  -6.912
  159    HG3  LYS  22           2HG      LYS  22   3.165   0.955  -6.441
  160    HD2  LYS  22           1HD      LYS  22   4.646   0.772  -8.442
  161    HD3  LYS  22           2HD      LYS  22   3.790  -0.709  -8.927
  162    HE2  LYS  22           1HE      LYS  22   1.660   0.574  -9.058
  163    HE3  LYS  22           2HE      LYS  22   2.520   2.046  -8.578
  164    HZ1  LYS  22           3HZ      LYS  22   2.266   1.916 -10.990
  165    HZ2  LYS  22           1HZ      LYS  22   3.058   0.493 -11.057
  166    HZ3  LYS  22           2HZ      LYS  22   3.851   1.851 -10.613
  167    H    HIS  23           H        HIS  23   3.721  -3.580  -5.271
  168    HA   HIS  23           HA       HIS  23   0.913  -3.806  -5.642
  169    HB2  HIS  23           1HB      HIS  23   1.340  -6.247  -5.599
  170    HB3  HIS  23           2HB      HIS  23   2.422  -5.361  -6.662
  171    HD1  HIS  23           1HD      HIS  23   4.981  -5.802  -6.285
  172    HD2  HIS  23           2HD      HIS  23   2.489  -7.057  -3.132
  173    HE1  HIS  23           1HE      HIS  23   6.474  -7.064  -4.652
  174    H    SER  24           H        SER  24   2.759  -3.828  -2.705
  175    HA   SER  24           HA       SER  24   0.809  -5.201  -1.021
  176    HB2  SER  24           1HB      SER  24   3.057  -3.270  -0.336
  177    HB3  SER  24           2HB      SER  24   2.073  -4.139   0.834
  178    HG   SER  24           HG       SER  24   2.879  -6.098   0.000
  179    H    LEU  25           H        LEU  25   1.573  -1.742  -1.656
  180    HA   LEU  25           HA       LEU  25  -0.622  -0.701  -0.110
  181    HB2  LEU  25           1HB      LEU  25   1.240   0.738  -0.685
  182    HB3  LEU  25           2HB      LEU  25   1.037   0.411  -2.409
  183    HG   LEU  25           HG       LEU  25  -1.145   1.582  -2.409
  184   HD11  LEU  25          1HD1      LEU  25  -1.781   1.188  -0.010
  185   HD12  LEU  25          2HD1      LEU  25  -1.900   2.862  -0.511
  186   HD13  LEU  25          3HD1      LEU  25  -0.516   2.336   0.477
  187   HD21  LEU  25          3HD2      LEU  25   1.061   3.243  -1.177
  188   HD22  LEU  25          1HD2      LEU  25  -0.305   3.836  -2.143
  189   HD23  LEU  25          2HD2      LEU  25   0.926   2.809  -2.900
  190    H    GLN  26           H        GLN  26  -0.238  -1.563  -3.551
  191    HA   GLN  26           HA       GLN  26  -2.742  -0.489  -4.432
  192    HB2  GLN  26           1HB      GLN  26  -0.914  -2.611  -5.582
  193    HB3  GLN  26           2HB      GLN  26  -2.383  -2.121  -6.406
  194    HG2  GLN  26           1HG      GLN  26  -0.188  -0.161  -5.592
  195    HG3  GLN  26           2HG      GLN  26  -0.272  -0.937  -7.169
  196   HE21  GLN  26          1HE2      GLN  26  -0.399   1.968  -6.552
  197   HE22  GLN  26          2HE2      GLN  26  -1.941   2.483  -7.217
  198    H    ALA  27           H        ALA  27  -2.006  -3.687  -3.135
  199    HA   ALA  27           HA       ALA  27  -4.682  -4.778  -3.464
  200    HB1  ALA  27           1HB      ALA  27  -2.374  -5.465  -1.606
  201    HB2  ALA  27           2HB      ALA  27  -3.803  -6.487  -1.903
  202    HB3  ALA  27           3HB      ALA  27  -2.654  -6.155  -3.225
  203    H    HIS  28           H        HIS  28  -3.023  -2.975  -0.822
  204    HA   HIS  28           HA       HIS  28  -5.139  -3.219   1.108
  205    HB2  HIS  28           1HB      HIS  28  -2.995  -2.611   1.881
  206    HB3  HIS  28           2HB      HIS  28  -2.816  -1.312   0.718
  207    HD1  HIS  28           1HD      HIS  28  -4.742  -2.051   3.974
  208    HD2  HIS  28           2HD      HIS  28  -3.731   1.069   1.345
  209    HE1  HIS  28           1HE      HIS  28  -5.412   0.094   5.156
  210    H    LEU  29           H        LEU  29  -4.705  -0.963  -1.632
  211    HA   LEU  29           HA       LEU  29  -6.716   0.913  -0.988
  212    HB2  LEU  29           1HB      LEU  29  -6.150  -0.171  -3.769
  213    HB3  LEU  29           2HB      LEU  29  -6.894   1.373  -3.362
  214    HG   LEU  29           HG       LEU  29  -4.029   0.535  -2.888
  215   HD11  LEU  29          1HD1      LEU  29  -4.621   1.125  -5.179
  216   HD12  LEU  29          2HD1      LEU  29  -3.493   2.293  -4.465
  217   HD13  LEU  29          3HD1      LEU  29  -5.219   2.712  -4.619
  218   HD21  LEU  29          3HD2      LEU  29  -3.703   2.949  -2.142
  219   HD22  LEU  29          1HD2      LEU  29  -4.622   1.967  -0.998
  220   HD23  LEU  29          2HD2      LEU  29  -5.473   3.100  -2.068
  221    H    ARG  30           H        ARG  30  -7.168  -2.391  -2.015
  222    HA   ARG  30           HA       ARG  30  -9.837  -2.209  -3.025
  223    HB2  ARG  30           1HB      ARG  30  -8.489  -4.583  -1.686
  224    HB3  ARG  30           2HB      ARG  30  -9.898  -4.612  -2.750
  225    HG2  ARG  30           1HG      ARG  30  -8.563  -3.866  -4.661
  226    HG3  ARG  30           2HG      ARG  30  -7.133  -3.669  -3.642
  227    HD2  ARG  30           1HD      ARG  30  -7.181  -6.084  -3.096
  228    HD3  ARG  30           2HD      ARG  30  -8.559  -6.294  -4.199
  229    HE   ARG  30           HE       ARG  30  -6.639  -5.048  -5.758
  230   HH11  ARG  30          2HH1      ARG  30  -6.661  -8.059  -3.966
  231   HH12  ARG  30          1HH1      ARG  30  -5.477  -8.794  -5.010
  232   HH21  ARG  30          2HH2      ARG  30  -5.143  -6.052  -7.059
  233   HH22  ARG  30          1HH2      ARG  30  -4.651  -7.684  -6.718
  234    H    ILE  31           H        ILE  31  -8.834  -1.891   0.246
  235    HA   ILE  31           HA       ILE  31 -11.531  -2.471   1.308
  236    HB   ILE  31           HB       ILE  31 -10.767  -2.076   3.414
  237   HG12  ILE  31          1HG1      ILE  31  -8.391  -0.524   2.356
  238   HG13  ILE  31          2HG1      ILE  31  -9.763   0.092   3.262
  239   HG21  ILE  31          1HG2      ILE  31  -8.281  -3.223   2.087
  240   HG22  ILE  31          2HG2      ILE  31  -8.924  -3.585   3.700
  241   HG23  ILE  31          3HG2      ILE  31  -9.812  -4.109   2.269
  242   HD11  ILE  31          3HD1      ILE  31  -9.077  -1.301   5.223
  243   HD12  ILE  31          1HD1      ILE  31  -7.591  -1.731   4.335
  244   HD13  ILE  31          2HD1      ILE  31  -7.918  -0.041   4.758
  245    H    HIS  32           H        HIS  32  -9.770   0.256   0.087
  246    HA   HIS  32           HA       HIS  32 -11.614   2.297   1.139
  247    HB2  HIS  32           1HB      HIS  32  -9.063   2.409  -0.525
  248    HB3  HIS  32           2HB      HIS  32  -9.944   3.803   0.032
  249    HD1  HIS  32           1HD      HIS  32 -10.270   3.632   2.993
  250    HD2  HIS  32           2HD      HIS  32  -6.997   1.983   0.942
  251    HE1  HIS  32           1HE      HIS  32  -8.380   3.516   4.688
  252    H    THR  33           H        THR  33 -10.927   0.619  -1.905
  253    HA   THR  33           HA       THR  33 -13.284   1.965  -3.141
  254    HB   THR  33           HB       THR  33 -11.211   2.957  -4.051
  255    HG1  THR  33           1HG      THR  33 -11.912   2.748  -6.161
  256   HG21  THR  33          3HG2      THR  33 -10.698   0.204  -5.286
  257   HG22  THR  33          1HG2      THR  33  -9.696   0.987  -4.053
  258   HG23  THR  33          2HG2      THR  33  -9.837   1.714  -5.655
  259    H    ASN  34           H        ASN  34 -14.556   0.735  -4.492
  260    HA   ASN  34           HA       ASN  34 -13.932  -2.038  -5.122
  261    HB2  ASN  34           1HB      ASN  34 -14.794  -2.050  -2.703
  262    HB3  ASN  34           2HB      ASN  34 -16.332  -1.449  -3.325
  263   HD21  ASN  34          1HD2      ASN  34 -17.070  -3.502  -2.212
  264   HD22  ASN  34          2HD2      ASN  34 -16.995  -4.983  -3.156
  265    H    GLU  35           H        GLU  35 -15.682  -3.009  -6.474
  266    HA   GLU  35           HA       GLU  35 -16.787  -1.098  -8.399
  267    HB2  GLU  35           1HB      GLU  35 -17.077  -4.117  -8.150
  268    HB3  GLU  35           2HB      GLU  35 -17.726  -3.137  -9.470
  269    HG2  GLU  35           1HG      GLU  35 -15.420  -2.356 -10.015
  270    HG3  GLU  35           2HG      GLU  35 -14.774  -3.407  -8.752
  271    H    LYS  36           H        LYS  36 -18.891  -0.539  -8.748
  272    HA   LYS  36           HA       LYS  36 -21.114  -1.562  -7.136
  273    HB2  LYS  36           1HB      LYS  36 -21.730   0.621  -6.223
  274    HB3  LYS  36           2HB      LYS  36 -20.174   0.075  -5.607
  275    HG2  LYS  36           1HG      LYS  36 -19.009   1.606  -7.203
  276    HG3  LYS  36           2HG      LYS  36 -20.588   2.164  -7.791
  277    HD2  LYS  36           1HD      LYS  36 -21.142   2.996  -5.514
  278    HD3  LYS  36           2HD      LYS  36 -19.603   2.371  -4.913
  279    HE2  LYS  36           1HE      LYS  36 -19.323   4.718  -5.233
  280    HE3  LYS  36           2HE      LYS  36 -18.379   3.889  -6.472
  281    HZ1  LYS  36           3HZ      LYS  36 -21.062   5.107  -6.897
  282    HZ2  LYS  36           1HZ      LYS  36 -20.172   4.372  -8.057
  283    HZ3  LYS  36           2HZ      LYS  36 -19.649   5.759  -7.382
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  18.605  -9.807  17.808
    2    H2   GLY   1           2H       GLY   1  17.125 -10.431  18.132
    3    H3   GLY   1           3H       GLY   1  17.418  -8.837  18.379
    4    HA2  GLY   1           1HA      GLY   1  17.404 -10.187  15.758
    5    HA3  GLY   1           2HA      GLY   1  16.113  -9.141  16.378
    6    H    SER   2           H        SER   2  17.130  -8.488  13.989
    7    HA   SER   2           HA       SER   2  19.406  -6.754  13.985
    8    HB2  SER   2           1HB      SER   2  17.069  -6.866  12.043
    9    HB3  SER   2           2HB      SER   2  18.652  -6.120  11.746
   10    HG   SER   2           HG       SER   2  18.518  -8.251  10.887
   11    H    SER   3           H        SER   3  19.569  -4.502  13.756
   12    HA   SER   3           HA       SER   3  17.864  -2.968  15.474
   13    HB2  SER   3           1HB      SER   3  20.060  -2.006  13.607
   14    HB3  SER   3           2HB      SER   3  19.403  -1.142  15.010
   15    HG   SER   3           HG       SER   3  21.360  -2.239  15.507
   16    H    GLY   4           H        GLY   4  17.416  -3.630  12.177
   17    HA2  GLY   4           1HA      GLY   4  15.764  -2.862  10.715
   18    HA3  GLY   4           2HA      GLY   4  15.362  -1.551  11.817
   19    H    SER   5           H        SER   5  15.420  -1.014   9.180
   20    HA   SER   5           HA       SER   5  17.566   0.964   8.899
   21    HB2  SER   5           1HB      SER   5  18.281   0.181   6.675
   22    HB3  SER   5           2HB      SER   5  18.680  -0.979   7.945
   23    HG   SER   5           HG       SER   5  16.906  -2.238   7.317
   24    H    SER   6           H        SER   6  17.239   2.460   7.162
   25    HA   SER   6           HA       SER   6  14.394   2.922   6.481
   26    HB2  SER   6           1HB      SER   6  16.845   4.671   6.084
   27    HB3  SER   6           2HB      SER   6  15.165   5.136   5.755
   28    HG   SER   6           HG       SER   6  15.880   5.835   7.833
   29    H    GLY   7           H        GLY   7  13.691   3.430   4.343
   30    HA2  GLY   7           1HA      GLY   7  15.264   3.220   1.975
   31    HA3  GLY   7           2HA      GLY   7  14.502   1.659   2.291
   32    H    LYS   8           H        LYS   8  13.681   2.436   0.054
   33    HA   LYS   8           HA       LYS   8  11.596   4.412  -0.107
   34    HB2  LYS   8           1HB      LYS   8  12.889   3.675  -2.067
   35    HB3  LYS   8           2HB      LYS   8  12.291   2.028  -1.881
   36    HG2  LYS   8           1HG      LYS   8  11.168   3.104  -3.718
   37    HG3  LYS   8           2HG      LYS   8  10.003   2.758  -2.444
   38    HD2  LYS   8           1HD      LYS   8  10.031   5.151  -1.755
   39    HD3  LYS   8           2HD      LYS   8  11.315   5.474  -2.922
   40    HE2  LYS   8           1HE      LYS   8   9.228   6.250  -3.829
   41    HE3  LYS   8           2HE      LYS   8   9.798   4.884  -4.788
   42    HZ1  LYS   8           3HZ      LYS   8   7.740   4.667  -2.642
   43    HZ2  LYS   8           1HZ      LYS   8   8.179   3.477  -3.673
   44    HZ3  LYS   8           2HZ      LYS   8   7.393   4.787  -4.240
   45    H    ILE   9           H        ILE   9   9.557   4.382   0.297
   46    HA   ILE   9           HA       ILE   9   8.030   1.879   0.775
   47    HB   ILE   9           HB       ILE   9   6.855   3.216   2.615
   48   HG12  ILE   9          1HG1      ILE   9   8.273   4.856   3.828
   49   HG13  ILE   9          2HG1      ILE   9   9.399   4.922   2.506
   50   HG21  ILE   9          1HG2      ILE   9   9.754   2.425   3.086
   51   HG22  ILE   9          2HG2      ILE   9   8.457   2.510   4.294
   52   HG23  ILE   9          3HG2      ILE   9   8.376   1.306   3.002
   53   HD11  ILE   9          3HD1      ILE   9   7.754   5.997   1.073
   54   HD12  ILE   9          1HD1      ILE   9   6.452   5.678   2.247
   55   HD13  ILE   9          2HD1      ILE   9   7.750   6.826   2.631
   56    H    PHE  10           H        PHE  10   5.662   2.330   0.837
   57    HA   PHE  10           HA       PHE  10   4.784   4.362  -1.191
   58    HB2  PHE  10           1HB      PHE  10   4.071   1.407  -0.960
   59    HB3  PHE  10           2HB      PHE  10   3.193   2.553  -1.952
   60    HD1  PHE  10           2HD      PHE  10   6.453   0.803  -1.557
   61    HD2  PHE  10           1HD      PHE  10   4.021   3.324  -4.073
   62    HE1  PHE  10           2HE      PHE  10   7.990   0.381  -3.466
   63    HE2  PHE  10           1HE      PHE  10   5.546   2.889  -5.982
   64    HZ   PHE  10           HZ       PHE  10   7.504   1.391  -5.696
   65    H    THR  11           H        THR  11   3.119   5.614  -0.471
   66    HA   THR  11           HA       THR  11   1.874   4.905   2.145
   67    HB   THR  11           HB       THR  11   1.906   7.658   0.906
   68    HG1  THR  11           1HG      THR  11   3.775   8.048   2.055
   69   HG21  THR  11          3HG2      THR  11   1.860   8.308   3.338
   70   HG22  THR  11          1HG2      THR  11   1.725   6.588   3.765
   71   HG23  THR  11          2HG2      THR  11   0.434   7.396   2.836
   72    H    CYS  12           H        CYS  12  -0.230   4.706   2.449
   73    HA   CYS  12           HA       CYS  12  -2.153   4.726   0.288
   74    HB2  CYS  12           1HB      CYS  12  -2.199   3.200   2.231
   75    HB3  CYS  12           2HB      CYS  12  -2.447   4.586   3.311
   76    H    GLU  13           H        GLU  13  -3.188   6.414  -0.537
   77    HA   GLU  13           HA       GLU  13  -3.000   9.054   0.675
   78    HB2  GLU  13           1HB      GLU  13  -4.163   9.850  -1.278
   79    HB3  GLU  13           2HB      GLU  13  -2.897   8.721  -1.758
   80    HG2  GLU  13           1HG      GLU  13  -4.611   6.931  -2.038
   81    HG3  GLU  13           2HG      GLU  13  -5.873   8.085  -1.583
   82    H    TYR  14           H        TYR  14  -5.055   6.484   1.318
   83    HA   TYR  14           HA       TYR  14  -7.449   8.148   1.919
   84    HB2  TYR  14           1HB      TYR  14  -7.045   5.158   1.785
   85    HB3  TYR  14           2HB      TYR  14  -8.572   5.965   2.077
   86    HD1  TYR  14           1HD      TYR  14  -9.634   7.352   0.265
   87    HD2  TYR  14           2HD      TYR  14  -6.173   4.874  -0.471
   88    HE1  TYR  14           1HE      TYR  14 -10.097   7.430  -2.180
   89    HE2  TYR  14           2HE      TYR  14  -6.641   4.962  -2.917
   90    HH   TYR  14           HH       TYR  14  -9.431   6.757  -4.266
   91    H    CYS  15           H        CYS  15  -5.094   6.026   3.563
   92    HA   CYS  15           HA       CYS  15  -6.133   7.019   6.170
   93    HB2  CYS  15           1HB      CYS  15  -5.993   4.882   7.200
   94    HB3  CYS  15           2HB      CYS  15  -7.097   4.833   5.831
   95    H    ASN  16           H        ASN  16  -3.490   7.062   4.266
   96    HA   ASN  16           HA       ASN  16  -1.329   7.582   4.528
   97    HB2  ASN  16           1HB      ASN  16  -2.204   8.638   7.225
   98    HB3  ASN  16           2HB      ASN  16  -0.690   9.013   6.416
   99   HD21  ASN  16          1HD2      ASN  16  -4.156   9.630   6.409
  100   HD22  ASN  16          2HD2      ASN  16  -4.079  10.892   5.186
  101    H    LYS  17           H        LYS  17  -2.094   4.821   5.388
  102    HA   LYS  17           HA       LYS  17   0.136   4.037   7.145
  103    HB2  LYS  17           1HB      LYS  17  -1.944   2.703   7.175
  104    HB3  LYS  17           2HB      LYS  17  -1.752   2.336   5.452
  105    HG2  LYS  17           1HG      LYS  17   0.348   1.181   5.886
  106    HG3  LYS  17           2HG      LYS  17   0.298   1.628   7.602
  107    HD2  LYS  17           1HD      LYS  17  -1.721   0.214   7.877
  108    HD3  LYS  17           2HD      LYS  17  -1.655  -0.223   6.166
  109    HE2  LYS  17           1HE      LYS  17   0.461  -0.803   8.294
  110    HE3  LYS  17           2HE      LYS  17  -0.644  -1.976   7.578
  111    HZ1  LYS  17           3HZ      LYS  17   0.462  -1.544   5.412
  112    HZ2  LYS  17           1HZ      LYS  17   1.507  -2.132   6.525
  113    HZ3  LYS  17           2HZ      LYS  17   1.543  -0.548   6.131
  114    H    VAL  18           H        VAL  18   2.031   3.106   6.484
  115    HA   VAL  18           HA       VAL  18   2.734   3.299   3.602
  116    HB   VAL  18           HB       VAL  18   5.147   3.108   4.545
  117   HG11  VAL  18          1HG1      VAL  18   4.245   5.025   3.339
  118   HG12  VAL  18          2HG1      VAL  18   3.516   5.649   4.839
  119   HG13  VAL  18          3HG1      VAL  18   5.281   5.545   4.674
  120   HG21  VAL  18          3HG2      VAL  18   3.772   4.413   6.924
  121   HG22  VAL  18          1HG2      VAL  18   4.420   2.747   6.942
  122   HG23  VAL  18          2HG2      VAL  18   5.510   4.130   6.702
  123    H    PHE  19           H        PHE  19   3.851   1.783   2.557
  124    HA   PHE  19           HA       PHE  19   4.026  -0.991   3.649
  125    HB2  PHE  19           1HB      PHE  19   3.028  -0.129   0.910
  126    HB3  PHE  19           2HB      PHE  19   3.234  -1.781   1.443
  127    HD1  PHE  19           2HD      PHE  19   1.232   1.321   2.046
  128    HD2  PHE  19           1HD      PHE  19   1.531  -2.937   2.645
  129    HE1  PHE  19           2HE      PHE  19  -1.013   1.315   3.098
  130    HE2  PHE  19           1HE      PHE  19  -0.753  -2.956   3.628
  131    HZ   PHE  19           HZ       PHE  19  -1.992  -0.818   3.917
  132    H    LYS  20           H        LYS  20   5.514  -2.350   2.457
  133    HA   LYS  20           HA       LYS  20   8.006  -0.933   1.873
  134    HB2  LYS  20           1HB      LYS  20   7.350  -3.906   1.925
  135    HB3  LYS  20           2HB      LYS  20   8.973  -3.189   1.895
  136    HG2  LYS  20           1HG      LYS  20   8.409  -2.019   4.074
  137    HG3  LYS  20           2HG      LYS  20   6.890  -2.935   4.111
  138    HD2  LYS  20           1HD      LYS  20   8.205  -5.068   4.045
  139    HD3  LYS  20           2HD      LYS  20   9.708  -4.116   4.077
  140    HE2  LYS  20           1HE      LYS  20   9.015  -3.118   6.249
  141    HE3  LYS  20           2HE      LYS  20   7.533  -4.084   6.216
  142    HZ1  LYS  20           3HZ      LYS  20  10.287  -5.200   6.309
  143    HZ2  LYS  20           1HZ      LYS  20   8.917  -6.091   6.279
  144    HZ3  LYS  20           2HZ      LYS  20   9.250  -5.147   7.566
  145    H    PHE  21           H        PHE  21   5.587  -2.494  -0.083
  146    HA   PHE  21           HA       PHE  21   7.192  -2.072  -2.555
  147    HB2  PHE  21           1HB      PHE  21   5.545  -4.546  -1.903
  148    HB3  PHE  21           2HB      PHE  21   6.468  -4.248  -3.364
  149    HD1  PHE  21           2HD      PHE  21   9.044  -4.007  -3.167
  150    HD2  PHE  21           1HD      PHE  21   6.561  -5.592  -0.018
  151    HE1  PHE  21           2HE      PHE  21  11.043  -5.028  -2.100
  152    HE2  PHE  21           1HE      PHE  21   8.563  -6.590   1.060
  153    HZ   PHE  21           HZ       PHE  21  10.806  -6.314   0.017
  154    H    LYS  22           H        LYS  22   5.964  -1.767  -4.461
  155    HA   LYS  22           HA       LYS  22   3.691  -0.125  -4.159
  156    HB2  LYS  22           1HB      LYS  22   5.318  -0.166  -6.097
  157    HB3  LYS  22           2HB      LYS  22   4.528  -1.633  -6.681
  158    HG2  LYS  22           1HG      LYS  22   2.376  -0.407  -6.786
  159    HG3  LYS  22           2HG      LYS  22   3.178   1.071  -6.227
  160    HD2  LYS  22           1HD      LYS  22   4.647   1.033  -8.234
  161    HD3  LYS  22           2HD      LYS  22   3.823  -0.435  -8.805
  162    HE2  LYS  22           1HE      LYS  22   1.668   0.803  -8.867
  163    HE3  LYS  22           2HE      LYS  22   2.484   2.262  -8.292
  164    HZ1  LYS  22           3HZ      LYS  22   3.826   2.233 -10.330
  165    HZ2  LYS  22           1HZ      LYS  22   2.240   2.278 -10.709
  166    HZ3  LYS  22           2HZ      LYS  22   3.071   0.883 -10.862
  167    H    HIS  23           H        HIS  23   3.779  -3.515  -5.307
  168    HA   HIS  23           HA       HIS  23   0.991  -3.781  -5.730
  169    HB2  HIS  23           1HB      HIS  23   1.469  -6.233  -5.686
  170    HB3  HIS  23           2HB      HIS  23   2.512  -5.300  -6.747
  171    HD1  HIS  23           1HD      HIS  23   5.070  -5.713  -6.437
  172    HD2  HIS  23           2HD      HIS  23   2.693  -6.956  -3.190
  173    HE1  HIS  23           1HE      HIS  23   6.634  -6.911  -4.821
  174    H    SER  24           H        SER  24   2.755  -3.865  -2.734
  175    HA   SER  24           HA       SER  24   0.740  -5.286  -1.167
  176    HB2  SER  24           1HB      SER  24   3.042  -3.477  -0.342
  177    HB3  SER  24           2HB      SER  24   1.972  -4.335   0.764
  178    HG   SER  24           HG       SER  24   3.802  -5.608   0.384
  179    H    LEU  25           H        LEU  25   1.557  -1.825  -1.685
  180    HA   LEU  25           HA       LEU  25  -0.643  -0.795  -0.130
  181    HB2  LEU  25           1HB      LEU  25   1.227   0.646  -0.653
  182    HB3  LEU  25           2HB      LEU  25   1.049   0.353  -2.385
  183    HG   LEU  25           HG       LEU  25  -1.135   1.530  -2.390
  184   HD11  LEU  25          1HD1      LEU  25  -1.901   2.785  -0.482
  185   HD12  LEU  25          2HD1      LEU  25  -0.519   2.256   0.505
  186   HD13  LEU  25          3HD1      LEU  25  -1.778   1.106   0.006
  187   HD21  LEU  25          3HD2      LEU  25   0.942   2.748  -2.856
  188   HD22  LEU  25          1HD2      LEU  25   1.083   3.155  -1.127
  189   HD23  LEU  25          2HD2      LEU  25  -0.278   3.776  -2.084
  190    H    GLN  26           H        GLN  26  -0.233  -1.609  -3.584
  191    HA   GLN  26           HA       GLN  26  -2.721  -0.526  -4.485
  192    HB2  GLN  26           1HB      GLN  26  -0.987  -2.745  -5.618
  193    HB3  GLN  26           2HB      GLN  26  -2.414  -2.139  -6.443
  194    HG2  GLN  26           1HG      GLN  26  -0.039  -0.386  -5.678
  195    HG3  GLN  26           2HG      GLN  26  -0.266  -1.140  -7.251
  196   HE21  GLN  26          1HE2      GLN  26  -2.495  -0.549  -8.355
  197   HE22  GLN  26          2HE2      GLN  26  -2.973   1.129  -8.147
  198    H    ALA  27           H        ALA  27  -2.024  -3.744  -3.194
  199    HA   ALA  27           HA       ALA  27  -4.712  -4.801  -3.540
  200    HB1  ALA  27           1HB      ALA  27  -2.416  -5.540  -1.680
  201    HB2  ALA  27           2HB      ALA  27  -3.854  -6.541  -1.998
  202    HB3  ALA  27           3HB      ALA  27  -2.693  -6.202  -3.311
  203    H    HIS  28           H        HIS  28  -3.051  -3.032  -0.880
  204    HA   HIS  28           HA       HIS  28  -5.177  -3.282   1.042
  205    HB2  HIS  28           1HB      HIS  28  -3.039  -2.683   1.832
  206    HB3  HIS  28           2HB      HIS  28  -2.845  -1.385   0.670
  207    HD1  HIS  28           1HD      HIS  28  -4.786  -2.114   3.920
  208    HD2  HIS  28           2HD      HIS  28  -3.746   1.001   1.294
  209    HE1  HIS  28           1HE      HIS  28  -5.442   0.034   5.102
  210    H    LEU  29           H        LEU  29  -4.718  -1.020  -1.691
  211    HA   LEU  29           HA       LEU  29  -6.741   0.848  -1.061
  212    HB2  LEU  29           1HB      LEU  29  -6.164  -0.226  -3.843
  213    HB3  LEU  29           2HB      LEU  29  -6.902   1.318  -3.427
  214    HG   LEU  29           HG       LEU  29  -4.038   0.470  -2.964
  215   HD11  LEU  29          1HD1      LEU  29  -3.521   2.268  -4.523
  216   HD12  LEU  29          2HD1      LEU  29  -5.256   2.633  -4.696
  217   HD13  LEU  29          3HD1      LEU  29  -4.602   1.063  -5.248
  218   HD21  LEU  29          3HD2      LEU  29  -4.630   1.892  -1.064
  219   HD22  LEU  29          1HD2      LEU  29  -5.457   3.043  -2.135
  220   HD23  LEU  29          2HD2      LEU  29  -3.689   2.863  -2.198
  221    H    ARG  30           H        ARG  30  -7.160  -2.463  -2.099
  222    HA   ARG  30           HA       ARG  30  -9.797  -2.332  -3.143
  223    HB2  ARG  30           1HB      ARG  30  -8.480  -4.665  -1.752
  224    HB3  ARG  30           2HB      ARG  30  -9.928  -4.698  -2.771
  225    HG2  ARG  30           1HG      ARG  30  -8.600  -3.823  -4.704
  226    HG3  ARG  30           2HG      ARG  30  -7.150  -3.840  -3.707
  227    HD2  ARG  30           1HD      ARG  30  -7.122  -5.822  -5.020
  228    HD3  ARG  30           2HD      ARG  30  -7.430  -6.264  -3.339
  229    HE   ARG  30           HE       ARG  30  -9.532  -7.065  -3.910
  230   HH11  ARG  30          2HH1      ARG  30  -8.346  -5.307  -6.705
  231   HH12  ARG  30          1HH1      ARG  30  -9.644  -5.875  -7.719
  232   HH21  ARG  30          2HH2      ARG  30 -11.153  -7.741  -5.258
  233   HH22  ARG  30          1HH2      ARG  30 -11.184  -7.216  -6.915
  234    H    ILE  31           H        ILE  31  -8.850  -1.978   0.179
  235    HA   ILE  31           HA       ILE  31 -11.565  -2.521   1.195
  236    HB   ILE  31           HB       ILE  31 -10.826  -2.132   3.315
  237   HG12  ILE  31          1HG1      ILE  31  -8.443  -0.572   2.276
  238   HG13  ILE  31          2HG1      ILE  31  -9.824   0.041   3.171
  239   HG21  ILE  31          1HG2      ILE  31  -8.981  -3.632   3.618
  240   HG22  ILE  31          2HG2      ILE  31  -9.849  -4.159   2.176
  241   HG23  ILE  31          3HG2      ILE  31  -8.319  -3.268   2.014
  242   HD11  ILE  31          3HD1      ILE  31  -7.655  -1.777   4.263
  243   HD12  ILE  31          1HD1      ILE  31  -7.985  -0.086   4.678
  244   HD13  ILE  31          2HD1      ILE  31  -9.146  -1.345   5.140
  245    H    HIS  32           H        HIS  32  -9.717   0.229   0.066
  246    HA   HIS  32           HA       HIS  32 -11.569   2.257   1.086
  247    HB2  HIS  32           1HB      HIS  32  -9.048   2.367  -0.620
  248    HB3  HIS  32           2HB      HIS  32  -9.931   3.766  -0.064
  249    HD1  HIS  32           1HD      HIS  32 -10.257   3.572   2.906
  250    HD2  HIS  32           2HD      HIS  32  -6.957   1.988   0.846
  251    HE1  HIS  32           1HE      HIS  32  -8.374   3.451   4.606
  252    H    THR  33           H        THR  33 -10.999   0.542  -1.978
  253    HA   THR  33           HA       THR  33 -12.704   2.210  -3.625
  254    HB   THR  33           HB       THR  33 -12.815   0.228  -5.113
  255    HG1  THR  33           1HG      THR  33 -11.723  -1.612  -4.529
  256   HG21  THR  33          3HG2      THR  33 -10.866   1.728  -5.319
  257   HG22  THR  33          1HG2      THR  33 -10.439   0.040  -5.666
  258   HG23  THR  33          2HG2      THR  33  -9.987   0.765  -4.114
  259    H    ASN  34           H        ASN  34 -13.413  -0.088  -1.151
  260    HA   ASN  34           HA       ASN  34 -15.244  -1.088  -0.358
  261    HB2  ASN  34           1HB      ASN  34 -15.742   1.365  -0.048
  262    HB3  ASN  34           2HB      ASN  34 -16.767   1.282  -1.482
  263   HD21  ASN  34          1HD2      ASN  34 -18.500   1.994  -0.002
  264   HD22  ASN  34          2HD2      ASN  34 -19.275   0.795   1.024
  265    H    GLU  35           H        GLU  35 -14.464  -2.209  -2.754
  266    HA   GLU  35           HA       GLU  35 -16.755  -2.840  -4.437
  267    HB2  GLU  35           1HB      GLU  35 -14.023  -4.117  -4.055
  268    HB3  GLU  35           2HB      GLU  35 -15.218  -4.755  -5.174
  269    HG2  GLU  35           1HG      GLU  35 -14.021  -1.957  -5.272
  270    HG3  GLU  35           2HG      GLU  35 -13.554  -3.313  -6.293
  271    H    LYS  36           H        LYS  36 -17.777  -4.891  -4.653
  272    HA   LYS  36           HA       LYS  36 -17.939  -6.612  -2.245
  273    HB2  LYS  36           1HB      LYS  36 -19.603  -4.714  -2.042
  274    HB3  LYS  36           2HB      LYS  36 -20.345  -5.255  -3.536
  275    HG2  LYS  36           1HG      LYS  36 -21.625  -6.028  -1.623
  276    HG3  LYS  36           2HG      LYS  36 -20.973  -7.397  -2.510
  277    HD2  LYS  36           1HD      LYS  36 -20.859  -7.733  -0.080
  278    HD3  LYS  36           2HD      LYS  36 -19.246  -7.743  -0.796
  279    HE2  LYS  36           1HE      LYS  36 -18.897  -5.394  -0.077
  280    HE3  LYS  36           2HE      LYS  36 -20.536  -5.345   0.586
  281    HZ1  LYS  36           3HZ      LYS  36 -18.893  -5.801   2.313
  282    HZ2  LYS  36           1HZ      LYS  36 -18.366  -7.137   1.541
  283    HZ3  LYS  36           2HZ      LYS  36 -19.880  -7.090   2.156
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1  22.675  10.607  11.944
    2    H2   GLY   1           2H       GLY   1  24.203  10.901  12.468
    3    H3   GLY   1           3H       GLY   1  23.372   9.607  13.036
    4    HA2  GLY   1           1HA      GLY   1  24.297   9.974  10.260
    5    HA3  GLY   1           2HA      GLY   1  25.005   8.861  11.447
    6    H    SER   2           H        SER   2  23.319   8.697   8.762
    7    HA   SER   2           HA       SER   2  21.591   7.566   7.829
    8    HB2  SER   2           1HB      SER   2  22.189   5.469   9.942
    9    HB3  SER   2           2HB      SER   2  21.265   5.228   8.449
   10    HG   SER   2           HG       SER   2  24.005   6.001   8.656
   11    H    SER   3           H        SER   3  20.791   9.555   9.582
   12    HA   SER   3           HA       SER   3  18.900   8.749  11.538
   13    HB2  SER   3           1HB      SER   3  19.144  11.471  10.222
   14    HB3  SER   3           2HB      SER   3  18.515  11.101  11.836
   15    HG   SER   3           HG       SER   3  20.647  11.856  11.948
   16    H    GLY   4           H        GLY   4  18.421   8.938   8.156
   17    HA2  GLY   4           1HA      GLY   4  15.687   8.170   8.231
   18    HA3  GLY   4           2HA      GLY   4  15.768   9.900   7.880
   19    H    SER   5           H        SER   5  14.634   8.669   5.958
   20    HA   SER   5           HA       SER   5  14.573   8.041   3.784
   21    HB2  SER   5           1HB      SER   5  17.015   9.825   3.587
   22    HB3  SER   5           2HB      SER   5  15.932   9.369   2.259
   23    HG   SER   5           HG       SER   5  15.397  11.418   3.161
   24    H    SER   6           H        SER   6  15.930   6.067   5.360
   25    HA   SER   6           HA       SER   6  18.250   5.072   3.949
   26    HB2  SER   6           1HB      SER   6  18.007   3.149   5.508
   27    HB3  SER   6           2HB      SER   6  18.029   4.727   6.314
   28    HG   SER   6           HG       SER   6  16.356   3.345   7.108
   29    H    GLY   7           H        GLY   7  14.894   4.723   3.293
   30    HA2  GLY   7           1HA      GLY   7  15.375   3.161   0.930
   31    HA3  GLY   7           2HA      GLY   7  14.604   2.170   2.172
   32    H    LYS   8           H        LYS   8  13.402   2.714  -0.286
   33    HA   LYS   8           HA       LYS   8  11.423   4.876   0.057
   34    HB2  LYS   8           1HB      LYS   8  12.584   4.491  -2.089
   35    HB3  LYS   8           2HB      LYS   8  11.842   2.903  -2.239
   36    HG2  LYS   8           1HG      LYS   8  10.072   5.342  -1.908
   37    HG3  LYS   8           2HG      LYS   8  10.886   5.074  -3.447
   38    HD2  LYS   8           1HD      LYS   8   9.814   2.889  -3.731
   39    HD3  LYS   8           2HD      LYS   8   9.067   3.007  -2.144
   40    HE2  LYS   8           1HE      LYS   8   7.371   3.579  -3.677
   41    HE3  LYS   8           2HE      LYS   8   7.855   5.077  -2.888
   42    HZ1  LYS   8           3HZ      LYS   8   9.180   5.612  -4.870
   43    HZ2  LYS   8           1HZ      LYS   8   7.631   5.345  -5.299
   44    HZ3  LYS   8           2HZ      LYS   8   8.759   4.202  -5.587
   45    H    ILE   9           H        ILE   9   9.354   4.717   0.437
   46    HA   ILE   9           HA       ILE   9   8.018   2.084   0.763
   47    HB   ILE   9           HB       ILE   9   6.749   3.248   2.671
   48   HG12  ILE   9          1HG1      ILE   9   8.085   4.854   4.006
   49   HG13  ILE   9          2HG1      ILE   9   9.234   5.041   2.718
   50   HG21  ILE   9          1HG2      ILE   9   9.677   2.528   3.082
   51   HG22  ILE   9          2HG2      ILE   9   8.393   2.498   4.307
   52   HG23  ILE   9          3HG2      ILE   9   8.332   1.376   2.943
   53   HD11  ILE   9          3HD1      ILE   9   7.510   6.879   2.948
   54   HD12  ILE   9          1HD1      ILE   9   7.602   6.177   1.333
   55   HD13  ILE   9          2HD1      ILE   9   6.272   5.719   2.428
   56    H    PHE  10           H        PHE  10   5.684   2.232   0.737
   57    HA   PHE  10           HA       PHE  10   4.654   4.234  -1.253
   58    HB2  PHE  10           1HB      PHE  10   4.037   1.278  -0.861
   59    HB3  PHE  10           2HB      PHE  10   3.121   2.349  -1.902
   60    HD1  PHE  10           2HD      PHE  10   6.448   0.735  -1.447
   61    HD2  PHE  10           1HD      PHE  10   3.885   3.000  -4.074
   62    HE1  PHE  10           2HE      PHE  10   7.964   0.240  -3.355
   63    HE2  PHE  10           1HE      PHE  10   5.388   2.487  -5.981
   64    HZ   PHE  10           HZ       PHE  10   7.397   1.075  -5.638
   65    H    THR  11           H        THR  11   3.105   5.555  -0.446
   66    HA   THR  11           HA       THR  11   1.823   4.848   2.151
   67    HB   THR  11           HB       THR  11   1.908   7.602   0.911
   68    HG1  THR  11           1HG      THR  11   3.764   7.961   2.090
   69   HG21  THR  11          3HG2      THR  11   1.843   8.249   3.351
   70   HG22  THR  11          1HG2      THR  11   1.643   6.532   3.763
   71   HG23  THR  11          2HG2      THR  11   0.401   7.385   2.808
   72    H    CYS  12           H        CYS  12  -0.281   4.629   2.419
   73    HA   CYS  12           HA       CYS  12  -2.208   4.705   0.279
   74    HB2  CYS  12           1HB      CYS  12  -2.253   3.169   2.207
   75    HB3  CYS  12           2HB      CYS  12  -2.462   4.548   3.304
   76    H    GLU  13           H        GLU  13  -3.244   6.390  -0.537
   77    HA   GLU  13           HA       GLU  13  -3.026   9.036   0.651
   78    HB2  GLU  13           1HB      GLU  13  -4.213   9.821  -1.291
   79    HB3  GLU  13           2HB      GLU  13  -2.966   8.675  -1.782
   80    HG2  GLU  13           1HG      GLU  13  -4.704   6.900  -2.010
   81    HG3  GLU  13           2HG      GLU  13  -5.946   8.071  -1.548
   82    H    TYR  14           H        TYR  14  -5.087   6.488   1.354
   83    HA   TYR  14           HA       TYR  14  -7.455   8.179   1.986
   84    HB2  TYR  14           1HB      TYR  14  -7.085   5.182   1.875
   85    HB3  TYR  14           2HB      TYR  14  -8.596   6.012   2.183
   86    HD1  TYR  14           1HD      TYR  14  -9.693   7.362   0.375
   87    HD2  TYR  14           2HD      TYR  14  -6.241   4.878  -0.395
   88    HE1  TYR  14           1HE      TYR  14 -10.202   7.396  -2.066
   89    HE2  TYR  14           2HE      TYR  14  -6.750   4.931  -2.826
   90    HH   TYR  14           HH       TYR  14  -8.165   5.682  -4.466
   91    H    CYS  15           H        CYS  15  -5.093   6.041   3.600
   92    HA   CYS  15           HA       CYS  15  -6.058   7.065   6.221
   93    HB2  CYS  15           1HB      CYS  15  -5.958   4.930   7.253
   94    HB3  CYS  15           2HB      CYS  15  -7.073   4.894   5.892
   95    H    ASN  16           H        ASN  16  -3.435   7.017   4.269
   96    HA   ASN  16           HA       ASN  16  -1.250   7.429   4.486
   97    HB2  ASN  16           1HB      ASN  16  -2.008   8.527   7.202
   98    HB3  ASN  16           2HB      ASN  16  -0.488   8.813   6.367
   99   HD21  ASN  16          1HD2      ASN  16  -3.925   9.607   6.386
  100   HD22  ASN  16          2HD2      ASN  16  -3.784  10.876   5.177
  101    H    LYS  17           H        LYS  17  -2.159   4.719   5.374
  102    HA   LYS  17           HA       LYS  17   0.008   3.756   7.088
  103    HB2  LYS  17           1HB      LYS  17  -2.209   2.629   6.938
  104    HB3  LYS  17           2HB      LYS  17  -1.887   2.226   5.248
  105    HG2  LYS  17           1HG      LYS  17  -0.019   0.805   5.871
  106    HG3  LYS  17           2HG      LYS  17  -0.081   1.365   7.552
  107    HD2  LYS  17           1HD      LYS  17  -2.259   0.307   7.878
  108    HD3  LYS  17           2HD      LYS  17  -2.320  -0.180   6.171
  109    HE2  LYS  17           1HE      LYS  17  -0.287  -1.561   6.475
  110    HE3  LYS  17           2HE      LYS  17  -0.166  -1.038   8.160
  111    HZ1  LYS  17           3HZ      LYS  17  -2.300  -2.130   8.592
  112    HZ2  LYS  17           1HZ      LYS  17  -1.235  -3.207   7.992
  113    HZ3  LYS  17           2HZ      LYS  17  -2.420  -2.620   7.037
  114    H    VAL  18           H        VAL  18   1.873   2.749   6.439
  115    HA   VAL  18           HA       VAL  18   2.701   3.134   3.604
  116    HB   VAL  18           HB       VAL  18   5.075   3.090   4.665
  117   HG11  VAL  18          1HG1      VAL  18   5.059   5.517   4.805
  118   HG12  VAL  18          2HG1      VAL  18   4.086   4.959   3.436
  119   HG13  VAL  18          3HG1      VAL  18   3.287   5.523   4.925
  120   HG21  VAL  18          3HG2      VAL  18   4.284   2.654   7.023
  121   HG22  VAL  18          1HG2      VAL  18   5.272   4.117   6.839
  122   HG23  VAL  18          2HG2      VAL  18   3.514   4.268   6.994
  123    H    PHE  19           H        PHE  19   3.746   1.671   2.490
  124    HA   PHE  19           HA       PHE  19   4.134  -1.074   3.610
  125    HB2  PHE  19           1HB      PHE  19   3.047  -0.330   0.874
  126    HB3  PHE  19           2HB      PHE  19   3.299  -1.951   1.495
  127    HD1  PHE  19           2HD      PHE  19   1.207   1.113   1.853
  128    HD2  PHE  19           1HD      PHE  19   1.697  -3.031   2.932
  129    HE1  PHE  19           2HE      PHE  19  -1.030   1.132   2.939
  130    HE2  PHE  19           1HE      PHE  19  -0.560  -3.025   3.969
  131    HZ   PHE  19           HZ       PHE  19  -1.905  -0.936   3.999
  132    H    LYS  20           H        LYS  20   5.591  -2.416   2.405
  133    HA   LYS  20           HA       LYS  20   8.060  -0.996   1.756
  134    HB2  LYS  20           1HB      LYS  20   7.409  -3.951   1.956
  135    HB3  LYS  20           2HB      LYS  20   9.028  -3.254   1.745
  136    HG2  LYS  20           1HG      LYS  20   8.682  -1.921   3.862
  137    HG3  LYS  20           2HG      LYS  20   7.122  -2.724   4.073
  138    HD2  LYS  20           1HD      LYS  20   8.722  -3.800   5.478
  139    HD3  LYS  20           2HD      LYS  20   8.270  -4.918   4.176
  140    HE2  LYS  20           1HE      LYS  20  10.373  -4.374   2.974
  141    HE3  LYS  20           2HE      LYS  20  10.798  -3.202   4.228
  142    HZ1  LYS  20           3HZ      LYS  20  10.893  -5.044   5.822
  143    HZ2  LYS  20           1HZ      LYS  20  11.914  -5.330   4.583
  144    HZ3  LYS  20           2HZ      LYS  20  10.493  -6.127   4.667
  145    H    PHE  21           H        PHE  21   5.585  -2.537  -0.132
  146    HA   PHE  21           HA       PHE  21   7.147  -2.203  -2.645
  147    HB2  PHE  21           1HB      PHE  21   5.429  -4.608  -1.932
  148    HB3  PHE  21           2HB      PHE  21   6.367  -4.371  -3.395
  149    HD1  PHE  21           2HD      PHE  21   8.967  -4.141  -3.133
  150    HD2  PHE  21           1HD      PHE  21   6.372  -5.754  -0.087
  151    HE1  PHE  21           2HE      PHE  21  10.913  -5.251  -2.058
  152    HE2  PHE  21           1HE      PHE  21   8.321  -6.860   0.985
  153    HZ   PHE  21           HZ       PHE  21  10.594  -6.608   0.003
  154    H    LYS  22           H        LYS  22   5.894  -1.926  -4.535
  155    HA   LYS  22           HA       LYS  22   3.647  -0.247  -4.293
  156    HB2  LYS  22           1HB      LYS  22   5.249  -0.411  -6.241
  157    HB3  LYS  22           2HB      LYS  22   4.454  -1.911  -6.726
  158    HG2  LYS  22           1HG      LYS  22   2.303  -0.685  -6.907
  159    HG3  LYS  22           2HG      LYS  22   3.120   0.825  -6.459
  160    HD2  LYS  22           1HD      LYS  22   4.592   0.614  -8.459
  161    HD3  LYS  22           2HD      LYS  22   3.742  -0.878  -8.919
  162    HE2  LYS  22           1HE      LYS  22   1.607   0.396  -9.070
  163    HE3  LYS  22           2HE      LYS  22   2.461   1.878  -8.618
  164    HZ1  LYS  22           3HZ      LYS  22   2.206   1.703 -11.027
  165    HZ2  LYS  22           1HZ      LYS  22   3.003   0.281 -11.068
  166    HZ3  LYS  22           2HZ      LYS  22   3.791   1.651 -10.650
  167    H    HIS  23           H        HIS  23   3.675  -3.698  -5.230
  168    HA   HIS  23           HA       HIS  23   0.874  -3.935  -5.615
  169    HB2  HIS  23           1HB      HIS  23   1.281  -6.347  -5.587
  170    HB3  HIS  23           2HB      HIS  23   2.491  -5.507  -6.543
  171    HD1  HIS  23           1HD      HIS  23   5.017  -5.919  -5.818
  172    HD2  HIS  23           2HD      HIS  23   2.113  -7.282  -3.090
  173    HE1  HIS  23           1HE      HIS  23   6.276  -7.203  -4.012
  174    H    SER  24           H        SER  24   2.691  -3.902  -2.664
  175    HA   SER  24           HA       SER  24   0.714  -5.274  -0.983
  176    HB2  SER  24           1HB      SER  24   3.105  -3.510  -0.352
  177    HB3  SER  24           2HB      SER  24   2.011  -4.153   0.868
  178    HG   SER  24           HG       SER  24   3.417  -5.751  -1.043
  179    H    LEU  25           H        LEU  25   1.537  -1.834  -1.649
  180    HA   LEU  25           HA       LEU  25  -0.644  -0.758  -0.100
  181    HB2  LEU  25           1HB      LEU  25   1.233   0.659  -0.683
  182    HB3  LEU  25           2HB      LEU  25   1.026   0.326  -2.404
  183    HG   LEU  25           HG       LEU  25  -1.150   1.512  -2.405
  184   HD11  LEU  25          1HD1      LEU  25  -0.505   2.267   0.476
  185   HD12  LEU  25          2HD1      LEU  25  -1.786   1.134  -0.007
  186   HD13  LEU  25          3HD1      LEU  25  -1.884   2.809  -0.507
  187   HD21  LEU  25          3HD2      LEU  25   1.065   3.168  -1.186
  188   HD22  LEU  25          1HD2      LEU  25  -0.297   3.761  -2.156
  189   HD23  LEU  25          2HD2      LEU  25   0.930   2.721  -2.906
  190    H    GLN  26           H        GLN  26  -0.264  -1.625  -3.546
  191    HA   GLN  26           HA       GLN  26  -2.741  -0.513  -4.429
  192    HB2  GLN  26           1HB      GLN  26  -0.944  -2.665  -5.573
  193    HB3  GLN  26           2HB      GLN  26  -2.403  -2.154  -6.404
  194    HG2  GLN  26           1HG      GLN  26  -0.182  -0.227  -5.580
  195    HG3  GLN  26           2HG      GLN  26  -0.276  -0.998  -7.160
  196   HE21  GLN  26          1HE2      GLN  26  -0.358   1.907  -6.540
  197   HE22  GLN  26          2HE2      GLN  26  -1.892   2.447  -7.205
  198    H    ALA  27           H        ALA  27  -2.088  -3.731  -3.133
  199    HA   ALA  27           HA       ALA  27  -4.806  -4.731  -3.485
  200    HB1  ALA  27           1HB      ALA  27  -3.974  -6.503  -1.963
  201    HB2  ALA  27           2HB      ALA  27  -2.819  -6.184  -3.285
  202    HB3  ALA  27           3HB      ALA  27  -2.509  -5.537  -1.653
  203    H    HIS  28           H        HIS  28  -3.066  -3.044  -0.812
  204    HA   HIS  28           HA       HIS  28  -5.181  -3.240   1.122
  205    HB2  HIS  28           1HB      HIS  28  -3.022  -2.671   1.891
  206    HB3  HIS  28           2HB      HIS  28  -2.827  -1.370   0.732
  207    HD1  HIS  28           1HD      HIS  28  -4.749  -2.094   3.993
  208    HD2  HIS  28           2HD      HIS  28  -3.742   1.019   1.357
  209    HE1  HIS  28           1HE      HIS  28  -5.423   0.051   5.169
  210    H    LEU  29           H        LEU  29  -4.697  -0.977  -1.607
  211    HA   LEU  29           HA       LEU  29  -6.682   0.925  -0.966
  212    HB2  LEU  29           1HB      LEU  29  -6.140  -0.168  -3.749
  213    HB3  LEU  29           2HB      LEU  29  -6.868   1.381  -3.340
  214    HG   LEU  29           HG       LEU  29  -4.007   0.525  -2.882
  215   HD11  LEU  29          1HD1      LEU  29  -3.473   2.283  -4.462
  216   HD12  LEU  29          2HD1      LEU  29  -5.198   2.711  -4.602
  217   HD13  LEU  29          3HD1      LEU  29  -4.613   1.122  -5.169
  218   HD21  LEU  29          3HD2      LEU  29  -4.576   1.959  -0.988
  219   HD22  LEU  29          1HD2      LEU  29  -5.435   3.095  -2.049
  220   HD23  LEU  29          2HD2      LEU  29  -3.665   2.939  -2.140
  221    H    ARG  30           H        ARG  30  -7.187  -2.384  -2.019
  222    HA   ARG  30           HA       ARG  30  -9.860  -2.113  -3.000
  223    HB2  ARG  30           1HB      ARG  30  -8.558  -4.559  -1.741
  224    HB3  ARG  30           2HB      ARG  30 -10.007  -4.507  -2.753
  225    HG2  ARG  30           1HG      ARG  30  -8.673  -3.659  -4.662
  226    HG3  ARG  30           2HG      ARG  30  -7.202  -3.745  -3.697
  227    HD2  ARG  30           1HD      ARG  30  -7.331  -6.129  -3.505
  228    HD3  ARG  30           2HD      ARG  30  -8.976  -6.178  -4.132
  229    HE   ARG  30           HE       ARG  30  -6.488  -5.928  -5.686
  230   HH11  ARG  30          2HH1      ARG  30 -10.014  -5.626  -5.892
  231   HH12  ARG  30          1HH1      ARG  30  -9.928  -5.773  -7.654
  232   HH21  ARG  30          1HH2      ARG  30  -6.636  -6.095  -7.964
  233   HH22  ARG  30          2HH2      ARG  30  -8.248  -6.003  -8.680
  234    H    ILE  31           H        ILE  31  -8.859  -1.833   0.261
  235    HA   ILE  31           HA       ILE  31 -11.565  -2.394   1.316
  236    HB   ILE  31           HB       ILE  31 -10.805  -1.989   3.424
  237   HG12  ILE  31          1HG1      ILE  31  -8.401  -0.485   2.359
  238   HG13  ILE  31          2HG1      ILE  31  -9.766   0.164   3.254
  239   HG21  ILE  31          1HG2      ILE  31  -9.879  -4.043   2.292
  240   HG22  ILE  31          2HG2      ILE  31  -8.335  -3.182   2.105
  241   HG23  ILE  31          3HG2      ILE  31  -8.983  -3.525   3.720
  242   HD11  ILE  31          3HD1      ILE  31  -9.113  -1.224   5.230
  243   HD12  ILE  31          1HD1      ILE  31  -7.631  -1.686   4.355
  244   HD13  ILE  31          2HD1      ILE  31  -7.932   0.013   4.760
  245    H    HIS  32           H        HIS  32  -9.805   0.301   0.064
  246    HA   HIS  32           HA       HIS  32 -11.628   2.377   1.101
  247    HB2  HIS  32           1HB      HIS  32  -9.045   2.437  -0.519
  248    HB3  HIS  32           2HB      HIS  32  -9.903   3.848   0.018
  249    HD1  HIS  32           1HD      HIS  32 -10.258   3.680   2.990
  250    HD2  HIS  32           2HD      HIS  32  -7.007   1.967   0.959
  251    HE1  HIS  32           1HE      HIS  32  -8.381   3.522   4.697
  252    H    THR  33           H        THR  33 -10.877   0.693  -1.915
  253    HA   THR  33           HA       THR  33 -13.070   2.135  -3.331
  254    HB   THR  33           HB       THR  33 -10.751   3.059  -3.869
  255    HG1  THR  33           1HG      THR  33 -12.301   3.542  -5.265
  256   HG21  THR  33          3HG2      THR  33  -9.540   0.865  -4.041
  257   HG22  THR  33          1HG2      THR  33  -9.379   1.885  -5.475
  258   HG23  THR  33          2HG2      THR  33 -10.473   0.487  -5.495
  259    H    ASN  34           H        ASN  34 -13.592   1.007  -5.461
  260    HA   ASN  34           HA       ASN  34 -13.535  -1.964  -5.141
  261    HB2  ASN  34           1HB      ASN  34 -15.729  -0.865  -4.468
  262    HB3  ASN  34           2HB      ASN  34 -15.900  -0.335  -6.143
  263   HD21  ASN  34          1HD2      ASN  34 -17.956  -1.619  -5.939
  264   HD22  ASN  34          2HD2      ASN  34 -17.853  -3.351  -6.220
  265    H    GLU  35           H        GLU  35 -13.807  -3.170  -7.117
  266    HA   GLU  35           HA       GLU  35 -12.285  -1.996  -9.358
  267    HB2  GLU  35           1HB      GLU  35 -11.850  -4.261  -8.244
  268    HB3  GLU  35           2HB      GLU  35 -13.284  -4.850  -9.091
  269    HG2  GLU  35           1HG      GLU  35 -12.221  -4.316 -11.261
  270    HG3  GLU  35           2HG      GLU  35 -10.850  -3.578 -10.431
  271    H    LYS  36           H        LYS  36 -12.972  -2.186 -11.559
  272    HA   LYS  36           HA       LYS  36 -14.323  -1.526 -13.253
  273    HB2  LYS  36           1HB      LYS  36 -16.268  -3.540 -12.087
  274    HB3  LYS  36           2HB      LYS  36 -16.332  -2.842 -13.709
  275    HG2  LYS  36           1HG      LYS  36 -14.073  -3.816 -14.192
  276    HG3  LYS  36           2HG      LYS  36 -14.118  -4.636 -12.626
  277    HD2  LYS  36           1HD      LYS  36 -16.123  -5.034 -14.887
  278    HD3  LYS  36           2HD      LYS  36 -14.773  -6.109 -14.500
  279    HE2  LYS  36           1HE      LYS  36 -15.736  -6.508 -12.238
  280    HE3  LYS  36           2HE      LYS  36 -17.107  -5.466 -12.642
  281    HZ1  LYS  36           3HZ      LYS  36 -17.645  -7.802 -13.000
  282    HZ2  LYS  36           1HZ      LYS  36 -16.415  -7.986 -14.055
  283    HZ3  LYS  36           2HZ      LYS  36 -17.678  -7.019 -14.431
  Start of MODEL   11
    1    H1   GLY   1           1H       GLY   1  10.959  10.916  12.330
    2    H2   GLY   1           2H       GLY   1   9.379  10.492  12.283
    3    H3   GLY   1           3H       GLY   1  10.037  11.338  11.043
    4    HA2  GLY   1           1HA      GLY   1   9.755   9.047  10.391
    5    HA3  GLY   1           2HA      GLY   1  11.469   9.496  10.458
    6    H    SER   2           H        SER   2  11.715   7.108  10.616
    7    HA   SER   2           HA       SER   2  11.965   6.266  13.436
    8    HB2  SER   2           1HB      SER   2   9.735   5.446  12.827
    9    HB3  SER   2           2HB      SER   2  10.391   4.665  11.375
   10    HG   SER   2           HG       SER   2  10.113   3.282  13.278
   11    H    SER   3           H        SER   3  13.608   4.801  13.781
   12    HA   SER   3           HA       SER   3  15.634   4.321  11.785
   13    HB2  SER   3           1HB      SER   3  15.155   2.914  14.441
   14    HB3  SER   3           2HB      SER   3  16.651   2.885  13.486
   15    HG   SER   3           HG       SER   3  16.732   4.443  15.175
   16    H    GLY   4           H        GLY   4  12.640   2.700  12.454
   17    HA2  GLY   4           1HA      GLY   4  13.301   0.080  11.385
   18    HA3  GLY   4           2HA      GLY   4  11.694   0.751  11.674
   19    H    SER   5           H        SER   5  12.789   3.125   9.805
   20    HA   SER   5           HA       SER   5  11.662   2.075   7.325
   21    HB2  SER   5           1HB      SER   5  12.911   4.767   7.979
   22    HB3  SER   5           2HB      SER   5  12.071   4.348   6.472
   23    HG   SER   5           HG       SER   5  10.666   5.377   7.954
   24    H    SER   6           H        SER   6  13.144   0.356   6.916
   25    HA   SER   6           HA       SER   6  15.962   0.773   6.545
   26    HB2  SER   6           1HB      SER   6  15.940  -1.595   5.835
   27    HB3  SER   6           2HB      SER   6  15.079  -1.320   7.357
   28    HG   SER   6           HG       SER   6  13.906  -2.678   5.903
   29    H    GLY   7           H        GLY   7  13.451   1.512   4.382
   30    HA2  GLY   7           1HA      GLY   7  15.224   2.183   2.221
   31    HA3  GLY   7           2HA      GLY   7  14.358   0.689   1.859
   32    H    LYS   8           H        LYS   8  13.622   2.086   0.055
   33    HA   LYS   8           HA       LYS   8  11.798   4.277   0.444
   34    HB2  LYS   8           1HB      LYS   8  13.198   3.780  -1.583
   35    HB3  LYS   8           2HB      LYS   8  12.119   2.453  -1.994
   36    HG2  LYS   8           1HG      LYS   8  11.060   5.276  -1.615
   37    HG3  LYS   8           2HG      LYS   8  11.888   4.827  -3.104
   38    HD2  LYS   8           1HD      LYS   8  10.243   3.082  -3.592
   39    HD3  LYS   8           2HD      LYS   8   9.414   3.395  -2.067
   40    HE2  LYS   8           1HE      LYS   8   9.271   5.873  -2.917
   41    HE3  LYS   8           2HE      LYS   8   9.623   5.183  -4.507
   42    HZ1  LYS   8           3HZ      LYS   8   7.354   4.481  -2.725
   43    HZ2  LYS   8           1HZ      LYS   8   7.641   3.728  -4.157
   44    HZ3  LYS   8           2HZ      LYS   8   7.236   5.317  -4.131
   45    H    ILE   9           H        ILE   9   9.649   4.401   0.574
   46    HA   ILE   9           HA       ILE   9   8.036   1.909   0.815
   47    HB   ILE   9           HB       ILE   9   6.784   3.180   2.631
   48   HG12  ILE   9          1HG1      ILE   9   8.065   4.794   3.965
   49   HG13  ILE   9          2HG1      ILE   9   9.327   4.873   2.760
   50   HG21  ILE   9          1HG2      ILE   9   8.284   1.265   3.031
   51   HG22  ILE   9          2HG2      ILE   9   9.663   2.373   3.188
   52   HG23  ILE   9          3HG2      ILE   9   8.328   2.434   4.356
   53   HD11  ILE   9          3HD1      ILE   9   7.699   6.798   2.753
   54   HD12  ILE   9          1HD1      ILE   9   7.845   5.990   1.189
   55   HD13  ILE   9          2HD1      ILE   9   6.430   5.675   2.225
   56    H    PHE  10           H        PHE  10   5.704   2.327   0.823
   57    HA   PHE  10           HA       PHE  10   4.818   4.364  -1.197
   58    HB2  PHE  10           1HB      PHE  10   4.109   1.409  -0.956
   59    HB3  PHE  10           2HB      PHE  10   3.215   2.552  -1.937
   60    HD1  PHE  10           2HD      PHE  10   6.528   0.874  -1.570
   61    HD2  PHE  10           1HD      PHE  10   3.955   3.243  -4.097
   62    HE1  PHE  10           2HE      PHE  10   8.027   0.443  -3.506
   63    HE2  PHE  10           1HE      PHE  10   5.440   2.791  -6.032
   64    HZ   PHE  10           HZ       PHE  10   7.451   1.364  -5.752
   65    H    THR  11           H        THR  11   3.145   5.614  -0.484
   66    HA   THR  11           HA       THR  11   1.901   4.910   2.138
   67    HB   THR  11           HB       THR  11   1.963   7.664   0.899
   68    HG1  THR  11           1HG      THR  11   3.828   8.039   2.058
   69   HG21  THR  11          3HG2      THR  11   1.912   8.314   3.333
   70   HG22  THR  11          1HG2      THR  11   1.748   6.594   3.756
   71   HG23  THR  11          2HG2      THR  11   0.476   7.424   2.816
   72    H    CYS  12           H        CYS  12  -0.213   4.742   2.443
   73    HA   CYS  12           HA       CYS  12  -2.123   4.784   0.272
   74    HB2  CYS  12           1HB      CYS  12  -2.201   3.267   2.222
   75    HB3  CYS  12           2HB      CYS  12  -2.439   4.662   3.293
   76    H    GLU  13           H        GLU  13  -3.214   6.454  -0.529
   77    HA   GLU  13           HA       GLU  13  -2.960   9.107   0.668
   78    HB2  GLU  13           1HB      GLU  13  -4.127   9.917  -1.278
   79    HB3  GLU  13           2HB      GLU  13  -2.868   8.782  -1.765
   80    HG2  GLU  13           1HG      GLU  13  -4.595   7.004  -2.044
   81    HG3  GLU  13           2HG      GLU  13  -5.849   8.164  -1.585
   82    H    TYR  14           H        TYR  14  -5.051   6.541   1.277
   83    HA   TYR  14           HA       TYR  14  -7.422   8.226   1.899
   84    HB2  TYR  14           1HB      TYR  14  -7.053   5.232   1.751
   85    HB3  TYR  14           2HB      TYR  14  -8.567   6.056   2.045
   86    HD1  TYR  14           1HD      TYR  14  -9.614   7.457   0.228
   87    HD2  TYR  14           2HD      TYR  14  -6.171   4.950  -0.493
   88    HE1  TYR  14           1HE      TYR  14 -10.063   7.541  -2.219
   89    HE2  TYR  14           2HE      TYR  14  -6.627   5.043  -2.942
   90    HH   TYR  14           HH       TYR  14  -9.393   6.866  -4.304
   91    H    CYS  15           H        CYS  15  -5.084   6.086   3.535
   92    HA   CYS  15           HA       CYS  15  -6.117   7.068   6.147
   93    HB2  CYS  15           1HB      CYS  15  -6.013   4.917   7.163
   94    HB3  CYS  15           2HB      CYS  15  -7.116   4.897   5.792
   95    H    ASN  16           H        ASN  16  -3.483   7.076   4.241
   96    HA   ASN  16           HA       ASN  16  -1.318   7.560   4.494
   97    HB2  ASN  16           1HB      ASN  16  -2.034   8.600   7.236
   98    HB3  ASN  16           2HB      ASN  16  -0.693   9.103   6.207
   99   HD21  ASN  16          1HD2      ASN  16  -1.566   9.782   3.826
  100   HD22  ASN  16          2HD2      ASN  16  -2.915  10.901   3.922
  101    H    LYS  17           H        LYS  17  -2.079   4.822   5.370
  102    HA   LYS  17           HA       LYS  17   0.143   4.044   7.139
  103    HB2  LYS  17           1HB      LYS  17  -1.937   2.714   7.167
  104    HB3  LYS  17           2HB      LYS  17  -1.749   2.350   5.443
  105    HG2  LYS  17           1HG      LYS  17   0.347   1.184   5.872
  106    HG3  LYS  17           2HG      LYS  17   0.297   1.623   7.590
  107    HD2  LYS  17           1HD      LYS  17  -1.728   0.218   7.855
  108    HD3  LYS  17           2HD      LYS  17  -1.663  -0.212   6.143
  109    HE2  LYS  17           1HE      LYS  17   0.448  -0.814   8.270
  110    HE3  LYS  17           2HE      LYS  17  -0.663  -1.976   7.547
  111    HZ1  LYS  17           3HZ      LYS  17   1.487  -2.140   6.493
  112    HZ2  LYS  17           1HZ      LYS  17   1.533  -0.554   6.109
  113    HZ3  LYS  17           2HZ      LYS  17   0.446  -1.538   5.384
  114    H    VAL  18           H        VAL  18   2.033   3.092   6.480
  115    HA   VAL  18           HA       VAL  18   2.745   3.295   3.600
  116    HB   VAL  18           HB       VAL  18   5.155   3.096   4.553
  117   HG11  VAL  18          1HG1      VAL  18   5.296   5.533   4.678
  118   HG12  VAL  18          2HG1      VAL  18   4.264   5.014   3.340
  119   HG13  VAL  18          3HG1      VAL  18   3.530   5.642   4.835
  120   HG21  VAL  18          3HG2      VAL  18   4.418   2.741   6.948
  121   HG22  VAL  18          1HG2      VAL  18   5.512   4.122   6.709
  122   HG23  VAL  18          2HG2      VAL  18   3.775   4.410   6.923
  123    H    PHE  19           H        PHE  19   3.861   1.776   2.557
  124    HA   PHE  19           HA       PHE  19   4.027  -0.999   3.644
  125    HB2  PHE  19           1HB      PHE  19   3.024  -0.138   0.905
  126    HB3  PHE  19           2HB      PHE  19   3.219  -1.789   1.448
  127    HD1  PHE  19           2HD      PHE  19   1.247   1.337   2.051
  128    HD2  PHE  19           1HD      PHE  19   1.493  -2.927   2.630
  129    HE1  PHE  19           2HE      PHE  19  -1.008   1.349   3.080
  130    HE2  PHE  19           1HE      PHE  19  -0.800  -2.926   3.592
  131    HZ   PHE  19           HZ       PHE  19  -2.020  -0.777   3.877
  132    H    LYS  20           H        LYS  20   5.511  -2.360   2.450
  133    HA   LYS  20           HA       LYS  20   7.994  -0.942   1.823
  134    HB2  LYS  20           1HB      LYS  20   7.359  -3.920   1.884
  135    HB3  LYS  20           2HB      LYS  20   8.971  -3.189   1.841
  136    HG2  LYS  20           1HG      LYS  20   8.439  -2.040   4.029
  137    HG3  LYS  20           2HG      LYS  20   6.907  -2.935   4.077
  138    HD2  LYS  20           1HD      LYS  20   8.175  -5.086   4.011
  139    HD3  LYS  20           2HD      LYS  20   9.701  -4.172   4.006
  140    HE2  LYS  20           1HE      LYS  20   9.076  -3.141   6.184
  141    HE3  LYS  20           2HE      LYS  20   7.570  -4.071   6.189
  142    HZ1  LYS  20           3HZ      LYS  20   9.289  -5.165   7.511
  143    HZ2  LYS  20           1HZ      LYS  20  10.299  -5.251   6.234
  144    HZ3  LYS  20           2HZ      LYS  20   8.908  -6.110   6.238
  145    H    PHE  21           H        PHE  21   5.525  -2.442  -0.100
  146    HA   PHE  21           HA       PHE  21   7.122  -2.082  -2.588
  147    HB2  PHE  21           1HB      PHE  21   5.369  -4.481  -1.948
  148    HB3  PHE  21           2HB      PHE  21   6.351  -4.232  -3.379
  149    HD1  PHE  21           1HD      PHE  21   8.939  -4.074  -3.062
  150    HD2  PHE  21           2HD      PHE  21   6.249  -5.624  -0.067
  151    HE1  PHE  21           1HE      PHE  21  10.841  -5.209  -1.937
  152    HE2  PHE  21           2HE      PHE  21   8.156  -6.742   1.066
  153    HZ   PHE  21           HZ       PHE  21  10.454  -6.539   0.130
  154    H    LYS  22           H        LYS  22   5.920  -1.721  -4.478
  155    HA   LYS  22           HA       LYS  22   3.640  -0.079  -4.265
  156    HB2  LYS  22           1HB      LYS  22   5.291  -0.183  -6.176
  157    HB3  LYS  22           2HB      LYS  22   4.539  -1.688  -6.704
  158    HG2  LYS  22           1HG      LYS  22   2.370  -0.505  -6.926
  159    HG3  LYS  22           2HG      LYS  22   3.140   1.014  -6.428
  160    HD2  LYS  22           1HD      LYS  22   4.661   0.884  -8.392
  161    HD3  LYS  22           2HD      LYS  22   3.879  -0.631  -8.895
  162    HE2  LYS  22           1HE      LYS  22   1.706   0.563  -9.095
  163    HE3  LYS  22           2HE      LYS  22   2.486   2.071  -8.597
  164    HZ1  LYS  22           3HZ      LYS  22   3.165   0.532 -11.050
  165    HZ2  LYS  22           1HZ      LYS  22   3.886   1.925 -10.589
  166    HZ3  LYS  22           2HZ      LYS  22   2.312   1.923 -11.015
  167    H    HIS  23           H        HIS  23   3.747  -3.508  -5.292
  168    HA   HIS  23           HA       HIS  23   0.960  -3.773  -5.739
  169    HB2  HIS  23           1HB      HIS  23   1.397  -6.176  -5.785
  170    HB3  HIS  23           2HB      HIS  23   2.624  -5.292  -6.680
  171    HD1  HIS  23           1HD      HIS  23   5.134  -5.700  -5.896
  172    HD2  HIS  23           2HD      HIS  23   2.170  -7.194  -3.306
  173    HE1  HIS  23           1HE      HIS  23   6.356  -7.037  -4.104
  174    H    SER  24           H        SER  24   2.721  -3.817  -2.752
  175    HA   SER  24           HA       SER  24   0.712  -5.255  -1.165
  176    HB2  SER  24           1HB      SER  24   3.096  -3.525  -0.413
  177    HB3  SER  24           2HB      SER  24   1.978  -4.225   0.757
  178    HG   SER  24           HG       SER  24   3.416  -5.736  -1.201
  179    H    LEU  25           H        LEU  25   1.553  -1.803  -1.698
  180    HA   LEU  25           HA       LEU  25  -0.636  -0.758  -0.132
  181    HB2  LEU  25           1HB      LEU  25   1.240   0.671  -0.664
  182    HB3  LEU  25           2HB      LEU  25   1.056   0.376  -2.395
  183    HG   LEU  25           HG       LEU  25  -1.118   1.569  -2.398
  184   HD11  LEU  25          1HD1      LEU  25  -1.874   2.833  -0.490
  185   HD12  LEU  25          2HD1      LEU  25  -0.496   2.290   0.497
  186   HD13  LEU  25          3HD1      LEU  25  -1.765   1.153  -0.002
  187   HD21  LEU  25          3HD2      LEU  25  -0.248   3.809  -2.097
  188   HD22  LEU  25          1HD2      LEU  25   0.970   2.775  -2.865
  189   HD23  LEU  25          2HD2      LEU  25   1.108   3.183  -1.136
  190    H    GLN  26           H        GLN  26  -0.241  -1.550  -3.593
  191    HA   GLN  26           HA       GLN  26  -2.734  -0.474  -4.478
  192    HB2  GLN  26           1HB      GLN  26  -0.908  -2.600  -5.621
  193    HB3  GLN  26           2HB      GLN  26  -2.373  -2.106  -6.452
  194    HG2  GLN  26           1HG      GLN  26  -0.184  -0.146  -5.624
  195    HG3  GLN  26           2HG      GLN  26  -0.252  -0.927  -7.199
  196   HE21  GLN  26          1HE2      GLN  26  -0.396   1.982  -6.578
  197   HE22  GLN  26          2HE2      GLN  26  -1.931   2.492  -7.264
  198    H    ALA  27           H        ALA  27  -2.012  -3.702  -3.214
  199    HA   ALA  27           HA       ALA  27  -4.685  -4.780  -3.575
  200    HB1  ALA  27           1HB      ALA  27  -2.645  -6.147  -3.354
  201    HB2  ALA  27           2HB      ALA  27  -2.381  -5.495  -1.718
  202    HB3  ALA  27           3HB      ALA  27  -3.799  -6.522  -2.049
  203    H    HIS  28           H        HIS  28  -3.064  -2.995  -0.908
  204    HA   HIS  28           HA       HIS  28  -5.201  -3.273   1.006
  205    HB2  HIS  28           1HB      HIS  28  -3.089  -2.668   1.835
  206    HB3  HIS  28           2HB      HIS  28  -2.856  -1.389   0.662
  207    HD1  HIS  28           1HD      HIS  28  -4.827  -2.044   3.902
  208    HD2  HIS  28           2HD      HIS  28  -3.764   1.016   1.224
  209    HE1  HIS  28           1HE      HIS  28  -5.473   0.128   5.044
  210    H    LEU  29           H        LEU  29  -4.711  -0.976  -1.697
  211    HA   LEU  29           HA       LEU  29  -6.727   0.892  -1.071
  212    HB2  LEU  29           1HB      LEU  29  -6.136  -0.163  -3.858
  213    HB3  LEU  29           2HB      LEU  29  -6.876   1.377  -3.441
  214    HG   LEU  29           HG       LEU  29  -4.020   0.526  -2.941
  215   HD11  LEU  29          1HD1      LEU  29  -4.581   1.130  -5.239
  216   HD12  LEU  29          2HD1      LEU  29  -3.461   2.293  -4.506
  217   HD13  LEU  29          3HD1      LEU  29  -5.184   2.713  -4.682
  218   HD21  LEU  29          3HD2      LEU  29  -4.639   1.950  -1.054
  219   HD22  LEU  29          1HD2      LEU  29  -5.472   3.090  -2.128
  220   HD23  LEU  29          2HD2      LEU  29  -3.700   2.936  -2.176
  221    H    ARG  30           H        ARG  30  -7.180  -2.405  -2.138
  222    HA   ARG  30           HA       ARG  30  -9.815  -2.194  -3.183
  223    HB2  ARG  30           1HB      ARG  30  -8.555  -4.602  -1.880
  224    HB3  ARG  30           2HB      ARG  30  -9.964  -4.547  -2.954
  225    HG2  ARG  30           1HG      ARG  30  -8.489  -3.567  -4.769
  226    HG3  ARG  30           2HG      ARG  30  -7.106  -3.803  -3.706
  227    HD2  ARG  30           1HD      ARG  30  -7.102  -5.680  -5.094
  228    HD3  ARG  30           2HD      ARG  30  -7.767  -6.240  -3.544
  229    HE   ARG  30           HE       ARG  30  -9.726  -5.394  -5.616
  230   HH11  ARG  30          2HH1      ARG  30  -8.110  -8.228  -4.296
  231   HH12  ARG  30          1HH1      ARG  30  -9.321  -9.291  -4.961
  232   HH21  ARG  30          2HH2      ARG  30 -11.123  -6.696  -6.378
  233   HH22  ARG  30          1HH2      ARG  30 -11.030  -8.446  -6.151
  234    H    ILE  31           H        ILE  31  -8.817  -2.051   0.163
  235    HA   ILE  31           HA       ILE  31 -11.528  -2.566   1.177
  236    HB   ILE  31           HB       ILE  31 -10.793  -2.215   3.300
  237   HG12  ILE  31          1HG1      ILE  31  -8.406  -0.630   2.303
  238   HG13  ILE  31          2HG1      ILE  31  -9.796  -0.036   3.196
  239   HG21  ILE  31          1HG2      ILE  31  -8.940  -3.709   3.581
  240   HG22  ILE  31          2HG2      ILE  31  -9.823  -4.218   2.143
  241   HG23  ILE  31          3HG2      ILE  31  -8.290  -3.327   1.975
  242   HD11  ILE  31          3HD1      ILE  31  -7.975  -0.186   4.719
  243   HD12  ILE  31          1HD1      ILE  31  -9.134  -1.459   5.145
  244   HD13  ILE  31          2HD1      ILE  31  -7.633  -1.866   4.274
  245    H    HIS  32           H        HIS  32  -9.659   0.228   0.131
  246    HA   HIS  32           HA       HIS  32 -11.551   2.219   1.108
  247    HB2  HIS  32           1HB      HIS  32  -9.091   2.362  -0.679
  248    HB3  HIS  32           2HB      HIS  32 -10.003   3.748  -0.143
  249    HD1  HIS  32           1HD      HIS  32 -10.268   3.623   2.836
  250    HD2  HIS  32           2HD      HIS  32  -6.969   2.047   0.771
  251    HE1  HIS  32           1HE      HIS  32  -8.374   3.538   4.525
  252    H    THR  33           H        THR  33 -10.977   0.488  -1.968
  253    HA   THR  33           HA       THR  33 -13.121   1.926  -3.376
  254    HB   THR  33           HB       THR  33 -12.898   0.282  -5.116
  255    HG1  THR  33           1HG      THR  33 -11.806  -1.536  -4.878
  256   HG21  THR  33          3HG2      THR  33 -10.580   0.466  -5.768
  257   HG22  THR  33          1HG2      THR  33 -10.076   0.836  -4.115
  258   HG23  THR  33          2HG2      THR  33 -11.072   2.004  -5.021
  259    H    ASN  34           H        ASN  34 -13.110  -0.332  -0.904
  260    HA   ASN  34           HA       ASN  34 -14.519  -1.721   0.077
  261    HB2  ASN  34           1HB      ASN  34 -15.831   0.425   0.100
  262    HB3  ASN  34           2HB      ASN  34 -16.753  -0.185  -1.275
  263   HD21  ASN  34          1HD2      ASN  34 -18.613   0.117   0.220
  264   HD22  ASN  34          2HD2      ASN  34 -18.948  -1.154   1.389
  265    H    GLU  35           H        GLU  35 -13.351  -2.860  -2.109
  266    HA   GLU  35           HA       GLU  35 -15.453  -4.801  -3.004
  267    HB2  GLU  35           1HB      GLU  35 -14.231  -5.248  -4.967
  268    HB3  GLU  35           2HB      GLU  35 -14.309  -3.492  -4.816
  269    HG2  GLU  35           1HG      GLU  35 -11.982  -3.607  -3.753
  270    HG3  GLU  35           2HG      GLU  35 -11.946  -5.311  -4.170
  271    H    LYS  36           H        LYS  36 -13.058  -4.480  -0.791
  272    HA   LYS  36           HA       LYS  36 -12.601  -7.423  -0.506
  273    HB2  LYS  36           1HB      LYS  36 -10.610  -6.282  -1.418
  274    HB3  LYS  36           2HB      LYS  36 -10.603  -5.177  -0.034
  275    HG2  LYS  36           1HG      LYS  36 -10.231  -7.101   1.492
  276    HG3  LYS  36           2HG      LYS  36 -10.245  -8.203   0.097
  277    HD2  LYS  36           1HD      LYS  36  -8.298  -6.966  -0.863
  278    HD3  LYS  36           2HD      LYS  36  -8.247  -5.929   0.566
  279    HE2  LYS  36           1HE      LYS  36  -7.908  -8.968   0.556
  280    HE3  LYS  36           2HE      LYS  36  -6.581  -7.805   0.575
  281    HZ1  LYS  36           3HZ      LYS  36  -7.064  -8.578   2.806
  282    HZ2  LYS  36           1HZ      LYS  36  -8.616  -8.092   2.720
  283    HZ3  LYS  36           2HZ      LYS  36  -7.408  -6.987   2.721
  Start of MODEL   12
    1    H1   GLY   1           1H       GLY   1  12.965 -10.366   8.307
    2    H2   GLY   1           2H       GLY   1  13.837  -9.929   9.623
    3    H3   GLY   1           3H       GLY   1  14.539  -9.945   8.143
    4    HA2  GLY   1           1HA      GLY   1  12.373  -8.135   9.003
    5    HA3  GLY   1           2HA      GLY   1  14.074  -7.680   8.801
    6    H    SER   2           H        SER   2  13.721  -6.150   7.181
    7    HA   SER   2           HA       SER   2  12.168  -6.562   4.810
    8    HB2  SER   2           1HB      SER   2  14.470  -4.648   5.339
    9    HB3  SER   2           2HB      SER   2  13.315  -4.536   3.998
   10    HG   SER   2           HG       SER   2  12.820  -3.222   5.885
   11    H    SER   3           H        SER   3  12.886  -6.699   2.616
   12    HA   SER   3           HA       SER   3  14.889  -8.733   2.120
   13    HB2  SER   3           1HB      SER   3  12.748  -8.430   0.843
   14    HB3  SER   3           2HB      SER   3  13.455  -6.980   0.097
   15    HG   SER   3           HG       SER   3  13.739  -8.928  -1.151
   16    H    GLY   4           H        GLY   4  16.623  -8.506   0.525
   17    HA2  GLY   4           1HA      GLY   4  18.489  -6.366   1.189
   18    HA3  GLY   4           2HA      GLY   4  18.776  -7.741   0.123
   19    H    SER   5           H        SER   5  16.741  -4.800   0.198
   20    HA   SER   5           HA       SER   5  17.648  -3.967  -2.510
   21    HB2  SER   5           1HB      SER   5  15.547  -5.399  -2.657
   22    HB3  SER   5           2HB      SER   5  14.704  -4.114  -1.772
   23    HG   SER   5           HG       SER   5  14.566  -3.936  -4.097
   24    H    SER   6           H        SER   6  16.488  -1.762  -3.014
   25    HA   SER   6           HA       SER   6  17.487   0.191  -1.201
   26    HB2  SER   6           1HB      SER   6  15.424   0.531  -3.413
   27    HB3  SER   6           2HB      SER   6  16.380   1.825  -2.670
   28    HG   SER   6           HG       SER   6  18.265   0.858  -3.502
   29    H    GLY   7           H        GLY   7  16.498   1.684   0.147
   30    HA2  GLY   7           1HA      GLY   7  14.318   0.701   1.747
   31    HA3  GLY   7           2HA      GLY   7  15.222   2.197   1.990
   32    H    LYS   8           H        LYS   8  13.169   1.178  -0.750
   33    HA   LYS   8           HA       LYS   8  11.668   3.686  -0.795
   34    HB2  LYS   8           1HB      LYS   8  11.470   1.037  -2.278
   35    HB3  LYS   8           2HB      LYS   8  10.253   2.291  -2.491
   36    HG2  LYS   8           1HG      LYS   8  13.226   2.720  -3.018
   37    HG3  LYS   8           2HG      LYS   8  12.032   2.269  -4.243
   38    HD2  LYS   8           1HD      LYS   8  10.734   4.350  -3.734
   39    HD3  LYS   8           2HD      LYS   8  12.013   4.846  -2.601
   40    HE2  LYS   8           1HE      LYS   8  13.672   4.755  -4.427
   41    HE3  LYS   8           2HE      LYS   8  12.402   4.264  -5.560
   42    HZ1  LYS   8           3HZ      LYS   8  12.473   6.854  -4.101
   43    HZ2  LYS   8           1HZ      LYS   8  11.299   6.400  -5.144
   44    HZ3  LYS   8           2HZ      LYS   8  12.817   6.655  -5.682
   45    H    ILE   9           H        ILE   9   9.653   4.103  -0.247
   46    HA   ILE   9           HA       ILE   9   7.925   2.021   0.941
   47    HB   ILE   9           HB       ILE   9   7.141   3.525   2.711
   48   HG12  ILE   9          1HG1      ILE   9   9.036   5.386   3.259
   49   HG13  ILE   9          2HG1      ILE   9   9.125   5.460   1.516
   50   HG21  ILE   9          1HG2      ILE   9  10.133   3.036   2.895
   51   HG22  ILE   9          2HG2      ILE   9   8.975   3.187   4.229
   52   HG23  ILE   9          3HG2      ILE   9   8.870   1.804   3.130
   53   HD11  ILE   9          3HD1      ILE   9   6.663   5.950   1.432
   54   HD12  ILE   9          1HD1      ILE   9   6.612   5.851   3.204
   55   HD13  ILE   9          2HD1      ILE   9   7.556   7.125   2.412
   56    H    PHE  10           H        PHE  10   5.705   2.479   0.923
   57    HA   PHE  10           HA       PHE  10   4.742   4.467  -1.102
   58    HB2  PHE  10           1HB      PHE  10   4.072   1.503  -0.825
   59    HB3  PHE  10           2HB      PHE  10   3.192   2.627  -1.840
   60    HD1  PHE  10           2HD      PHE  10   6.445   0.879  -1.410
   61    HD2  PHE  10           1HD      PHE  10   4.038   3.387  -3.966
   62    HE1  PHE  10           2HE      PHE  10   8.008   0.458  -3.300
   63    HE2  PHE  10           1HE      PHE  10   5.590   2.949  -5.854
   64    HZ   PHE  10           HZ       PHE  10   7.547   1.460  -5.536
   65    H    THR  11           H        THR  11   2.976   5.623  -0.423
   66    HA   THR  11           HA       THR  11   1.770   4.894   2.220
   67    HB   THR  11           HB       THR  11   1.861   7.660   0.994
   68    HG1  THR  11           1HG      THR  11   3.677   8.025   2.228
   69   HG21  THR  11          3HG2      THR  11   1.735   8.283   3.450
   70   HG22  THR  11          1HG2      THR  11   1.472   6.564   3.818
   71   HG23  THR  11          2HG2      THR  11   0.298   7.471   2.821
   72    H    CYS  12           H        CYS  12  -0.356   4.685   2.480
   73    HA   CYS  12           HA       CYS  12  -2.256   4.728   0.333
   74    HB2  CYS  12           1HB      CYS  12  -2.333   3.285   2.335
   75    HB3  CYS  12           2HB      CYS  12  -2.548   4.720   3.357
   76    H    GLU  13           H        GLU  13  -3.408   6.343  -0.500
   77    HA   GLU  13           HA       GLU  13  -3.139   9.048   0.595
   78    HB2  GLU  13           1HB      GLU  13  -4.320   9.791  -1.366
   79    HB3  GLU  13           2HB      GLU  13  -3.059   8.649  -1.829
   80    HG2  GLU  13           1HG      GLU  13  -4.783   6.855  -2.037
   81    HG3  GLU  13           2HG      GLU  13  -6.036   8.028  -1.613
   82    H    TYR  14           H        TYR  14  -5.194   6.473   1.285
   83    HA   TYR  14           HA       TYR  14  -7.578   8.150   1.883
   84    HB2  TYR  14           1HB      TYR  14  -7.205   5.151   1.753
   85    HB3  TYR  14           2HB      TYR  14  -8.715   5.980   2.050
   86    HD1  TYR  14           1HD      TYR  14  -9.744   7.404   0.232
   87    HD2  TYR  14           2HD      TYR  14  -6.359   4.818  -0.499
   88    HE1  TYR  14           1HE      TYR  14 -10.219   7.461  -2.216
   89    HE2  TYR  14           2HE      TYR  14  -6.840   4.883  -2.934
   90    HH   TYR  14           HH       TYR  14  -8.211   5.678  -4.590
   91    H    CYS  15           H        CYS  15  -5.232   6.031   3.541
   92    HA   CYS  15           HA       CYS  15  -6.215   7.111   6.136
   93    HB2  CYS  15           1HB      CYS  15  -6.152   5.000   7.224
   94    HB3  CYS  15           2HB      CYS  15  -7.247   4.933   5.849
   95    H    ASN  16           H        ASN  16  -3.592   6.945   4.189
   96    HA   ASN  16           HA       ASN  16  -1.396   7.267   4.380
   97    HB2  ASN  16           1HB      ASN  16  -1.951   8.579   7.027
   98    HB3  ASN  16           2HB      ASN  16  -0.624   8.899   5.909
   99   HD21  ASN  16          1HD2      ASN  16  -2.100   9.036   3.414
  100   HD22  ASN  16          2HD2      ASN  16  -3.065  10.498   3.552
  101    H    LYS  17           H        LYS  17  -2.273   4.681   5.356
  102    HA   LYS  17           HA       LYS  17  -0.140   3.790   7.159
  103    HB2  LYS  17           1HB      LYS  17  -2.328   2.616   6.994
  104    HB3  LYS  17           2HB      LYS  17  -1.988   2.210   5.308
  105    HG2  LYS  17           1HG      LYS  17  -0.094   0.824   5.959
  106    HG3  LYS  17           2HG      LYS  17  -0.206   1.377   7.641
  107    HD2  LYS  17           1HD      LYS  17  -2.378   0.279   7.903
  108    HD3  LYS  17           2HD      LYS  17  -2.376  -0.207   6.195
  109    HE2  LYS  17           1HE      LYS  17  -0.327  -1.547   6.560
  110    HE3  LYS  17           2HE      LYS  17  -0.267  -1.025   8.247
  111    HZ1  LYS  17           3HZ      LYS  17  -1.288  -3.214   8.047
  112    HZ2  LYS  17           1HZ      LYS  17  -2.453  -2.650   7.055
  113    HZ3  LYS  17           2HZ      LYS  17  -2.393  -2.158   8.613
  114    H    VAL  18           H        VAL  18   1.753   2.779   6.547
  115    HA   VAL  18           HA       VAL  18   2.615   3.190   3.728
  116    HB   VAL  18           HB       VAL  18   4.976   3.200   4.824
  117   HG11  VAL  18          1HG1      VAL  18   3.112   5.580   5.000
  118   HG12  VAL  18          2HG1      VAL  18   4.886   5.636   4.965
  119   HG13  VAL  18          3HG1      VAL  18   4.004   5.028   3.557
  120   HG21  VAL  18          3HG2      VAL  18   4.151   2.772   7.175
  121   HG22  VAL  18          1HG2      VAL  18   5.117   4.249   6.986
  122   HG23  VAL  18          2HG2      VAL  18   3.353   4.372   7.112
  123    H    PHE  19           H        PHE  19   3.781   1.806   2.648
  124    HA   PHE  19           HA       PHE  19   4.147  -0.980   3.667
  125    HB2  PHE  19           1HB      PHE  19   3.106  -0.111   0.944
  126    HB3  PHE  19           2HB      PHE  19   3.362  -1.760   1.485
  127    HD1  PHE  19           2HD      PHE  19   1.245   1.270   1.944
  128    HD2  PHE  19           1HD      PHE  19   1.741  -2.911   2.859
  129    HE1  PHE  19           2HE      PHE  19  -1.004   1.237   3.005
  130    HE2  PHE  19           1HE      PHE  19  -0.524  -2.954   3.882
  131    HZ   PHE  19           HZ       PHE  19  -1.874  -0.870   3.988
  132    H    LYS  20           H        LYS  20   5.669  -2.243   2.398
  133    HA   LYS  20           HA       LYS  20   8.092  -0.675   1.800
  134    HB2  LYS  20           1HB      LYS  20   7.613  -3.676   1.989
  135    HB3  LYS  20           2HB      LYS  20   9.193  -2.869   1.896
  136    HG2  LYS  20           1HG      LYS  20   8.552  -1.613   4.027
  137    HG3  LYS  20           2HG      LYS  20   7.134  -2.673   4.138
  138    HD2  LYS  20           1HD      LYS  20   8.677  -4.662   4.145
  139    HD3  LYS  20           2HD      LYS  20  10.062  -3.542   4.133
  140    HE2  LYS  20           1HE      LYS  20   9.243  -2.528   6.254
  141    HE3  LYS  20           2HE      LYS  20   7.885  -3.664   6.269
  142    HZ1  LYS  20           3HZ      LYS  20  10.757  -4.434   6.398
  143    HZ2  LYS  20           1HZ      LYS  20   9.495  -5.483   6.438
  144    HZ3  LYS  20           2HZ      LYS  20   9.727  -4.432   7.667
  145    H    PHE  21           H        PHE  21   5.723  -2.363  -0.080
  146    HA   PHE  21           HA       PHE  21   7.310  -1.990  -2.571
  147    HB2  PHE  21           1HB      PHE  21   5.606  -4.419  -1.930
  148    HB3  PHE  21           2HB      PHE  21   6.637  -4.170  -3.326
  149    HD1  PHE  21           2HD      PHE  21   9.205  -3.978  -2.926
  150    HD2  PHE  21           1HD      PHE  21   6.440  -5.468   0.028
  151    HE1  PHE  21           2HE      PHE  21  11.088  -5.030  -1.692
  152    HE2  PHE  21           1HE      PHE  21   8.326  -6.503   1.272
  153    HZ   PHE  21           HZ       PHE  21  10.651  -6.290   0.410
  154    H    LYS  22           H        LYS  22   6.028  -1.757  -4.496
  155    HA   LYS  22           HA       LYS  22   3.802  -0.043  -4.121
  156    HB2  LYS  22           1HB      LYS  22   5.373  -0.080  -6.104
  157    HB3  LYS  22           2HB      LYS  22   4.541  -1.529  -6.678
  158    HG2  LYS  22           1HG      LYS  22   2.399  -0.252  -6.665
  159    HG3  LYS  22           2HG      LYS  22   3.245   1.187  -6.123
  160    HD2  LYS  22           1HD      LYS  22   2.863   1.384  -8.490
  161    HD3  LYS  22           2HD      LYS  22   4.601   1.179  -8.220
  162    HE2  LYS  22           1HE      LYS  22   4.413  -1.226  -8.822
  163    HE3  LYS  22           2HE      LYS  22   2.666  -1.046  -9.026
  164    HZ1  LYS  22           3HZ      LYS  22   3.108   0.518 -10.845
  165    HZ2  LYS  22           1HZ      LYS  22   3.827  -0.913 -11.154
  166    HZ3  LYS  22           2HZ      LYS  22   4.723   0.354 -10.654
  167    H    HIS  23           H        HIS  23   3.773  -3.396  -5.374
  168    HA   HIS  23           HA       HIS  23   0.989  -3.621  -5.670
  169    HB2  HIS  23           1HB      HIS  23   1.337  -5.983  -5.856
  170    HB3  HIS  23           2HB      HIS  23   2.687  -5.164  -6.629
  171    HD1  HIS  23           1HD      HIS  23   1.921  -7.597  -3.827
  172    HD2  HIS  23           2HD      HIS  23   5.105  -5.225  -5.217
  173    HE1  HIS  23           1HE      HIS  23   4.015  -8.447  -2.648
  174    H    SER  24           H        SER  24   2.876  -3.860  -2.746
  175    HA   SER  24           HA       SER  24   0.948  -5.205  -1.059
  176    HB2  SER  24           1HB      SER  24   3.174  -3.250  -0.366
  177    HB3  SER  24           2HB      SER  24   2.237  -4.167   0.800
  178    HG   SER  24           HG       SER  24   3.052  -6.091  -0.118
  179    H    LEU  25           H        LEU  25   1.643  -1.723  -1.625
  180    HA   LEU  25           HA       LEU  25  -0.579  -0.745  -0.071
  181    HB2  LEU  25           1HB      LEU  25   1.260   0.738  -0.608
  182    HB3  LEU  25           2HB      LEU  25   1.079   0.435  -2.336
  183    HG   LEU  25           HG       LEU  25  -1.135   1.556  -2.331
  184   HD11  LEU  25          1HD1      LEU  25  -1.911   2.810  -0.429
  185   HD12  LEU  25          2HD1      LEU  25  -0.507   2.325   0.550
  186   HD13  LEU  25          3HD1      LEU  25  -1.743   1.140   0.074
  187   HD21  LEU  25          3HD2      LEU  25  -0.326   3.821  -2.064
  188   HD22  LEU  25          1HD2      LEU  25   0.909   2.811  -2.836
  189   HD23  LEU  25          2HD2      LEU  25   1.059   3.246  -1.115
  190    H    GLN  26           H        GLN  26  -0.175  -1.582  -3.524
  191    HA   GLN  26           HA       GLN  26  -2.680  -0.553  -4.431
  192    HB2  GLN  26           1HB      GLN  26  -1.029  -2.848  -5.539
  193    HB3  GLN  26           2HB      GLN  26  -2.457  -2.193  -6.329
  194    HG2  GLN  26           1HG      GLN  26  -1.403   0.030  -6.504
  195    HG3  GLN  26           2HG      GLN  26   0.047  -0.569  -5.725
  196   HE21  GLN  26          1HE2      GLN  26  -1.820  -0.568  -8.735
  197   HE22  GLN  26          2HE2      GLN  26  -0.609  -1.433  -9.671
  198    H    ALA  27           H        ALA  27  -1.929  -3.753  -3.103
  199    HA   ALA  27           HA       ALA  27  -4.581  -4.873  -3.355
  200    HB1  ALA  27           1HB      ALA  27  -2.520  -6.196  -3.074
  201    HB2  ALA  27           2HB      ALA  27  -2.263  -5.456  -1.474
  202    HB3  ALA  27           3HB      ALA  27  -3.666  -6.519  -1.746
  203    H    HIS  28           H        HIS  28  -2.964  -2.957  -0.778
  204    HA   HIS  28           HA       HIS  28  -5.080  -3.200   1.164
  205    HB2  HIS  28           1HB      HIS  28  -2.937  -2.559   1.918
  206    HB3  HIS  28           2HB      HIS  28  -2.782  -1.268   0.742
  207    HD1  HIS  28           1HD      HIS  28  -4.706  -2.021   3.998
  208    HD2  HIS  28           2HD      HIS  28  -3.745   1.104   1.356
  209    HE1  HIS  28           1HE      HIS  28  -5.431   0.116   5.162
  210    H    LEU  29           H        LEU  29  -4.659  -1.002  -1.626
  211    HA   LEU  29           HA       LEU  29  -6.686   0.872  -1.007
  212    HB2  LEU  29           1HB      LEU  29  -6.093  -0.214  -3.781
  213    HB3  LEU  29           2HB      LEU  29  -6.836   1.328  -3.380
  214    HG   LEU  29           HG       LEU  29  -3.977   0.494  -2.863
  215   HD11  LEU  29          1HD1      LEU  29  -3.418   2.236  -4.456
  216   HD12  LEU  29          2HD1      LEU  29  -5.144   2.634  -4.654
  217   HD13  LEU  29          3HD1      LEU  29  -4.517   1.044  -5.175
  218   HD21  LEU  29          3HD2      LEU  29  -4.620   1.959  -1.009
  219   HD22  LEU  29          1HD2      LEU  29  -5.437   3.076  -2.120
  220   HD23  LEU  29          2HD2      LEU  29  -3.665   2.916  -2.145
  221    H    ARG  30           H        ARG  30  -7.099  -2.443  -2.009
  222    HA   ARG  30           HA       ARG  30  -9.739  -2.312  -3.079
  223    HB2  ARG  30           1HB      ARG  30  -8.404  -4.627  -1.624
  224    HB3  ARG  30           2HB      ARG  30  -9.796  -4.722  -2.707
  225    HG2  ARG  30           1HG      ARG  30  -8.445  -4.021  -4.623
  226    HG3  ARG  30           2HG      ARG  30  -7.029  -3.777  -3.592
  227    HD2  ARG  30           1HD      ARG  30  -7.063  -6.170  -2.966
  228    HD3  ARG  30           2HD      ARG  30  -8.434  -6.431  -4.066
  229    HE   ARG  30           HE       ARG  30  -6.520  -5.237  -5.668
  230   HH11  ARG  30          2HH1      ARG  30  -6.518  -8.167  -3.746
  231   HH12  ARG  30          1HH1      ARG  30  -5.327  -8.938  -4.758
  232   HH21  ARG  30          2HH2      ARG  30  -5.014  -6.284  -6.923
  233   HH22  ARG  30          1HH2      ARG  30  -4.507  -7.895  -6.511
  234    H    ILE  31           H        ILE  31  -8.813  -1.934   0.225
  235    HA   ILE  31           HA       ILE  31 -11.523  -2.519   1.240
  236    HB   ILE  31           HB       ILE  31 -10.790  -2.083   3.356
  237   HG12  ILE  31          1HG1      ILE  31  -8.418  -0.532   2.289
  238   HG13  ILE  31          2HG1      ILE  31  -9.794   0.082   3.190
  239   HG21  ILE  31          1HG2      ILE  31  -8.284  -3.241   2.070
  240   HG22  ILE  31          2HG2      ILE  31  -8.942  -3.583   3.681
  241   HG23  ILE  31          3HG2      ILE  31  -9.812  -4.130   2.248
  242   HD11  ILE  31          3HD1      ILE  31  -9.095  -1.285   5.165
  243   HD12  ILE  31          1HD1      ILE  31  -7.606  -1.711   4.281
  244   HD13  ILE  31          2HD1      ILE  31  -7.947  -0.020   4.686
  245    H    HIS  32           H        HIS  32  -9.804   0.194  -0.028
  246    HA   HIS  32           HA       HIS  32 -11.637   2.243   1.037
  247    HB2  HIS  32           1HB      HIS  32  -9.065   2.338  -0.593
  248    HB3  HIS  32           2HB      HIS  32  -9.947   3.742  -0.070
  249    HD1  HIS  32           1HD      HIS  32 -10.330   3.603   2.888
  250    HD2  HIS  32           2HD      HIS  32  -7.019   1.940   0.912
  251    HE1  HIS  32           1HE      HIS  32  -8.467   3.521   4.613
  252    H    THR  33           H        THR  33 -11.066   0.497  -1.992
  253    HA   THR  33           HA       THR  33 -12.290   2.372  -3.776
  254    HB   THR  33           HB       THR  33 -12.608   0.377  -5.280
  255    HG1  THR  33           1HG      THR  33 -11.739  -1.548  -4.649
  256   HG21  THR  33          3HG2      THR  33  -9.822   0.736  -4.105
  257   HG22  THR  33          1HG2      THR  33 -10.547   1.699  -5.406
  258   HG23  THR  33          2HG2      THR  33 -10.207  -0.024  -5.659
  259    H    ASN  34           H        ASN  34 -14.306   2.485  -4.712
  260    HA   ASN  34           HA       ASN  34 -16.576   1.435  -3.124
  261    HB2  ASN  34           1HB      ASN  34 -16.386   3.870  -3.636
  262    HB3  ASN  34           2HB      ASN  34 -16.506   3.500  -5.358
  263   HD21  ASN  34          1HD2      ASN  34 -18.383   5.058  -5.088
  264   HD22  ASN  34          2HD2      ASN  34 -19.924   4.360  -4.606
  265    H    GLU  35           H        GLU  35 -15.805  -0.746  -3.979
  266    HA   GLU  35           HA       GLU  35 -17.277  -1.482  -6.462
  267    HB2  GLU  35           1HB      GLU  35 -14.882  -1.012  -7.000
  268    HB3  GLU  35           2HB      GLU  35 -14.396  -2.273  -5.861
  269    HG2  GLU  35           1HG      GLU  35 -15.528  -3.979  -7.218
  270    HG3  GLU  35           2HG      GLU  35 -16.196  -2.736  -8.280
  271    H    LYS  36           H        LYS  36 -18.029  -3.587  -6.550
  272    HA   LYS  36           HA       LYS  36 -17.597  -5.473  -4.333
  273    HB2  LYS  36           1HB      LYS  36 -19.955  -5.758  -3.869
  274    HB3  LYS  36           2HB      LYS  36 -19.453  -4.106  -3.518
  275    HG2  LYS  36           1HG      LYS  36 -20.438  -3.350  -5.687
  276    HG3  LYS  36           2HG      LYS  36 -20.984  -4.995  -6.012
  277    HD2  LYS  36           1HD      LYS  36 -21.831  -3.242  -3.667
  278    HD3  LYS  36           2HD      LYS  36 -22.782  -3.527  -5.120
  279    HE2  LYS  36           1HE      LYS  36 -21.975  -5.664  -3.090
  280    HE3  LYS  36           2HE      LYS  36 -23.537  -4.852  -3.152
  281    HZ1  LYS  36           3HZ      LYS  36 -22.446  -6.580  -5.307
  282    HZ2  LYS  36           1HZ      LYS  36 -23.880  -5.795  -5.374
  283    HZ3  LYS  36           2HZ      LYS  36 -23.646  -6.979  -4.279
  Start of MODEL   13
    1    H1   GLY   1           1H       GLY   1  21.300  16.110  -7.058
    2    H2   GLY   1           2H       GLY   1  22.329  15.971  -5.791
    3    H3   GLY   1           3H       GLY   1  21.032  16.963  -5.684
    4    HA2  GLY   1           1HA      GLY   1  19.514  15.095  -5.821
    5    HA3  GLY   1           2HA      GLY   1  20.925  14.026  -5.917
    6    H    SER   2           H        SER   2  20.108  12.946  -4.016
    7    HA   SER   2           HA       SER   2  19.930  14.333  -1.454
    8    HB2  SER   2           1HB      SER   2  19.533  12.065  -0.563
    9    HB3  SER   2           2HB      SER   2  18.460  12.473  -1.910
   10    HG   SER   2           HG       SER   2  19.381  10.350  -2.073
   11    H    SER   3           H        SER   3  21.158  13.640   0.459
   12    HA   SER   3           HA       SER   3  24.034  13.708  -0.004
   13    HB2  SER   3           1HB      SER   3  24.127  13.835   2.475
   14    HB3  SER   3           2HB      SER   3  23.080  15.059   1.740
   15    HG   SER   3           HG       SER   3  22.095  14.034   3.558
   16    H    GLY   4           H        GLY   4  21.791  11.122   0.415
   17    HA2  GLY   4           1HA      GLY   4  23.710   9.071   0.071
   18    HA3  GLY   4           2HA      GLY   4  23.348   9.180   1.795
   19    H    SER   5           H        SER   5  22.818   6.863   0.521
   20    HA   SER   5           HA       SER   5  20.197   6.602  -0.605
   21    HB2  SER   5           1HB      SER   5  21.961   4.488   0.684
   22    HB3  SER   5           2HB      SER   5  20.569   4.191  -0.374
   23    HG   SER   5           HG       SER   5  22.570   4.121  -1.515
   24    H    SER   6           H        SER   6  18.317   5.652   0.202
   25    HA   SER   6           HA       SER   6  18.027   4.989   3.048
   26    HB2  SER   6           1HB      SER   6  17.638   7.488   2.858
   27    HB3  SER   6           2HB      SER   6  16.246   7.128   1.819
   28    HG   SER   6           HG       SER   6  15.695   7.371   4.062
   29    H    GLY   7           H        GLY   7  15.906   3.992   3.495
   30    HA2  GLY   7           1HA      GLY   7  15.181   2.050   1.474
   31    HA3  GLY   7           2HA      GLY   7  14.426   2.252   3.052
   32    H    LYS   8           H        LYS   8  13.383   1.870   0.211
   33    HA   LYS   8           HA       LYS   8  11.763   4.301  -0.234
   34    HB2  LYS   8           1HB      LYS   8  13.056   2.912  -2.010
   35    HB3  LYS   8           2HB      LYS   8  11.698   1.797  -1.955
   36    HG2  LYS   8           1HG      LYS   8  11.357   4.789  -2.435
   37    HG3  LYS   8           2HG      LYS   8  11.797   3.696  -3.743
   38    HD2  LYS   8           1HD      LYS   8   9.728   2.478  -3.593
   39    HD3  LYS   8           2HD      LYS   8   9.277   3.298  -2.099
   40    HE2  LYS   8           1HE      LYS   8   9.497   5.505  -3.469
   41    HE3  LYS   8           2HE      LYS   8   9.439   4.459  -4.894
   42    HZ1  LYS   8           3HZ      LYS   8   7.285   3.614  -4.037
   43    HZ2  LYS   8           1HZ      LYS   8   7.223   5.237  -4.266
   44    HZ3  LYS   8           2HZ      LYS   8   7.379   4.628  -2.752
   45    H    ILE   9           H        ILE   9   9.630   4.487   0.101
   46    HA   ILE   9           HA       ILE   9   8.011   2.149   0.973
   47    HB   ILE   9           HB       ILE   9   6.854   3.645   2.612
   48   HG12  ILE   9          1HG1      ILE   9   9.321   5.427   2.468
   49   HG13  ILE   9          2HG1      ILE   9   7.848   5.802   1.570
   50   HG21  ILE   9          1HG2      ILE   9   8.483   1.891   3.257
   51   HG22  ILE   9          2HG2      ILE   9   9.789   3.094   3.208
   52   HG23  ILE   9          3HG2      ILE   9   8.471   3.248   4.385
   53   HD11  ILE   9          3HD1      ILE   9   7.913   7.017   3.688
   54   HD12  ILE   9          1HD1      ILE   9   6.543   5.897   3.621
   55   HD13  ILE   9          2HD1      ILE   9   7.983   5.494   4.594
   56    H    PHE  10           H        PHE  10   5.741   2.459   0.849
   57    HA   PHE  10           HA       PHE  10   4.743   4.431  -1.177
   58    HB2  PHE  10           1HB      PHE  10   4.071   1.471  -0.872
   59    HB3  PHE  10           2HB      PHE  10   3.181   2.594  -1.879
   60    HD1  PHE  10           2HD      PHE  10   6.490   0.915  -1.468
   61    HD2  PHE  10           1HD      PHE  10   3.907   3.189  -4.071
   62    HE1  PHE  10           2HE      PHE  10   7.975   0.402  -3.393
   63    HE2  PHE  10           1HE      PHE  10   5.382   2.658  -5.995
   64    HZ   PHE  10           HZ       PHE  10   7.397   1.242  -5.668
   65    H    THR  11           H        THR  11   2.959   5.570  -0.478
   66    HA   THR  11           HA       THR  11   1.795   4.836   2.187
   67    HB   THR  11           HB       THR  11   1.944   7.610   0.986
   68    HG1  THR  11           1HG      THR  11   3.752   7.924   2.241
   69   HG21  THR  11          3HG2      THR  11   1.512   6.514   3.804
   70   HG22  THR  11          1HG2      THR  11   0.351   7.424   2.801
   71   HG23  THR  11          2HG2      THR  11   1.792   8.229   3.434
   72    H    CYS  12           H        CYS  12  -0.323   4.607   2.423
   73    HA   CYS  12           HA       CYS  12  -2.209   4.672   0.264
   74    HB2  CYS  12           1HB      CYS  12  -2.287   3.162   2.214
   75    HB3  CYS  12           2HB      CYS  12  -2.504   4.557   3.287
   76    H    GLU  13           H        GLU  13  -3.244   6.344  -0.590
   77    HA   GLU  13           HA       GLU  13  -3.050   9.005   0.563
   78    HB2  GLU  13           1HB      GLU  13  -4.212   9.760  -1.407
   79    HB3  GLU  13           2HB      GLU  13  -2.956   8.609  -1.862
   80    HG2  GLU  13           1HG      GLU  13  -4.691   6.826  -2.082
   81    HG3  GLU  13           2HG      GLU  13  -5.939   8.006  -1.663
   82    H    TYR  14           H        TYR  14  -5.111   6.465   1.282
   83    HA   TYR  14           HA       TYR  14  -7.493   8.156   1.856
   84    HB2  TYR  14           1HB      TYR  14  -7.112   5.161   1.784
   85    HB3  TYR  14           2HB      TYR  14  -8.630   5.988   2.068
   86    HD1  TYR  14           1HD      TYR  14  -9.698   7.337   0.234
   87    HD2  TYR  14           2HD      TYR  14  -6.254   4.823  -0.474
   88    HE1  TYR  14           1HE      TYR  14 -10.179   7.353  -2.213
   89    HE2  TYR  14           2HE      TYR  14  -6.737   4.854  -2.910
   90    HH   TYR  14           HH       TYR  14  -8.129   5.598  -4.572
   91    H    CYS  15           H        CYS  15  -5.144   6.052   3.530
   92    HA   CYS  15           HA       CYS  15  -6.143   7.114   6.124
   93    HB2  CYS  15           1HB      CYS  15  -6.074   4.994   7.187
   94    HB3  CYS  15           2HB      CYS  15  -7.165   4.940   5.807
   95    H    ASN  16           H        ASN  16  -3.489   7.008   4.207
   96    HA   ASN  16           HA       ASN  16  -1.302   7.379   4.446
   97    HB2  ASN  16           1HB      ASN  16  -2.067   8.536   7.136
   98    HB3  ASN  16           2HB      ASN  16  -0.530   8.774   6.316
   99   HD21  ASN  16          1HD2      ASN  16  -3.951   9.641   6.274
  100   HD22  ASN  16          2HD2      ASN  16  -3.766  10.890   5.051
  101    H    LYS  17           H        LYS  17  -2.259   4.702   5.327
  102    HA   LYS  17           HA       LYS  17  -0.150   3.712   7.098
  103    HB2  LYS  17           1HB      LYS  17  -2.373   2.610   6.904
  104    HB3  LYS  17           2HB      LYS  17  -2.022   2.202   5.219
  105    HG2  LYS  17           1HG      LYS  17  -0.164   0.772   5.892
  106    HG3  LYS  17           2HG      LYS  17  -0.292   1.320   7.574
  107    HD2  LYS  17           1HD      LYS  17  -2.497   0.270   7.790
  108    HD3  LYS  17           2HD      LYS  17  -2.461  -0.225   6.084
  109    HE2  LYS  17           1HE      LYS  17  -0.447  -1.597   6.506
  110    HE3  LYS  17           2HE      LYS  17  -0.414  -1.063   8.190
  111    HZ1  LYS  17           3HZ      LYS  17  -2.599  -2.665   6.965
  112    HZ2  LYS  17           1HZ      LYS  17  -2.564  -2.158   8.520
  113    HZ3  LYS  17           2HZ      LYS  17  -1.464  -3.236   7.988
  114    H    VAL  18           H        VAL  18   1.706   2.650   6.486
  115    HA   VAL  18           HA       VAL  18   2.629   3.129   3.696
  116    HB   VAL  18           HB       VAL  18   4.966   3.133   4.853
  117   HG11  VAL  18          1HG1      VAL  18   4.019   4.992   3.620
  118   HG12  VAL  18          2HG1      VAL  18   3.038   5.467   5.033
  119   HG13  VAL  18          3HG1      VAL  18   4.804   5.579   5.096
  120   HG21  VAL  18          3HG2      VAL  18   3.272   4.242   7.119
  121   HG22  VAL  18          1HG2      VAL  18   4.074   2.642   7.172
  122   HG23  VAL  18          2HG2      VAL  18   5.040   4.126   7.040
  123    H    PHE  19           H        PHE  19   3.824   1.775   2.612
  124    HA   PHE  19           HA       PHE  19   4.207  -1.020   3.585
  125    HB2  PHE  19           1HB      PHE  19   3.123  -0.152   0.875
  126    HB3  PHE  19           2HB      PHE  19   3.413  -1.800   1.422
  127    HD1  PHE  19           2HD      PHE  19   1.273   1.217   1.920
  128    HD2  PHE  19           1HD      PHE  19   1.791  -2.977   2.765
  129    HE1  PHE  19           2HE      PHE  19  -0.977   1.154   2.977
  130    HE2  PHE  19           1HE      PHE  19  -0.472  -3.049   3.787
  131    HZ   PHE  19           HZ       PHE  19  -1.835  -0.974   3.924
  132    H    LYS  20           H        LYS  20   5.684  -2.265   2.249
  133    HA   LYS  20           HA       LYS  20   8.113  -0.707   1.656
  134    HB2  LYS  20           1HB      LYS  20   7.576  -3.679   1.951
  135    HB3  LYS  20           2HB      LYS  20   9.175  -2.942   1.685
  136    HG2  LYS  20           1HG      LYS  20   8.801  -1.523   3.749
  137    HG3  LYS  20           2HG      LYS  20   7.288  -2.395   4.026
  138    HD2  LYS  20           1HD      LYS  20   8.991  -3.285   5.448
  139    HD3  LYS  20           2HD      LYS  20   8.539  -4.510   4.245
  140    HE2  LYS  20           1HE      LYS  20  10.574  -3.967   2.930
  141    HE3  LYS  20           2HE      LYS  20  10.994  -2.695   4.084
  142    HZ1  LYS  20           3HZ      LYS  20  11.222  -4.416   5.795
  143    HZ2  LYS  20           1HZ      LYS  20  12.210  -4.748   4.541
  144    HZ3  LYS  20           2HZ      LYS  20  10.828  -5.593   4.731
  145    H    PHE  21           H        PHE  21   5.716  -2.369  -0.211
  146    HA   PHE  21           HA       PHE  21   7.248  -1.968  -2.727
  147    HB2  PHE  21           1HB      PHE  21   5.690  -4.470  -1.974
  148    HB3  PHE  21           2HB      PHE  21   6.542  -4.176  -3.479
  149    HD1  PHE  21           2HD      PHE  21   9.119  -3.829  -3.379
  150    HD2  PHE  21           1HD      PHE  21   6.809  -5.496  -0.140
  151    HE1  PHE  21           2HE      PHE  21  11.187  -4.798  -2.400
  152    HE2  PHE  21           1HE      PHE  21   8.879  -6.460   0.838
  153    HZ   PHE  21           HZ       PHE  21  11.071  -6.110  -0.288
  154    H    LYS  22           H        LYS  22   5.926  -1.786  -4.617
  155    HA   LYS  22           HA       LYS  22   3.677  -0.125  -4.236
  156    HB2  LYS  22           1HB      LYS  22   5.212  -0.198  -6.252
  157    HB3  LYS  22           2HB      LYS  22   4.379  -1.665  -6.773
  158    HG2  LYS  22           1HG      LYS  22   2.225  -0.398  -6.745
  159    HG3  LYS  22           2HG      LYS  22   3.086   1.059  -6.261
  160    HD2  LYS  22           1HD      LYS  22   2.645   1.184  -8.625
  161    HD3  LYS  22           2HD      LYS  22   4.388   1.002  -8.384
  162    HE2  LYS  22           1HE      LYS  22   4.211  -1.420  -8.914
  163    HE3  LYS  22           2HE      LYS  22   2.460  -1.261  -9.092
  164    HZ1  LYS  22           3HZ      LYS  22   3.582  -1.176 -11.243
  165    HZ2  LYS  22           1HZ      LYS  22   4.476   0.111 -10.794
  166    HZ3  LYS  22           2HZ      LYS  22   2.857   0.258 -10.961
  167    H    HIS  23           H        HIS  23   3.657  -3.495  -5.442
  168    HA   HIS  23           HA       HIS  23   0.876  -3.747  -5.709
  169    HB2  HIS  23           1HB      HIS  23   1.247  -6.115  -5.859
  170    HB3  HIS  23           2HB      HIS  23   2.576  -5.290  -6.662
  171    HD1  HIS  23           1HD      HIS  23   1.873  -7.646  -3.762
  172    HD2  HIS  23           2HD      HIS  23   5.016  -5.312  -5.303
  173    HE1  HIS  23           1HE      HIS  23   3.992  -8.430  -2.584
  174    H    SER  24           H        SER  24   2.797  -3.972  -2.806
  175    HA   SER  24           HA       SER  24   0.884  -5.315  -1.098
  176    HB2  SER  24           1HB      SER  24   3.181  -3.429  -0.451
  177    HB3  SER  24           2HB      SER  24   2.210  -4.276   0.747
  178    HG   SER  24           HG       SER  24   4.037  -5.518   0.286
  179    H    LEU  25           H        LEU  25   1.580  -1.841  -1.678
  180    HA   LEU  25           HA       LEU  25  -0.604  -0.855  -0.073
  181    HB2  LEU  25           1HB      LEU  25   1.231   0.621  -0.633
  182    HB3  LEU  25           2HB      LEU  25   1.023   0.325  -2.359
  183    HG   LEU  25           HG       LEU  25  -1.180   1.461  -2.320
  184   HD11  LEU  25          1HD1      LEU  25  -1.758   1.030   0.096
  185   HD12  LEU  25          2HD1      LEU  25  -1.938   2.699  -0.405
  186   HD13  LEU  25          3HD1      LEU  25  -0.519   2.219   0.555
  187   HD21  LEU  25          3HD2      LEU  25   0.865   2.707  -2.835
  188   HD22  LEU  25          1HD2      LEU  25   1.039   3.128  -1.111
  189   HD23  LEU  25          2HD2      LEU  25  -0.353   3.722  -2.041
  190    H    GLN  26           H        GLN  26  -0.259  -1.680  -3.534
  191    HA   GLN  26           HA       GLN  26  -2.761  -0.645  -4.421
  192    HB2  GLN  26           1HB      GLN  26  -1.136  -2.965  -5.513
  193    HB3  GLN  26           2HB      GLN  26  -2.584  -2.339  -6.290
  194    HG2  GLN  26           1HG      GLN  26  -1.557  -0.116  -6.533
  195    HG3  GLN  26           2HG      GLN  26  -0.082  -0.684  -5.773
  196   HE21  GLN  26          1HE2      GLN  26  -2.000  -0.730  -8.744
  197   HE22  GLN  26          2HE2      GLN  26  -0.812  -1.620  -9.687
  198    H    ALA  27           H        ALA  27  -2.031  -3.852  -3.089
  199    HA   ALA  27           HA       ALA  27  -4.700  -4.933  -3.308
  200    HB1  ALA  27           1HB      ALA  27  -2.647  -6.282  -3.049
  201    HB2  ALA  27           2HB      ALA  27  -2.366  -5.543  -1.452
  202    HB3  ALA  27           3HB      ALA  27  -3.781  -6.595  -1.706
  203    H    HIS  28           H        HIS  28  -3.028  -3.048  -0.747
  204    HA   HIS  28           HA       HIS  28  -5.136  -3.251   1.212
  205    HB2  HIS  28           1HB      HIS  28  -2.979  -2.643   1.955
  206    HB3  HIS  28           2HB      HIS  28  -2.805  -1.362   0.771
  207    HD1  HIS  28           1HD      HIS  28  -4.698  -2.060   4.054
  208    HD2  HIS  28           2HD      HIS  28  -3.773   1.025   1.353
  209    HE1  HIS  28           1HE      HIS  28  -5.404   0.094   5.198
  210    H    LEU  29           H        LEU  29  -4.688  -1.078  -1.596
  211    HA   LEU  29           HA       LEU  29  -6.663   0.842  -0.963
  212    HB2  LEU  29           1HB      LEU  29  -6.120  -0.257  -3.742
  213    HB3  LEU  29           2HB      LEU  29  -6.842   1.294  -3.336
  214    HG   LEU  29           HG       LEU  29  -3.986   0.434  -2.839
  215   HD11  LEU  29          1HD1      LEU  29  -5.151   2.578  -4.631
  216   HD12  LEU  29          2HD1      LEU  29  -4.544   0.980  -5.152
  217   HD13  LEU  29          3HD1      LEU  29  -3.427   2.164  -4.448
  218   HD21  LEU  29          3HD2      LEU  29  -4.592   1.910  -0.987
  219   HD22  LEU  29          1HD2      LEU  29  -5.431   3.020  -2.086
  220   HD23  LEU  29          2HD2      LEU  29  -3.660   2.867  -2.142
  221    H    ARG  30           H        ARG  30  -7.186  -2.468  -1.993
  222    HA   ARG  30           HA       ARG  30  -9.818  -2.229  -3.032
  223    HB2  ARG  30           1HB      ARG  30  -8.636  -4.605  -1.545
  224    HB3  ARG  30           2HB      ARG  30 -10.027  -4.609  -2.643
  225    HG2  ARG  30           1HG      ARG  30  -8.555  -3.914  -4.525
  226    HG3  ARG  30           2HG      ARG  30  -7.154  -3.964  -3.455
  227    HD2  ARG  30           1HD      ARG  30  -7.538  -6.355  -3.008
  228    HD3  ARG  30           2HD      ARG  30  -8.965  -6.348  -4.042
  229    HE   ARG  30           HE       ARG  30  -6.159  -6.419  -4.864
  230   HH11  ARG  30          2HH1      ARG  30  -9.380  -5.690  -6.047
  231   HH12  ARG  30          1HH1      ARG  30  -8.911  -5.911  -7.710
  232   HH21  ARG  30          2HH2      ARG  30  -5.636  -6.673  -7.003
  233   HH22  ARG  30          1HH2      ARG  30  -6.850  -6.453  -8.227
  234    H    ILE  31           H        ILE  31  -8.854  -1.963   0.298
  235    HA   ILE  31           HA       ILE  31 -11.554  -2.422   1.344
  236    HB   ILE  31           HB       ILE  31 -10.779  -1.982   3.441
  237   HG12  ILE  31          1HG1      ILE  31  -8.405  -0.474   2.320
  238   HG13  ILE  31          2HG1      ILE  31  -9.756   0.167   3.238
  239   HG21  ILE  31          1HG2      ILE  31  -8.947  -3.508   3.743
  240   HG22  ILE  31          2HG2      ILE  31  -9.852  -4.052   2.330
  241   HG23  ILE  31          3HG2      ILE  31  -8.313  -3.188   2.117
  242   HD11  ILE  31          3HD1      ILE  31  -7.579  -1.650   4.310
  243   HD12  ILE  31          1HD1      ILE  31  -7.891   0.049   4.710
  244   HD13  ILE  31          2HD1      ILE  31  -9.048  -1.198   5.213
  245    H    HIS  32           H        HIS  32  -9.831   0.240   0.003
  246    HA   HIS  32           HA       HIS  32 -11.647   2.326   1.027
  247    HB2  HIS  32           1HB      HIS  32  -9.055   2.388  -0.577
  248    HB3  HIS  32           2HB      HIS  32  -9.922   3.796  -0.045
  249    HD1  HIS  32           1HD      HIS  32 -10.298   3.656   2.912
  250    HD2  HIS  32           2HD      HIS  32  -7.024   1.939   0.921
  251    HE1  HIS  32           1HE      HIS  32  -8.431   3.533   4.632
  252    H    THR  33           H        THR  33 -10.950   0.584  -2.005
  253    HA   THR  33           HA       THR  33 -12.189   2.463  -3.795
  254    HB   THR  33           HB       THR  33 -12.329   0.523  -5.370
  255    HG1  THR  33           1HG      THR  33 -11.557  -1.424  -4.738
  256   HG21  THR  33          3HG2      THR  33  -9.911   0.114  -5.594
  257   HG22  THR  33          1HG2      THR  33  -9.628   0.851  -4.009
  258   HG23  THR  33          2HG2      THR  33 -10.268   1.835  -5.339
  259    H    ASN  34           H        ASN  34 -13.577  -0.130  -1.847
  260    HA   ASN  34           HA       ASN  34 -16.090  -0.173  -3.314
  261    HB2  ASN  34           1HB      ASN  34 -16.769  -1.884  -1.778
  262    HB3  ASN  34           2HB      ASN  34 -15.118  -2.204  -2.296
  263   HD21  ASN  34          1HD2      ASN  34 -13.412  -2.168  -0.673
  264   HD22  ASN  34          2HD2      ASN  34 -13.814  -1.843   1.009
  265    H    GLU  35           H        GLU  35 -18.178   0.314  -2.484
  266    HA   GLU  35           HA       GLU  35 -18.153   2.966  -1.232
  267    HB2  GLU  35           1HB      GLU  35 -20.341   1.436  -2.678
  268    HB3  GLU  35           2HB      GLU  35 -20.468   3.099  -2.079
  269    HG2  GLU  35           1HG      GLU  35 -18.544   3.760  -3.516
  270    HG3  GLU  35           2HG      GLU  35 -18.489   2.126  -4.181
  271    H    LYS  36           H        LYS  36 -17.519   1.737   0.840
  272    HA   LYS  36           HA       LYS  36 -19.963   1.482   2.556
  273    HB2  LYS  36           1HB      LYS  36 -17.414  -0.168   2.757
  274    HB3  LYS  36           2HB      LYS  36 -18.718  -0.145   3.948
  275    HG2  LYS  36           1HG      LYS  36 -20.317  -0.971   2.222
  276    HG3  LYS  36           2HG      LYS  36 -18.988  -1.063   1.049
  277    HD2  LYS  36           1HD      LYS  36 -17.801  -2.672   2.527
  278    HD3  LYS  36           2HD      LYS  36 -19.155  -2.603   3.676
  279    HE2  LYS  36           1HE      LYS  36 -20.694  -3.411   1.896
  280    HE3  LYS  36           2HE      LYS  36 -19.340  -3.487   0.759
  281    HZ1  LYS  36           3HZ      LYS  36 -18.307  -5.157   2.207
  282    HZ2  LYS  36           1HZ      LYS  36 -19.788  -5.660   1.745
  283    HZ3  LYS  36           2HZ      LYS  36 -19.561  -5.088   3.256
  Start of MODEL   14
    1    H1   GLY   1           1H       GLY   1  16.335  10.589  18.382
    2    H2   GLY   1           2H       GLY   1  17.790   9.994  17.923
    3    H3   GLY   1           3H       GLY   1  17.042   9.393  19.252
    4    HA2  GLY   1           1HA      GLY   1  16.834   7.846  17.422
    5    HA3  GLY   1           2HA      GLY   1  15.259   8.479  17.933
    6    H    SER   2           H        SER   2  15.789   7.363  15.374
    7    HA   SER   2           HA       SER   2  16.299   9.315  13.353
    8    HB2  SER   2           1HB      SER   2  14.746   6.709  13.145
    9    HB3  SER   2           2HB      SER   2  15.442   7.633  11.800
   10    HG   SER   2           HG       SER   2  16.812   5.911  12.477
   11    H    SER   3           H        SER   3  14.941  10.389  11.898
   12    HA   SER   3           HA       SER   3  12.404  11.336  12.956
   13    HB2  SER   3           1HB      SER   3  12.452  12.793  10.946
   14    HB3  SER   3           2HB      SER   3  13.927  12.882  11.923
   15    HG   SER   3           HG       SER   3  14.375  12.696   9.667
   16    H    GLY   4           H        GLY   4  13.196   8.717  10.889
   17    HA2  GLY   4           1HA      GLY   4  10.481   7.878  10.543
   18    HA3  GLY   4           2HA      GLY   4  11.084   8.586   9.041
   19    H    SER   5           H        SER   5  10.478   6.203   8.522
   20    HA   SER   5           HA       SER   5  12.418   4.141   9.199
   21    HB2  SER   5           1HB      SER   5  11.120   2.788   7.553
   22    HB3  SER   5           2HB      SER   5  10.157   3.476   8.869
   23    HG   SER   5           HG       SER   5   9.130   3.753   6.847
   24    H    SER   6           H        SER   6  13.687   2.958   7.664
   25    HA   SER   6           HA       SER   6  15.106   4.720   5.759
   26    HB2  SER   6           1HB      SER   6  16.308   3.395   7.511
   27    HB3  SER   6           2HB      SER   6  15.838   1.916   6.647
   28    HG   SER   6           HG       SER   6  17.928   2.724   6.036
   29    H    GLY   7           H        GLY   7  15.686   4.033   3.641
   30    HA2  GLY   7           1HA      GLY   7  15.346   3.140   1.538
   31    HA3  GLY   7           2HA      GLY   7  14.398   1.840   2.250
   32    H    LYS   8           H        LYS   8  13.490   2.523  -0.052
   33    HA   LYS   8           HA       LYS   8  11.537   4.720   0.010
   34    HB2  LYS   8           1HB      LYS   8  12.902   4.132  -1.991
   35    HB3  LYS   8           2HB      LYS   8  12.038   2.607  -2.142
   36    HG2  LYS   8           1HG      LYS   8  10.534   5.248  -2.110
   37    HG3  LYS   8           2HG      LYS   8  11.387   4.728  -3.562
   38    HD2  LYS   8           1HD      LYS   8  10.092   2.620  -3.615
   39    HD3  LYS   8           2HD      LYS   8   9.146   3.142  -2.226
   40    HE2  LYS   8           1HE      LYS   8   9.303   4.573  -4.917
   41    HE3  LYS   8           2HE      LYS   8   7.998   3.509  -4.389
   42    HZ1  LYS   8           3HZ      LYS   8   7.351   5.767  -4.001
   43    HZ2  LYS   8           1HZ      LYS   8   8.700   6.109  -3.152
   44    HZ3  LYS   8           2HZ      LYS   8   7.589   5.077  -2.534
   45    H    ILE   9           H        ILE   9   9.462   4.634   0.360
   46    HA   ILE   9           HA       ILE   9   8.047   2.044   0.745
   47    HB   ILE   9           HB       ILE   9   6.816   3.248   2.623
   48   HG12  ILE   9          1HG1      ILE   9   8.127   4.939   3.882
   49   HG13  ILE   9          2HG1      ILE   9   9.242   5.117   2.558
   50   HG21  ILE   9          1HG2      ILE   9   8.481   2.601   4.268
   51   HG22  ILE   9          2HG2      ILE   9   8.461   1.432   2.942
   52   HG23  ILE   9          3HG2      ILE   9   9.766   2.635   3.045
   53   HD11  ILE   9          3HD1      ILE   9   7.472   6.906   2.746
   54   HD12  ILE   9          1HD1      ILE   9   7.524   6.125   1.163
   55   HD13  ILE   9          2HD1      ILE   9   6.250   5.686   2.331
   56    H    PHE  10           H        PHE  10   5.688   2.323   0.811
   57    HA   PHE  10           HA       PHE  10   4.680   4.282  -1.233
   58    HB2  PHE  10           1HB      PHE  10   4.057   1.322  -0.856
   59    HB3  PHE  10           2HB      PHE  10   3.148   2.399  -1.896
   60    HD1  PHE  10           2HD      PHE  10   6.466   0.770  -1.438
   61    HD2  PHE  10           1HD      PHE  10   3.922   3.060  -4.064
   62    HE1  PHE  10           2HE      PHE  10   7.986   0.276  -3.343
   63    HE2  PHE  10           1HE      PHE  10   5.428   2.546  -5.968
   64    HZ   PHE  10           HZ       PHE  10   7.426   1.120  -5.626
   65    H    THR  11           H        THR  11   3.061   5.553  -0.469
   66    HA   THR  11           HA       THR  11   1.818   4.854   2.154
   67    HB   THR  11           HB       THR  11   1.898   7.605   0.905
   68    HG1  THR  11           1HG      THR  11   3.752   7.969   2.086
   69   HG21  THR  11          3HG2      THR  11   1.629   6.545   3.759
   70   HG22  THR  11          1HG2      THR  11   0.389   7.394   2.800
   71   HG23  THR  11          2HG2      THR  11   1.829   8.261   3.341
   72    H    CYS  12           H        CYS  12  -0.289   4.630   2.424
   73    HA   CYS  12           HA       CYS  12  -2.212   4.693   0.281
   74    HB2  CYS  12           1HB      CYS  12  -2.262   3.166   2.219
   75    HB3  CYS  12           2HB      CYS  12  -2.481   4.553   3.305
   76    H    GLU  13           H        GLU  13  -3.240   6.372  -0.551
   77    HA   GLU  13           HA       GLU  13  -3.032   9.025   0.620
   78    HB2  GLU  13           1HB      GLU  13  -4.217   9.794  -1.331
   79    HB3  GLU  13           2HB      GLU  13  -2.962   8.650  -1.808
   80    HG2  GLU  13           1HG      GLU  13  -4.690   6.865  -2.033
   81    HG3  GLU  13           2HG      GLU  13  -5.939   8.034  -1.585
   82    H    TYR  14           H        TYR  14  -5.090   6.479   1.335
   83    HA   TYR  14           HA       TYR  14  -7.464   8.169   1.947
   84    HB2  TYR  14           1HB      TYR  14  -7.090   5.174   1.844
   85    HB3  TYR  14           2HB      TYR  14  -8.605   6.004   2.137
   86    HD1  TYR  14           1HD      TYR  14  -9.659   7.387   0.315
   87    HD2  TYR  14           2HD      TYR  14  -6.248   4.838  -0.417
   88    HE1  TYR  14           1HE      TYR  14 -10.151   7.426  -2.124
   89    HE2  TYR  14           2HE      TYR  14  -6.748   4.887  -2.857
   90    HH   TYR  14           HH       TYR  14  -9.524   6.702  -4.205
   91    H    CYS  15           H        CYS  15  -5.110   6.036   3.577
   92    HA   CYS  15           HA       CYS  15  -6.087   7.069   6.190
   93    HB2  CYS  15           1HB      CYS  15  -5.992   4.939   7.232
   94    HB3  CYS  15           2HB      CYS  15  -7.106   4.902   5.869
   95    H    ASN  16           H        ASN  16  -3.457   7.021   4.253
   96    HA   ASN  16           HA       ASN  16  -1.274   7.441   4.479
   97    HB2  ASN  16           1HB      ASN  16  -2.049   8.537   7.191
   98    HB3  ASN  16           2HB      ASN  16  -0.526   8.828   6.363
   99   HD21  ASN  16          1HD2      ASN  16  -3.964   9.612   6.367
  100   HD22  ASN  16          2HD2      ASN  16  -3.824  10.879   5.157
  101    H    LYS  17           H        LYS  17  -2.175   4.732   5.362
  102    HA   LYS  17           HA       LYS  17  -0.025   3.764   7.093
  103    HB2  LYS  17           1HB      LYS  17  -2.238   2.636   6.907
  104    HB3  LYS  17           2HB      LYS  17  -1.901   2.257   5.214
  105    HG2  LYS  17           1HG      LYS  17  -0.027   0.830   5.846
  106    HG3  LYS  17           2HG      LYS  17  -0.149   1.346   7.540
  107    HD2  LYS  17           1HD      LYS  17  -2.324   0.251   7.776
  108    HD3  LYS  17           2HD      LYS  17  -2.380  -0.092   6.046
  109    HE2  LYS  17           1HE      LYS  17  -1.779  -2.128   7.148
  110    HE3  LYS  17           2HE      LYS  17  -0.363  -1.548   6.267
  111    HZ1  LYS  17           3HZ      LYS  17   0.191  -2.296   8.522
  112    HZ2  LYS  17           1HZ      LYS  17  -0.812  -1.197   9.189
  113    HZ3  LYS  17           2HZ      LYS  17   0.523  -0.708   8.377
  114    H    VAL  18           H        VAL  18   1.863   2.793   6.462
  115    HA   VAL  18           HA       VAL  18   2.701   3.161   3.629
  116    HB   VAL  18           HB       VAL  18   5.073   3.121   4.700
  117   HG11  VAL  18          1HG1      VAL  18   5.061   5.547   4.812
  118   HG12  VAL  18          2HG1      VAL  18   4.094   4.977   3.445
  119   HG13  VAL  18          3HG1      VAL  18   3.289   5.559   4.924
  120   HG21  VAL  18          3HG2      VAL  18   4.271   2.707   7.057
  121   HG22  VAL  18          1HG2      VAL  18   5.259   4.170   6.865
  122   HG23  VAL  18          2HG2      VAL  18   3.499   4.318   7.010
  123    H    PHE  19           H        PHE  19   3.791   1.711   2.534
  124    HA   PHE  19           HA       PHE  19   4.176  -1.037   3.646
  125    HB2  PHE  19           1HB      PHE  19   3.100  -0.286   0.906
  126    HB3  PHE  19           2HB      PHE  19   3.362  -1.907   1.521
  127    HD1  PHE  19           2HD      PHE  19   1.241   1.137   1.880
  128    HD2  PHE  19           1HD      PHE  19   1.757  -3.010   2.932
  129    HE1  PHE  19           2HE      PHE  19  -1.015   1.123   2.929
  130    HE2  PHE  19           1HE      PHE  19  -0.519  -3.040   3.926
  131    HZ   PHE  19           HZ       PHE  19  -1.887  -0.967   3.949
  132    H    LYS  20           H        LYS  20   5.637  -2.370   2.407
  133    HA   LYS  20           HA       LYS  20   8.099  -0.926   1.757
  134    HB2  LYS  20           1HB      LYS  20   7.473  -3.886   1.965
  135    HB3  LYS  20           2HB      LYS  20   9.084  -3.177   1.735
  136    HG2  LYS  20           1HG      LYS  20   8.756  -1.846   3.855
  137    HG3  LYS  20           2HG      LYS  20   7.201  -2.656   4.086
  138    HD2  LYS  20           1HD      LYS  20   8.829  -3.721   5.471
  139    HD3  LYS  20           2HD      LYS  20   8.360  -4.844   4.180
  140    HE2  LYS  20           1HE      LYS  20  10.441  -4.296   2.944
  141    HE3  LYS  20           2HE      LYS  20  10.885  -3.122   4.189
  142    HZ1  LYS  20           3HZ      LYS  20  11.008  -4.963   5.784
  143    HZ2  LYS  20           1HZ      LYS  20  12.009  -5.249   4.529
  144    HZ3  LYS  20           2HZ      LYS  20  10.592  -6.048   4.634
  145    H    PHE  21           H        PHE  21   5.633  -2.523  -0.115
  146    HA   PHE  21           HA       PHE  21   7.190  -2.161  -2.630
  147    HB2  PHE  21           1HB      PHE  21   5.454  -4.561  -1.957
  148    HB3  PHE  21           2HB      PHE  21   6.432  -4.322  -3.392
  149    HD1  PHE  21           2HD      PHE  21   9.030  -4.093  -3.046
  150    HD2  PHE  21           1HD      PHE  21   6.334  -5.730  -0.103
  151    HE1  PHE  21           2HE      PHE  21  10.939  -5.213  -1.917
  152    HE2  PHE  21           1HE      PHE  21   8.247  -6.847   1.025
  153    HZ   PHE  21           HZ       PHE  21  10.552  -6.587   0.121
  154    H    LYS  22           H        LYS  22   5.936  -1.914  -4.530
  155    HA   LYS  22           HA       LYS  22   3.690  -0.214  -4.289
  156    HB2  LYS  22           1HB      LYS  22   5.290  -0.366  -6.236
  157    HB3  LYS  22           2HB      LYS  22   4.516  -1.877  -6.718
  158    HG2  LYS  22           1HG      LYS  22   2.348  -0.680  -6.901
  159    HG3  LYS  22           2HG      LYS  22   3.145   0.842  -6.458
  160    HD2  LYS  22           1HD      LYS  22   4.622   0.636  -8.459
  161    HD3  LYS  22           2HD      LYS  22   3.778  -0.860  -8.916
  162    HE2  LYS  22           1HE      LYS  22   1.637   0.406  -9.059
  163    HE3  LYS  22           2HE      LYS  22   2.489   1.892  -8.612
  164    HZ1  LYS  22           3HZ      LYS  22   3.025   0.294 -11.063
  165    HZ2  LYS  22           1HZ      LYS  22   3.811   1.667 -10.650
  166    HZ3  LYS  22           2HZ      LYS  22   2.224   1.714 -11.021
  167    H    HIS  23           H        HIS  23   3.739  -3.664  -5.234
  168    HA   HIS  23           HA       HIS  23   0.935  -3.908  -5.608
  169    HB2  HIS  23           1HB      HIS  23   1.376  -6.348  -5.540
  170    HB3  HIS  23           2HB      HIS  23   2.453  -5.464  -6.610
  171    HD1  HIS  23           1HD      HIS  23   5.018  -5.871  -6.224
  172    HD2  HIS  23           2HD      HIS  23   2.531  -7.134  -3.069
  173    HE1  HIS  23           1HE      HIS  23   6.520  -7.104  -4.576
  174    H    SER  24           H        SER  24   2.776  -3.915  -2.666
  175    HA   SER  24           HA       SER  24   0.832  -5.278  -0.976
  176    HB2  SER  24           1HB      SER  24   3.050  -3.313  -0.293
  177    HB3  SER  24           2HB      SER  24   2.084  -4.210   0.872
  178    HG   SER  24           HG       SER  24   2.935  -6.146   0.024
  179    H    LEU  25           H        LEU  25   1.579  -1.823  -1.631
  180    HA   LEU  25           HA       LEU  25  -0.615  -0.778  -0.086
  181    HB2  LEU  25           1HB      LEU  25   1.251   0.659  -0.663
  182    HB3  LEU  25           2HB      LEU  25   1.047   0.330  -2.386
  183    HG   LEU  25           HG       LEU  25  -1.139   1.500  -2.382
  184   HD11  LEU  25          1HD1      LEU  25  -1.881   2.786  -0.483
  185   HD12  LEU  25          2HD1      LEU  25  -0.494   2.259   0.498
  186   HD13  LEU  25          3HD1      LEU  25  -1.764   1.112   0.019
  187   HD21  LEU  25          3HD2      LEU  25  -0.300   3.755  -2.130
  188   HD22  LEU  25          1HD2      LEU  25   0.930   2.727  -2.888
  189   HD23  LEU  25          2HD2      LEU  25   1.071   3.169  -1.168
  190    H    GLN  26           H        GLN  26  -0.222  -1.649  -3.521
  191    HA   GLN  26           HA       GLN  26  -2.705  -0.555  -4.424
  192    HB2  GLN  26           1HB      GLN  26  -0.890  -2.698  -5.551
  193    HB3  GLN  26           2HB      GLN  26  -2.354  -2.208  -6.385
  194    HG2  GLN  26           1HG      GLN  26  -0.155  -0.251  -5.576
  195    HG3  GLN  26           2HG      GLN  26  -0.237  -1.037  -7.148
  196   HE21  GLN  26          1HE2      GLN  26  -0.355   1.872  -6.552
  197   HE22  GLN  26          2HE2      GLN  26  -1.895   2.389  -7.224
  198    H    ALA  27           H        ALA  27  -2.018  -3.757  -3.104
  199    HA   ALA  27           HA       ALA  27  -4.710  -4.815  -3.446
  200    HB1  ALA  27           1HB      ALA  27  -2.421  -5.520  -1.568
  201    HB2  ALA  27           2HB      ALA  27  -3.863  -6.523  -1.862
  202    HB3  ALA  27           3HB      ALA  27  -2.701  -6.223  -3.183
  203    H    HIS  28           H        HIS  28  -3.026  -3.047  -0.791
  204    HA   HIS  28           HA       HIS  28  -5.154  -3.253   1.128
  205    HB2  HIS  28           1HB      HIS  28  -3.003  -2.667   1.905
  206    HB3  HIS  28           2HB      HIS  28  -2.812  -1.367   0.742
  207    HD1  HIS  28           1HD      HIS  28  -4.734  -2.096   4.003
  208    HD2  HIS  28           2HD      HIS  28  -3.750   1.016   1.353
  209    HE1  HIS  28           1HE      HIS  28  -5.439   0.048   5.163
  210    H    LEU  29           H        LEU  29  -4.675  -1.008  -1.614
  211    HA   LEU  29           HA       LEU  29  -6.681   0.884  -0.994
  212    HB2  LEU  29           1HB      LEU  29  -6.094  -0.207  -3.767
  213    HB3  LEU  29           2HB      LEU  29  -6.835   1.339  -3.368
  214    HG   LEU  29           HG       LEU  29  -3.977   0.496  -2.873
  215   HD11  LEU  29          1HD1      LEU  29  -4.559   1.079  -5.168
  216   HD12  LEU  29          2HD1      LEU  29  -3.430   2.247  -4.454
  217   HD13  LEU  29          3HD1      LEU  29  -5.154   2.670  -4.616
  218   HD21  LEU  29          3HD2      LEU  29  -4.579   1.935  -0.991
  219   HD22  LEU  29          1HD2      LEU  29  -5.418   3.067  -2.071
  220   HD23  LEU  29          2HD2      LEU  29  -3.649   2.909  -2.132
  221    H    ARG  30           H        ARG  30  -7.140  -2.430  -2.020
  222    HA   ARG  30           HA       ARG  30  -9.746  -2.243  -3.130
  223    HB2  ARG  30           1HB      ARG  30  -8.491  -4.607  -1.732
  224    HB3  ARG  30           2HB      ARG  30  -9.919  -4.614  -2.781
  225    HG2  ARG  30           1HG      ARG  30  -8.553  -3.756  -4.683
  226    HG3  ARG  30           2HG      ARG  30  -7.120  -3.764  -3.660
  227    HD2  ARG  30           1HD      ARG  30  -7.056  -5.749  -4.963
  228    HD3  ARG  30           2HD      ARG  30  -7.395  -6.187  -3.288
  229    HE   ARG  30           HE       ARG  30  -9.485  -6.996  -3.896
  230   HH11  ARG  30          2HH1      ARG  30  -8.240  -5.257  -6.678
  231   HH12  ARG  30          1HH1      ARG  30  -9.511  -5.839  -7.717
  232   HH21  ARG  30          2HH2      ARG  30 -11.073  -7.687  -5.276
  233   HH22  ARG  30          1HH2      ARG  30 -11.067  -7.178  -6.938
  234    H    ILE  31           H        ILE  31  -8.876  -1.922   0.206
  235    HA   ILE  31           HA       ILE  31 -11.611  -2.449   1.178
  236    HB   ILE  31           HB       ILE  31 -10.890  -2.044   3.312
  237   HG12  ILE  31          1HG1      ILE  31  -8.485  -0.528   2.261
  238   HG13  ILE  31          2HG1      ILE  31  -9.851   0.106   3.167
  239   HG21  ILE  31          1HG2      ILE  31  -9.071  -3.576   3.636
  240   HG22  ILE  31          2HG2      ILE  31  -9.939  -4.097   2.193
  241   HG23  ILE  31          3HG2      ILE  31  -8.393  -3.233   2.034
  242   HD11  ILE  31          3HD1      ILE  31  -9.171  -1.285   5.133
  243   HD12  ILE  31          1HD1      ILE  31  -7.692  -1.734   4.243
  244   HD13  ILE  31          2HD1      ILE  31  -8.000  -0.040   4.658
  245    H    HIS  32           H        HIS  32  -9.766   0.272   0.025
  246    HA   HIS  32           HA       HIS  32 -11.608   2.326   1.034
  247    HB2  HIS  32           1HB      HIS  32  -9.028   2.415  -0.582
  248    HB3  HIS  32           2HB      HIS  32  -9.903   3.817  -0.031
  249    HD1  HIS  32           1HD      HIS  32 -10.266   3.672   2.913
  250    HD2  HIS  32           2HD      HIS  32  -7.002   1.930   0.928
  251    HE1  HIS  32           1HE      HIS  32  -8.404   3.532   4.637
  252    H    THR  33           H        THR  33 -10.996   0.590  -1.999
  253    HA   THR  33           HA       THR  33 -12.414   2.410  -3.742
  254    HB   THR  33           HB       THR  33 -12.535   0.459  -5.289
  255    HG1  THR  33           1HG      THR  33 -11.659  -1.453  -4.686
  256   HG21  THR  33          3HG2      THR  33 -10.126   0.158  -5.648
  257   HG22  THR  33          1HG2      THR  33  -9.778   0.872  -4.065
  258   HG23  THR  33          2HG2      THR  33 -10.521   1.861  -5.336
  259    H    ASN  34           H        ASN  34 -13.604   0.191  -1.379
  260    HA   ASN  34           HA       ASN  34 -16.053  -0.593  -2.607
  261    HB2  ASN  34           1HB      ASN  34 -15.003  -1.753  -0.688
  262    HB3  ASN  34           2HB      ASN  34 -15.300  -0.345   0.339
  263   HD21  ASN  34          1HD2      ASN  34 -16.939  -2.901  -1.576
  264   HD22  ASN  34          2HD2      ASN  34 -18.426  -2.826  -0.642
  265    H    GLU  35           H        GLU  35 -18.071   0.262  -2.675
  266    HA   GLU  35           HA       GLU  35 -18.804   2.693  -1.175
  267    HB2  GLU  35           1HB      GLU  35 -17.687   3.481  -3.264
  268    HB3  GLU  35           2HB      GLU  35 -18.859   2.571  -4.223
  269    HG2  GLU  35           1HG      GLU  35 -20.692   3.965  -3.344
  270    HG3  GLU  35           2HG      GLU  35 -19.570   4.796  -2.262
  271    H    LYS  36           H        LYS  36 -21.003   2.893  -0.860
  272    HA   LYS  36           HA       LYS  36 -22.902   0.989  -2.118
  273    HB2  LYS  36           1HB      LYS  36 -22.594   1.498   0.868
  274    HB3  LYS  36           2HB      LYS  36 -23.958   0.655   0.160
  275    HG2  LYS  36           1HG      LYS  36 -21.110  -0.392  -0.160
  276    HG3  LYS  36           2HG      LYS  36 -22.068  -0.690   1.275
  277    HD2  LYS  36           1HD      LYS  36 -22.236  -2.597  -0.130
  278    HD3  LYS  36           2HD      LYS  36 -23.816  -1.812  -0.051
  279    HE2  LYS  36           1HE      LYS  36 -23.486  -0.847  -2.283
  280    HE3  LYS  36           2HE      LYS  36 -21.833  -1.475  -2.345
  281    HZ1  LYS  36           3HZ      LYS  36 -22.767  -3.727  -2.286
  282    HZ2  LYS  36           1HZ      LYS  36 -23.379  -2.903  -3.554
  283    HZ3  LYS  36           2HZ      LYS  36 -24.292  -3.140  -2.223
  Start of MODEL   15
    1    H1   GLY   1           1H       GLY   1  27.112  -0.411  -4.147
    2    H2   GLY   1           2H       GLY   1  26.431  -1.502  -3.131
    3    H3   GLY   1           3H       GLY   1  25.596  -0.166  -3.581
    4    HA2  GLY   1           1HA      GLY   1  26.411  -2.367  -5.368
    5    HA3  GLY   1           2HA      GLY   1  24.767  -2.083  -4.768
    6    H    SER   2           H        SER   2  23.921  -1.854  -6.877
    7    HA   SER   2           HA       SER   2  24.907   0.154  -8.742
    8    HB2  SER   2           1HB      SER   2  22.885  -0.481 -10.043
    9    HB3  SER   2           2HB      SER   2  23.931  -1.845  -9.620
   10    HG   SER   2           HG       SER   2  21.703  -2.301  -9.252
   11    H    SER   3           H        SER   3  23.625   1.929  -9.576
   12    HA   SER   3           HA       SER   3  22.722   3.703  -7.537
   13    HB2  SER   3           1HB      SER   3  22.349   3.909 -10.547
   14    HB3  SER   3           2HB      SER   3  22.190   5.230  -9.374
   15    HG   SER   3           HG       SER   3  24.270   5.186 -10.367
   16    H    GLY   4           H        GLY   4  20.749   4.313  -6.811
   17    HA2  GLY   4           1HA      GLY   4  18.246   4.227  -8.003
   18    HA3  GLY   4           2HA      GLY   4  18.436   2.631  -7.273
   19    H    SER   5           H        SER   5  16.406   3.777  -6.261
   20    HA   SER   5           HA       SER   5  16.786   5.627  -4.091
   21    HB2  SER   5           1HB      SER   5  14.525   3.644  -4.545
   22    HB3  SER   5           2HB      SER   5  14.479   5.072  -3.499
   23    HG   SER   5           HG       SER   5  14.731   6.380  -5.350
   24    H    SER   6           H        SER   6  16.579   5.282  -1.843
   25    HA   SER   6           HA       SER   6  16.899   2.540  -0.756
   26    HB2  SER   6           1HB      SER   6  19.180   3.533  -1.021
   27    HB3  SER   6           2HB      SER   6  18.693   4.856   0.058
   28    HG   SER   6           HG       SER   6  19.761   3.119   1.163
   29    H    GLY   7           H        GLY   7  16.178   2.318   1.412
   30    HA2  GLY   7           1HA      GLY   7  14.662   2.661   3.120
   31    HA3  GLY   7           2HA      GLY   7  14.963   4.404   2.966
   32    H    LYS   8           H        LYS   8  13.744   2.590   0.250
   33    HA   LYS   8           HA       LYS   8  11.628   4.493  -0.032
   34    HB2  LYS   8           1HB      LYS   8  11.277   3.579  -2.186
   35    HB3  LYS   8           2HB      LYS   8  13.001   3.595  -1.843
   36    HG2  LYS   8           1HG      LYS   8  12.859   1.536  -2.793
   37    HG3  LYS   8           2HG      LYS   8  12.589   1.063  -1.115
   38    HD2  LYS   8           1HD      LYS   8  10.072   1.204  -1.608
   39    HD3  LYS   8           2HD      LYS   8  10.482   1.462  -3.299
   40    HE2  LYS   8           1HE      LYS   8  11.295  -0.960  -1.622
   41    HE3  LYS   8           2HE      LYS   8   9.907  -0.912  -2.702
   42    HZ1  LYS   8           3HZ      LYS   8  11.802  -1.919  -3.807
   43    HZ2  LYS   8           1HZ      LYS   8  12.738  -0.611  -3.562
   44    HZ3  LYS   8           2HZ      LYS   8  11.449  -0.518  -4.565
   45    H    ILE   9           H        ILE   9   9.540   4.366  -0.037
   46    HA   ILE   9           HA       ILE   9   8.006   2.032   0.930
   47    HB   ILE   9           HB       ILE   9   6.815   3.530   2.588
   48   HG12  ILE   9          1HG1      ILE   9   9.353   5.209   2.583
   49   HG13  ILE   9          2HG1      ILE   9   7.933   5.675   1.646
   50   HG21  ILE   9          1HG2      ILE   9   8.374   1.689   3.208
   51   HG22  ILE   9          2HG2      ILE   9   9.701   2.869   3.283
   52   HG23  ILE   9          3HG2      ILE   9   8.325   2.996   4.393
   53   HD11  ILE   9          3HD1      ILE   9   7.973   6.812   3.810
   54   HD12  ILE   9          1HD1      ILE   9   6.555   5.766   3.637
   55   HD13  ILE   9          2HD1      ILE   9   7.925   5.254   4.657
   56    H    PHE  10           H        PHE  10   5.737   2.294   0.761
   57    HA   PHE  10           HA       PHE  10   4.749   4.326  -1.211
   58    HB2  PHE  10           1HB      PHE  10   4.056   1.374  -0.905
   59    HB3  PHE  10           2HB      PHE  10   3.161   2.504  -1.902
   60    HD1  PHE  10           2HD      PHE  10   6.432   0.766  -1.540
   61    HD2  PHE  10           1HD      PHE  10   3.927   3.211  -4.060
   62    HE1  PHE  10           2HE      PHE  10   7.928   0.313  -3.475
   63    HE2  PHE  10           1HE      PHE  10   5.418   2.750  -5.990
   64    HZ   PHE  10           HZ       PHE  10   7.396   1.280  -5.711
   65    H    THR  11           H        THR  11   3.030   5.524  -0.491
   66    HA   THR  11           HA       THR  11   1.828   4.805   2.159
   67    HB   THR  11           HB       THR  11   2.036   7.577   0.957
   68    HG1  THR  11           1HG      THR  11   3.832   7.862   2.230
   69   HG21  THR  11          3HG2      THR  11   1.878   8.184   3.422
   70   HG22  THR  11          1HG2      THR  11   1.509   6.478   3.757
   71   HG23  THR  11          2HG2      THR  11   0.418   7.460   2.737
   72    H    CYS  12           H        CYS  12  -0.301   4.658   2.418
   73    HA   CYS  12           HA       CYS  12  -2.195   4.748   0.272
   74    HB2  CYS  12           1HB      CYS  12  -2.292   3.304   2.270
   75    HB3  CYS  12           2HB      CYS  12  -2.484   4.738   3.294
   76    H    GLU  13           H        GLU  13  -3.334   6.378  -0.551
   77    HA   GLU  13           HA       GLU  13  -3.021   9.078   0.549
   78    HB2  GLU  13           1HB      GLU  13  -4.198   9.840  -1.409
   79    HB3  GLU  13           2HB      GLU  13  -2.945   8.691  -1.874
   80    HG2  GLU  13           1HG      GLU  13  -4.680   6.912  -2.098
   81    HG3  GLU  13           2HG      GLU  13  -5.926   8.090  -1.664
   82    H    TYR  14           H        TYR  14  -5.111   6.527   1.230
   83    HA   TYR  14           HA       TYR  14  -7.473   8.232   1.833
   84    HB2  TYR  14           1HB      TYR  14  -7.139   5.229   1.714
   85    HB3  TYR  14           2HB      TYR  14  -8.638   6.080   2.004
   86    HD1  TYR  14           1HD      TYR  14  -9.646   7.503   0.173
   87    HD2  TYR  14           2HD      TYR  14  -6.281   4.885  -0.533
   88    HE1  TYR  14           1HE      TYR  14 -10.108   7.563  -2.272
   89    HE2  TYR  14           2HE      TYR  14  -6.754   4.951  -2.976
   90    HH   TYR  14           HH       TYR  14  -9.473   6.833  -4.350
   91    H    CYS  15           H        CYS  15  -5.151   6.089   3.489
   92    HA   CYS  15           HA       CYS  15  -6.106   7.189   6.085
   93    HB2  CYS  15           1HB      CYS  15  -6.076   5.076   7.174
   94    HB3  CYS  15           2HB      CYS  15  -7.177   5.027   5.803
   95    H    ASN  16           H        ASN  16  -3.489   6.973   4.131
   96    HA   ASN  16           HA       ASN  16  -1.282   7.225   4.317
   97    HB2  ASN  16           1HB      ASN  16  -1.784   8.541   6.973
   98    HB3  ASN  16           2HB      ASN  16  -0.453   8.823   5.850
   99   HD21  ASN  16          1HD2      ASN  16  -1.937   9.027   3.362
  100   HD22  ASN  16          2HD2      ASN  16  -2.849  10.520   3.516
  101    H    LYS  17           H        LYS  17  -2.239   4.665   5.270
  102    HA   LYS  17           HA       LYS  17  -0.149   3.695   7.078
  103    HB2  LYS  17           1HB      LYS  17  -2.387   2.601   6.865
  104    HB3  LYS  17           2HB      LYS  17  -2.002   2.156   5.199
  105    HG2  LYS  17           1HG      LYS  17  -0.175   0.729   5.935
  106    HG3  LYS  17           2HG      LYS  17  -0.310   1.326   7.599
  107    HD2  LYS  17           1HD      LYS  17  -2.521   0.302   7.836
  108    HD3  LYS  17           2HD      LYS  17  -2.488  -0.238   6.145
  109    HE2  LYS  17           1HE      LYS  17  -0.486  -1.620   6.608
  110    HE3  LYS  17           2HE      LYS  17  -0.459  -1.045   8.280
  111    HZ1  LYS  17           3HZ      LYS  17  -2.623  -2.110   8.621
  112    HZ2  LYS  17           1HZ      LYS  17  -1.531  -3.212   8.120
  113    HZ3  LYS  17           2HZ      LYS  17  -2.653  -2.650   7.077
  114    H    VAL  18           H        VAL  18   1.695   2.584   6.463
  115    HA   VAL  18           HA       VAL  18   2.628   3.072   3.677
  116    HB   VAL  18           HB       VAL  18   4.961   3.075   4.844
  117   HG11  VAL  18          1HG1      VAL  18   4.053   4.912   3.582
  118   HG12  VAL  18          2HG1      VAL  18   3.034   5.407   4.963
  119   HG13  VAL  18          3HG1      VAL  18   4.797   5.526   5.069
  120   HG21  VAL  18          3HG2      VAL  18   4.056   2.611   7.166
  121   HG22  VAL  18          1HG2      VAL  18   5.027   4.090   7.022
  122   HG23  VAL  18          2HG2      VAL  18   3.261   4.213   7.091
  123    H    PHE  19           H        PHE  19   3.792   1.705   2.587
  124    HA   PHE  19           HA       PHE  19   4.147  -1.089   3.577
  125    HB2  PHE  19           1HB      PHE  19   3.072  -0.221   0.864
  126    HB3  PHE  19           2HB      PHE  19   3.315  -1.869   1.435
  127    HD1  PHE  19           2HD      PHE  19   1.231   1.186   1.798
  128    HD2  PHE  19           1HD      PHE  19   1.714  -2.948   2.914
  129    HE1  PHE  19           2HE      PHE  19  -1.011   1.218   2.882
  130    HE2  PHE  19           1HE      PHE  19  -0.545  -2.930   3.952
  131    HZ   PHE  19           HZ       PHE  19  -1.886  -0.839   3.962
  132    H    LYS  20           H        LYS  20   5.625  -2.364   2.291
  133    HA   LYS  20           HA       LYS  20   8.061  -0.829   1.688
  134    HB2  LYS  20           1HB      LYS  20   7.536  -3.805   1.949
  135    HB3  LYS  20           2HB      LYS  20   9.129  -3.039   1.753
  136    HG2  LYS  20           1HG      LYS  20   8.548  -1.624   3.839
  137    HG3  LYS  20           2HG      LYS  20   7.155  -2.686   4.052
  138    HD2  LYS  20           1HD      LYS  20   8.878  -3.506   5.479
  139    HD3  LYS  20           2HD      LYS  20   8.696  -4.644   4.144
  140    HE2  LYS  20           1HE      LYS  20  11.037  -4.420   4.546
  141    HE3  LYS  20           2HE      LYS  20  10.699  -3.587   3.028
  142    HZ1  LYS  20           3HZ      LYS  20  10.756  -1.477   4.261
  143    HZ2  LYS  20           1HZ      LYS  20  12.152  -2.287   4.490
  144    HZ3  LYS  20           2HZ      LYS  20  11.030  -2.259   5.671
  145    H    PHE  21           H        PHE  21   5.666  -2.469  -0.201
  146    HA   PHE  21           HA       PHE  21   7.233  -2.068  -2.699
  147    HB2  PHE  21           1HB      PHE  21   5.644  -4.555  -1.955
  148    HB3  PHE  21           2HB      PHE  21   6.451  -4.257  -3.484
  149    HD1  PHE  21           2HD      PHE  21   9.007  -4.032  -3.527
  150    HD2  PHE  21           1HD      PHE  21   6.834  -5.512  -0.108
  151    HE1  PHE  21           2HE      PHE  21  11.099  -5.031  -2.625
  152    HE2  PHE  21           1HE      PHE  21   8.928  -6.501   0.794
  153    HZ   PHE  21           HZ       PHE  21  11.062  -6.258  -0.462
  154    H    LYS  22           H        LYS  22   5.949  -1.849  -4.604
  155    HA   LYS  22           HA       LYS  22   3.701  -0.172  -4.279
  156    HB2  LYS  22           1HB      LYS  22   5.261  -0.263  -6.261
  157    HB3  LYS  22           2HB      LYS  22   4.469  -1.755  -6.777
  158    HG2  LYS  22           1HG      LYS  22   2.304  -0.553  -6.875
  159    HG3  LYS  22           2HG      LYS  22   3.103   0.950  -6.377
  160    HD2  LYS  22           1HD      LYS  22   4.531   0.864  -8.412
  161    HD3  LYS  22           2HD      LYS  22   3.711  -0.630  -8.921
  162    HE2  LYS  22           1HE      LYS  22   1.542   0.584  -8.980
  163    HE3  LYS  22           2HE      LYS  22   2.353   2.068  -8.463
  164    HZ1  LYS  22           3HZ      LYS  22   2.066   2.013 -10.874
  165    HZ2  LYS  22           1HZ      LYS  22   2.909   0.622 -11.002
  166    HZ3  LYS  22           2HZ      LYS  22   3.658   1.994 -10.524
  167    H    HIS  23           H        HIS  23   3.733  -3.598  -5.315
  168    HA   HIS  23           HA       HIS  23   0.934  -3.858  -5.646
  169    HB2  HIS  23           1HB      HIS  23   1.392  -6.308  -5.527
  170    HB3  HIS  23           2HB      HIS  23   2.420  -5.427  -6.646
  171    HD1  HIS  23           1HD      HIS  23   4.980  -5.857  -6.378
  172    HD2  HIS  23           2HD      HIS  23   2.664  -6.958  -3.037
  173    HE1  HIS  23           1HE      HIS  23   6.567  -7.017  -4.756
  174    H    SER  24           H        SER  24   2.783  -3.848  -2.703
  175    HA   SER  24           HA       SER  24   0.824  -5.197  -1.017
  176    HB2  SER  24           1HB      SER  24   3.152  -3.355  -0.371
  177    HB3  SER  24           2HB      SER  24   2.126  -4.131   0.829
  178    HG   SER  24           HG       SER  24   3.931  -5.443   0.446
  179    H    LEU  25           H        LEU  25   1.593  -1.748  -1.691
  180    HA   LEU  25           HA       LEU  25  -0.605  -0.694  -0.140
  181    HB2  LEU  25           1HB      LEU  25   1.255   0.746  -0.724
  182    HB3  LEU  25           2HB      LEU  25   1.059   0.402  -2.443
  183    HG   LEU  25           HG       LEU  25  -1.128   1.565  -2.461
  184   HD11  LEU  25          1HD1      LEU  25  -1.886   2.870  -0.580
  185   HD12  LEU  25          2HD1      LEU  25  -0.505   2.351   0.418
  186   HD13  LEU  25          3HD1      LEU  25  -1.770   1.200  -0.063
  187   HD21  LEU  25          3HD2      LEU  25   1.074   3.248  -1.248
  188   HD22  LEU  25          1HD2      LEU  25  -0.292   3.824  -2.225
  189   HD23  LEU  25          2HD2      LEU  25   0.942   2.786  -2.964
  190    H    GLN  26           H        GLN  26  -0.218  -1.599  -3.572
  191    HA   GLN  26           HA       GLN  26  -2.729  -0.549  -4.464
  192    HB2  GLN  26           1HB      GLN  26  -0.995  -2.776  -5.580
  193    HB3  GLN  26           2HB      GLN  26  -2.435  -2.191  -6.397
  194    HG2  GLN  26           1HG      GLN  26  -0.055  -0.417  -5.691
  195    HG3  GLN  26           2HG      GLN  26  -0.302  -1.196  -7.249
  196   HE21  GLN  26          1HE2      GLN  26  -2.542  -0.628  -8.337
  197   HE22  GLN  26          2HE2      GLN  26  -3.023   1.051  -8.148
  198    H    ALA  27           H        ALA  27  -1.980  -3.729  -3.122
  199    HA   ALA  27           HA       ALA  27  -4.646  -4.838  -3.396
  200    HB1  ALA  27           1HB      ALA  27  -2.605  -6.191  -3.138
  201    HB2  ALA  27           2HB      ALA  27  -2.324  -5.467  -1.534
  202    HB3  ALA  27           3HB      ALA  27  -3.746  -6.507  -1.804
  203    H    HIS  28           H        HIS  28  -3.004  -2.944  -0.814
  204    HA   HIS  28           HA       HIS  28  -5.104  -3.180   1.137
  205    HB2  HIS  28           1HB      HIS  28  -2.959  -2.528   1.876
  206    HB3  HIS  28           2HB      HIS  28  -2.811  -1.248   0.689
  207    HD1  HIS  28           1HD      HIS  28  -4.730  -1.968   3.957
  208    HD2  HIS  28           2HD      HIS  28  -3.731   1.134   1.303
  209    HE1  HIS  28           1HE      HIS  28  -5.419   0.183   5.117
  210    H    LEU  29           H        LEU  29  -4.705  -0.976  -1.651
  211    HA   LEU  29           HA       LEU  29  -6.740   0.885  -1.042
  212    HB2  LEU  29           1HB      LEU  29  -6.169  -0.235  -3.807
  213    HB3  LEU  29           2HB      LEU  29  -6.915   1.312  -3.417
  214    HG   LEU  29           HG       LEU  29  -4.046   0.486  -2.935
  215   HD11  LEU  29          1HD1      LEU  29  -5.268   2.610  -4.713
  216   HD12  LEU  29          2HD1      LEU  29  -4.606   1.031  -5.233
  217   HD13  LEU  29          3HD1      LEU  29  -3.534   2.254  -4.528
  218   HD21  LEU  29          3HD2      LEU  29  -3.717   2.902  -2.221
  219   HD22  LEU  29          1HD2      LEU  29  -4.652   1.949  -1.068
  220   HD23  LEU  29          2HD2      LEU  29  -5.487   3.069  -2.165
  221    H    ARG  30           H        ARG  30  -7.150  -2.439  -2.011
  222    HA   ARG  30           HA       ARG  30  -9.816  -2.344  -3.023
  223    HB2  ARG  30           1HB      ARG  30  -8.428  -4.624  -1.562
  224    HB3  ARG  30           2HB      ARG  30  -9.849  -4.752  -2.602
  225    HG2  ARG  30           1HG      ARG  30  -8.561  -4.077  -4.570
  226    HG3  ARG  30           2HG      ARG  30  -7.119  -3.796  -3.587
  227    HD2  ARG  30           1HD      ARG  30  -7.111  -6.178  -2.911
  228    HD3  ARG  30           2HD      ARG  30  -8.506  -6.474  -3.971
  229    HE   ARG  30           HE       ARG  30  -6.642  -5.290  -5.640
  230   HH11  ARG  30          2HH1      ARG  30  -6.570  -8.187  -3.672
  231   HH12  ARG  30          1HH1      ARG  30  -5.395  -8.964  -4.698
  232   HH21  ARG  30          2HH2      ARG  30  -5.154  -6.342  -6.910
  233   HH22  ARG  30          1HH2      ARG  30  -4.624  -7.943  -6.485
  234    H    ILE  31           H        ILE  31  -8.818  -1.912   0.263
  235    HA   ILE  31           HA       ILE  31 -11.512  -2.490   1.328
  236    HB   ILE  31           HB       ILE  31 -10.749  -2.050   3.427
  237   HG12  ILE  31          1HG1      ILE  31  -8.380  -0.507   2.340
  238   HG13  ILE  31          2HG1      ILE  31  -9.754   0.119   3.236
  239   HG21  ILE  31          1HG2      ILE  31  -8.897  -3.547   3.736
  240   HG22  ILE  31          2HG2      ILE  31  -9.785  -4.098   2.315
  241   HG23  ILE  31          3HG2      ILE  31  -8.258  -3.209   2.115
  242   HD11  ILE  31          3HD1      ILE  31  -7.574  -1.673   4.340
  243   HD12  ILE  31          1HD1      ILE  31  -7.911   0.021   4.734
  244   HD13  ILE  31          2HD1      ILE  31  -9.062  -1.238   5.220
  245    H    HIS  32           H        HIS  32  -9.796   0.224   0.037
  246    HA   HIS  32           HA       HIS  32 -11.603   2.275   1.130
  247    HB2  HIS  32           1HB      HIS  32  -9.096   2.346  -0.600
  248    HB3  HIS  32           2HB      HIS  32  -9.975   3.763  -0.100
  249    HD1  HIS  32           1HD      HIS  32 -10.286   3.703   2.873
  250    HD2  HIS  32           2HD      HIS  32  -7.016   1.983   0.876
  251    HE1  HIS  32           1HE      HIS  32  -8.401   3.627   4.574
  252    H    THR  33           H        THR  33 -11.100   0.529  -1.913
  253    HA   THR  33           HA       THR  33 -12.504   2.283  -3.670
  254    HB   THR  33           HB       THR  33 -12.902   0.180  -5.032
  255    HG1  THR  33           1HG      THR  33 -12.840  -1.285  -3.257
  256   HG21  THR  33          3HG2      THR  33 -10.508  -0.163  -5.557
  257   HG22  THR  33          1HG2      THR  33 -10.055   0.744  -4.100
  258   HG23  THR  33          2HG2      THR  33 -10.919   1.559  -5.419
  259    H    ASN  34           H        ASN  34 -14.574   2.743  -3.975
  260    HA   ASN  34           HA       ASN  34 -16.706   1.144  -2.640
  261    HB2  ASN  34           1HB      ASN  34 -17.574   3.139  -1.610
  262    HB3  ASN  34           2HB      ASN  34 -15.887   2.956  -1.156
  263   HD21  ASN  34          1HD2      ASN  34 -16.899   5.373  -0.695
  264   HD22  ASN  34          2HD2      ASN  34 -16.350   6.526  -1.904
  265    H    GLU  35           H        GLU  35 -15.918   1.662  -5.587
  266    HA   GLU  35           HA       GLU  35 -18.118   3.165  -6.710
  267    HB2  GLU  35           1HB      GLU  35 -15.903   2.930  -7.791
  268    HB3  GLU  35           2HB      GLU  35 -16.192   1.206  -8.012
  269    HG2  GLU  35           1HG      GLU  35 -16.557   2.418 -10.086
  270    HG3  GLU  35           2HG      GLU  35 -18.055   1.685  -9.547
  271    H    LYS  36           H        LYS  36 -19.888   2.427  -7.910
  272    HA   LYS  36           HA       LYS  36 -21.152  -0.010  -6.781
  273    HB2  LYS  36           1HB      LYS  36 -22.297   2.338  -8.340
  274    HB3  LYS  36           2HB      LYS  36 -23.231   0.963  -7.736
  275    HG2  LYS  36           1HG      LYS  36 -22.550   1.512  -5.406
  276    HG3  LYS  36           2HG      LYS  36 -21.653   2.921  -6.003
  277    HD2  LYS  36           1HD      LYS  36 -23.753   3.874  -6.922
  278    HD3  LYS  36           2HD      LYS  36 -24.654   2.468  -6.311
  279    HE2  LYS  36           1HE      LYS  36 -23.938   3.021  -3.996
  280    HE3  LYS  36           2HE      LYS  36 -23.039   4.417  -4.603
  281    HZ1  LYS  36           3HZ      LYS  36 -25.984   4.063  -4.822
  282    HZ2  LYS  36           1HZ      LYS  36 -25.152   5.354  -5.383
  283    HZ3  LYS  36           2HZ      LYS  36 -25.228   5.065  -3.780
  Start of MODEL   16
    1    H1   GLY   1           1H       GLY   1  28.662  -9.727  -2.484
    2    H2   GLY   1           2H       GLY   1  27.288 -10.591  -2.279
    3    H3   GLY   1           3H       GLY   1  28.393 -10.514  -1.071
    4    HA2  GLY   1           1HA      GLY   1  26.521  -9.095  -0.560
    5    HA3  GLY   1           2HA      GLY   1  28.013  -8.161  -0.774
    6    H    SER   2           H        SER   2  25.646  -6.875  -0.986
    7    HA   SER   2           HA       SER   2  25.369  -6.220  -3.892
    8    HB2  SER   2           1HB      SER   2  23.091  -6.527  -1.899
    9    HB3  SER   2           2HB      SER   2  22.945  -5.940  -3.567
   10    HG   SER   2           HG       SER   2  22.452  -8.182  -3.379
   11    H    SER   3           H        SER   3  24.696  -4.107  -4.367
   12    HA   SER   3           HA       SER   3  24.950  -2.043  -2.218
   13    HB2  SER   3           1HB      SER   3  26.447  -2.075  -4.869
   14    HB3  SER   3           2HB      SER   3  26.441  -0.745  -3.698
   15    HG   SER   3           HG       SER   3  28.281  -2.105  -3.468
   16    H    GLY   4           H        GLY   4  24.221   0.095  -2.854
   17    HA2  GLY   4           1HA      GLY   4  22.984   1.659  -4.011
   18    HA3  GLY   4           2HA      GLY   4  22.750   0.513  -5.328
   19    H    SER   5           H        SER   5  21.692  -0.934  -2.455
   20    HA   SER   5           HA       SER   5  18.853  -0.570  -3.097
   21    HB2  SER   5           1HB      SER   5  19.848  -2.735  -2.323
   22    HB3  SER   5           2HB      SER   5  20.099  -2.000  -0.726
   23    HG   SER   5           HG       SER   5  18.102  -3.168  -0.904
   24    H    SER   6           H        SER   6  17.258   0.246  -1.615
   25    HA   SER   6           HA       SER   6  18.121   2.017   0.582
   26    HB2  SER   6           1HB      SER   6  16.988   3.981  -0.315
   27    HB3  SER   6           2HB      SER   6  18.290   3.459  -1.392
   28    HG   SER   6           HG       SER   6  16.391   3.953  -2.561
   29    H    GLY   7           H        GLY   7  16.409   2.810   1.897
   30    HA2  GLY   7           1HA      GLY   7  14.292   0.876   2.368
   31    HA3  GLY   7           2HA      GLY   7  14.662   2.313   3.324
   32    H    LYS   8           H        LYS   8  13.632   1.861  -0.096
   33    HA   LYS   8           HA       LYS   8  11.900   4.155  -0.081
   34    HB2  LYS   8           1HB      LYS   8  13.050   3.184  -2.065
   35    HB3  LYS   8           2HB      LYS   8  11.932   1.824  -2.055
   36    HG2  LYS   8           1HG      LYS   8  10.842   4.654  -2.137
   37    HG3  LYS   8           2HG      LYS   8  11.590   3.985  -3.584
   38    HD2  LYS   8           1HD      LYS   8   9.984   2.183  -3.724
   39    HD3  LYS   8           2HD      LYS   8   9.307   2.575  -2.150
   40    HE2  LYS   8           1HE      LYS   8   7.783   3.438  -3.742
   41    HE3  LYS   8           2HE      LYS   8   8.601   4.816  -3.013
   42    HZ1  LYS   8           3HZ      LYS   8   9.286   3.638  -5.660
   43    HZ2  LYS   8           1HZ      LYS   8  10.017   4.944  -4.998
   44    HZ3  LYS   8           2HZ      LYS   8   8.450   5.019  -5.436
   45    H    ILE   9           H        ILE   9   9.761   4.398   0.120
   46    HA   ILE   9           HA       ILE   9   8.041   2.104   0.929
   47    HB   ILE   9           HB       ILE   9   6.937   3.678   2.555
   48   HG12  ILE   9          1HG1      ILE   9   9.516   5.283   2.527
   49   HG13  ILE   9          2HG1      ILE   9   8.153   5.754   1.511
   50   HG21  ILE   9          1HG2      ILE   9   8.518   3.192   4.349
   51   HG22  ILE   9          2HG2      ILE   9   8.417   1.823   3.235
   52   HG23  ILE   9          3HG2      ILE   9   9.818   2.913   3.173
   53   HD11  ILE   9          3HD1      ILE   9   6.699   6.015   3.416
   54   HD12  ILE   9          1HD1      ILE   9   7.973   5.447   4.531
   55   HD13  ILE   9          2HD1      ILE   9   8.169   6.974   3.645
   56    H    PHE  10           H        PHE  10   5.818   2.450   0.786
   57    HA   PHE  10           HA       PHE  10   4.831   4.479  -1.189
   58    HB2  PHE  10           1HB      PHE  10   4.051   1.549  -0.846
   59    HB3  PHE  10           2HB      PHE  10   3.196   2.700  -1.849
   60    HD1  PHE  10           2HD      PHE  10   6.398   0.832  -1.480
   61    HD2  PHE  10           1HD      PHE  10   3.962   3.293  -4.049
   62    HE1  PHE  10           2HE      PHE  10   7.831   0.228  -3.420
   63    HE2  PHE  10           1HE      PHE  10   5.382   2.676  -5.987
   64    HZ   PHE  10           HZ       PHE  10   7.294   1.121  -5.687
   65    H    THR  11           H        THR  11   2.946   5.586  -0.506
   66    HA   THR  11           HA       THR  11   1.877   4.881   2.215
   67    HB   THR  11           HB       THR  11   1.982   7.666   1.032
   68    HG1  THR  11           1HG      THR  11   4.089   7.067   1.243
   69   HG21  THR  11          3HG2      THR  11   0.419   7.413   2.872
   70   HG22  THR  11          1HG2      THR  11   1.854   8.259   3.469
   71   HG23  THR  11          2HG2      THR  11   1.636   6.535   3.844
   72    H    CYS  12           H        CYS  12  -0.251   4.704   2.496
   73    HA   CYS  12           HA       CYS  12  -2.131   4.741   0.304
   74    HB2  CYS  12           1HB      CYS  12  -2.213   3.190   2.216
   75    HB3  CYS  12           2HB      CYS  12  -2.455   4.557   3.322
   76    H    GLU  13           H        GLU  13  -3.190   6.417  -0.513
   77    HA   GLU  13           HA       GLU  13  -3.012   9.054   0.703
   78    HB2  GLU  13           1HB      GLU  13  -4.170   9.850  -1.254
   79    HB3  GLU  13           2HB      GLU  13  -2.901   8.723  -1.730
   80    HG2  GLU  13           1HG      GLU  13  -4.612   6.931  -2.015
   81    HG3  GLU  13           2HG      GLU  13  -5.877   8.082  -1.565
   82    H    TYR  14           H        TYR  14  -5.075   6.481   1.327
   83    HA   TYR  14           HA       TYR  14  -7.473   8.143   1.912
   84    HB2  TYR  14           1HB      TYR  14  -7.062   5.153   1.797
   85    HB3  TYR  14           2HB      TYR  14  -8.591   5.957   2.080
   86    HD1  TYR  14           1HD      TYR  14  -9.668   7.310   0.258
   87    HD2  TYR  14           2HD      TYR  14  -6.168   4.879  -0.453
   88    HE1  TYR  14           1HE      TYR  14 -10.121   7.371  -2.189
   89    HE2  TYR  14           2HE      TYR  14  -6.624   4.955  -2.902
   90    HH   TYR  14           HH       TYR  14  -9.435   6.703  -4.270
   91    H    CYS  15           H        CYS  15  -5.121   6.039   3.580
   92    HA   CYS  15           HA       CYS  15  -6.181   7.030   6.179
   93    HB2  CYS  15           1HB      CYS  15  -6.048   4.888   7.205
   94    HB3  CYS  15           2HB      CYS  15  -7.135   4.836   5.822
   95    H    ASN  16           H        ASN  16  -3.516   7.056   4.289
   96    HA   ASN  16           HA       ASN  16  -1.349   7.535   4.563
   97    HB2  ASN  16           1HB      ASN  16  -2.219   8.616   7.253
   98    HB3  ASN  16           2HB      ASN  16  -0.691   8.954   6.455
   99   HD21  ASN  16          1HD2      ASN  16  -4.149   9.633   6.397
  100   HD22  ASN  16          2HD2      ASN  16  -4.029  10.897   5.181
  101    H    LYS  17           H        LYS  17  -2.163   4.790   5.387
  102    HA   LYS  17           HA       LYS  17   0.021   3.963   7.183
  103    HB2  LYS  17           1HB      LYS  17  -2.060   2.638   7.159
  104    HB3  LYS  17           2HB      LYS  17  -1.840   2.290   5.434
  105    HG2  LYS  17           1HG      LYS  17   0.256   1.129   5.895
  106    HG3  LYS  17           2HG      LYS  17   0.168   1.553   7.615
  107    HD2  LYS  17           1HD      LYS  17  -1.849   0.126   7.826
  108    HD3  LYS  17           2HD      LYS  17  -1.739  -0.291   6.112
  109    HE2  LYS  17           1HE      LYS  17   0.330  -0.878   8.286
  110    HE3  LYS  17           2HE      LYS  17  -0.744  -2.053   7.525
  111    HZ1  LYS  17           3HZ      LYS  17   0.417  -1.585   5.397
  112    HZ2  LYS  17           1HZ      LYS  17   1.438  -2.171   6.531
  113    HZ3  LYS  17           2HZ      LYS  17   1.467  -0.585   6.153
  114    H    VAL  18           H        VAL  18   1.908   3.007   6.558
  115    HA   VAL  18           HA       VAL  18   2.724   3.323   3.719
  116    HB   VAL  18           HB       VAL  18   5.105   3.135   4.776
  117   HG11  VAL  18          1HG1      VAL  18   5.132   5.594   5.057
  118   HG12  VAL  18          2HG1      VAL  18   4.286   5.076   3.589
  119   HG13  VAL  18          3HG1      VAL  18   3.362   5.612   5.014
  120   HG21  VAL  18          3HG2      VAL  18   4.231   2.700   7.124
  121   HG22  VAL  18          1HG2      VAL  18   5.320   4.098   6.978
  122   HG23  VAL  18          2HG2      VAL  18   3.570   4.364   7.096
  123    H    PHE  19           H        PHE  19   3.909   1.872   2.657
  124    HA   PHE  19           HA       PHE  19   4.125  -0.936   3.635
  125    HB2  PHE  19           1HB      PHE  19   3.078  -0.034   0.918
  126    HB3  PHE  19           2HB      PHE  19   3.332  -1.692   1.451
  127    HD1  PHE  19           2HD      PHE  19   1.291   1.385   2.087
  128    HD2  PHE  19           1HD      PHE  19   1.617  -2.882   2.607
  129    HE1  PHE  19           2HE      PHE  19  -0.968   1.338   3.096
  130    HE2  PHE  19           1HE      PHE  19  -0.686  -2.942   3.537
  131    HZ   PHE  19           HZ       PHE  19  -1.951  -0.822   3.843
  132    H    LYS  20           H        LYS  20   5.565  -2.236   2.286
  133    HA   LYS  20           HA       LYS  20   8.029  -0.748   1.648
  134    HB2  LYS  20           1HB      LYS  20   7.449  -3.709   1.958
  135    HB3  LYS  20           2HB      LYS  20   9.048  -2.986   1.678
  136    HG2  LYS  20           1HG      LYS  20   8.717  -1.575   3.753
  137    HG3  LYS  20           2HG      LYS  20   7.192  -2.425   4.039
  138    HD2  LYS  20           1HD      LYS  20   8.885  -3.368   5.438
  139    HD3  LYS  20           2HD      LYS  20   8.418  -4.566   4.213
  140    HE2  LYS  20           1HE      LYS  20  10.456  -4.022   2.904
  141    HE3  LYS  20           2HE      LYS  20  10.891  -2.774   4.078
  142    HZ1  LYS  20           3HZ      LYS  20  10.696  -5.681   4.677
  143    HZ2  LYS  20           1HZ      LYS  20  11.106  -4.527   5.759
  144    HZ3  LYS  20           2HZ      LYS  20  12.087  -4.847   4.497
  145    H    PHE  21           H        PHE  21   5.563  -2.403  -0.172
  146    HA   PHE  21           HA       PHE  21   7.108  -2.074  -2.697
  147    HB2  PHE  21           1HB      PHE  21   5.401  -4.480  -1.979
  148    HB3  PHE  21           2HB      PHE  21   6.364  -4.250  -3.424
  149    HD1  PHE  21           2HD      PHE  21   8.958  -4.010  -3.120
  150    HD2  PHE  21           1HD      PHE  21   6.315  -5.588  -0.099
  151    HE1  PHE  21           2HE      PHE  21  10.891  -5.089  -1.989
  152    HE2  PHE  21           1HE      PHE  21   8.250  -6.663   1.031
  153    HZ   PHE  21           HZ       PHE  21  10.540  -6.413   0.088
  154    H    LYS  22           H        LYS  22   5.846  -1.841  -4.593
  155    HA   LYS  22           HA       LYS  22   3.582  -0.165  -4.345
  156    HB2  LYS  22           1HB      LYS  22   5.167  -0.272  -6.294
  157    HB3  LYS  22           2HB      LYS  22   4.439  -1.808  -6.776
  158    HG2  LYS  22           1HG      LYS  22   2.237  -0.685  -6.978
  159    HG3  LYS  22           2HG      LYS  22   2.978   0.862  -6.513
  160    HD2  LYS  22           1HD      LYS  22   4.490   0.712  -8.501
  161    HD3  LYS  22           2HD      LYS  22   3.679  -0.795  -8.984
  162    HE2  LYS  22           1HE      LYS  22   1.513   0.436  -9.120
  163    HE3  LYS  22           2HE      LYS  22   2.340   1.930  -8.653
  164    HZ1  LYS  22           3HZ      LYS  22   2.086   1.775 -11.064
  165    HZ2  LYS  22           1HZ      LYS  22   2.910   0.368 -11.120
  166    HZ3  LYS  22           2HZ      LYS  22   3.672   1.749 -10.688
  167    H    HIS  23           H        HIS  23   3.669  -3.607  -5.321
  168    HA   HIS  23           HA       HIS  23   0.868  -3.891  -5.675
  169    HB2  HIS  23           1HB      HIS  23   1.349  -6.328  -5.605
  170    HB3  HIS  23           2HB      HIS  23   2.391  -5.424  -6.692
  171    HD1  HIS  23           1HD      HIS  23   4.967  -5.782  -6.350
  172    HD2  HIS  23           2HD      HIS  23   2.560  -7.088  -3.151
  173    HE1  HIS  23           1HE      HIS  23   6.521  -6.983  -4.728
  174    H    SER  24           H        SER  24   2.736  -3.905  -2.743
  175    HA   SER  24           HA       SER  24   0.811  -5.283  -1.046
  176    HB2  SER  24           1HB      SER  24   3.032  -3.314  -0.368
  177    HB3  SER  24           2HB      SER  24   2.081  -4.222   0.797
  178    HG   SER  24           HG       SER  24   2.922  -6.151  -0.068
  179    H    LEU  25           H        LEU  25   1.531  -1.826  -1.695
  180    HA   LEU  25           HA       LEU  25  -0.656  -0.806  -0.102
  181    HB2  LEU  25           1HB      LEU  25   1.212   0.637  -0.636
  182    HB3  LEU  25           2HB      LEU  25   1.017   0.352  -2.368
  183    HG   LEU  25           HG       LEU  25  -1.160   1.535  -2.351
  184   HD11  LEU  25          1HD1      LEU  25  -1.921   2.777  -0.433
  185   HD12  LEU  25          2HD1      LEU  25  -0.533   2.246   0.545
  186   HD13  LEU  25          3HD1      LEU  25  -1.791   1.096   0.048
  187   HD21  LEU  25          3HD2      LEU  25   0.923   2.750  -2.812
  188   HD22  LEU  25          1HD2      LEU  25   1.062   3.153  -1.080
  189   HD23  LEU  25          2HD2      LEU  25  -0.298   3.776  -2.037
  190    H    GLN  26           H        GLN  26  -0.266  -1.610  -3.550
  191    HA   GLN  26           HA       GLN  26  -2.762  -0.534  -4.439
  192    HB2  GLN  26           1HB      GLN  26  -0.936  -2.656  -5.585
  193    HB3  GLN  26           2HB      GLN  26  -2.408  -2.173  -6.410
  194    HG2  GLN  26           1HG      GLN  26  -0.225  -0.199  -5.601
  195    HG3  GLN  26           2HG      GLN  26  -0.300  -0.984  -7.174
  196   HE21  GLN  26          1HE2      GLN  26  -0.459   1.928  -6.548
  197   HE22  GLN  26          2HE2      GLN  26  -1.999   2.427  -7.232
  198    H    ALA  27           H        ALA  27  -2.049  -3.758  -3.155
  199    HA   ALA  27           HA       ALA  27  -4.746  -4.801  -3.503
  200    HB1  ALA  27           1HB      ALA  27  -2.453  -5.567  -1.650
  201    HB2  ALA  27           2HB      ALA  27  -3.902  -6.551  -1.967
  202    HB3  ALA  27           3HB      ALA  27  -2.742  -6.224  -3.282
  203    H    HIS  28           H        HIS  28  -3.074  -3.021  -0.857
  204    HA   HIS  28           HA       HIS  28  -5.196  -3.282   1.073
  205    HB2  HIS  28           1HB      HIS  28  -3.064  -2.690   1.871
  206    HB3  HIS  28           2HB      HIS  28  -2.857  -1.395   0.709
  207    HD1  HIS  28           1HD      HIS  28  -4.750  -2.095   3.983
  208    HD2  HIS  28           2HD      HIS  28  -3.792   0.994   1.296
  209    HE1  HIS  28           1HE      HIS  28  -5.397   0.064   5.151
  210    H    LEU  29           H        LEU  29  -4.740  -1.016  -1.655
  211    HA   LEU  29           HA       LEU  29  -6.768   0.850  -1.027
  212    HB2  LEU  29           1HB      LEU  29  -6.207  -0.225  -3.811
  213    HB3  LEU  29           2HB      LEU  29  -6.924   1.327  -3.388
  214    HG   LEU  29           HG       LEU  29  -4.071   0.442  -2.945
  215   HD11  LEU  29          1HD1      LEU  29  -4.669   1.050  -5.227
  216   HD12  LEU  29          2HD1      LEU  29  -3.519   2.198  -4.518
  217   HD13  LEU  29          3HD1      LEU  29  -5.240   2.643  -4.658
  218   HD21  LEU  29          3HD2      LEU  29  -3.672   2.821  -2.181
  219   HD22  LEU  29          1HD2      LEU  29  -4.631   1.874  -1.042
  220   HD23  LEU  29          2HD2      LEU  29  -5.435   3.040  -2.112
  221    H    ARG  30           H        ARG  30  -7.184  -2.466  -2.036
  222    HA   ARG  30           HA       ARG  30  -9.835  -2.370  -3.067
  223    HB2  ARG  30           1HB      ARG  30  -8.461  -4.660  -1.656
  224    HB3  ARG  30           2HB      ARG  30  -9.924  -4.734  -2.649
  225    HG2  ARG  30           1HG      ARG  30  -8.671  -3.913  -4.627
  226    HG3  ARG  30           2HG      ARG  30  -7.200  -3.802  -3.672
  227    HD2  ARG  30           1HD      ARG  30  -7.149  -5.831  -4.957
  228    HD3  ARG  30           2HD      ARG  30  -7.236  -6.187  -3.229
  229    HE   ARG  30           HE       ARG  30  -9.248  -7.267  -3.547
  230   HH11  ARG  30          2HH1      ARG  30  -8.754  -5.365  -6.500
  231   HH12  ARG  30          1HH1      ARG  30 -10.210  -6.077  -7.207
  232   HH21  ARG  30          2HH2      ARG  30 -11.045  -8.071  -4.667
  233   HH22  ARG  30          1HH2      ARG  30 -11.340  -7.442  -6.292
  234    H    ILE  31           H        ILE  31  -8.863  -1.923   0.229
  235    HA   ILE  31           HA       ILE  31 -11.564  -2.492   1.284
  236    HB   ILE  31           HB       ILE  31 -10.801  -2.074   3.388
  237   HG12  ILE  31          1HG1      ILE  31  -8.427  -0.535   2.308
  238   HG13  ILE  31          2HG1      ILE  31  -9.793   0.086   3.219
  239   HG21  ILE  31          1HG2      ILE  31  -9.850  -4.123   2.264
  240   HG22  ILE  31          2HG2      ILE  31  -8.316  -3.245   2.072
  241   HG23  ILE  31          3HG2      ILE  31  -8.960  -3.587   3.689
  242   HD11  ILE  31          3HD1      ILE  31  -9.092  -1.290   5.186
  243   HD12  ILE  31          1HD1      ILE  31  -7.614  -1.729   4.291
  244   HD13  ILE  31          2HD1      ILE  31  -7.935  -0.036   4.703
  245    H    HIS  32           H        HIS  32  -9.822   0.202   0.005
  246    HA   HIS  32           HA       HIS  32 -11.597   2.277   1.108
  247    HB2  HIS  32           1HB      HIS  32  -9.070   2.320  -0.593
  248    HB3  HIS  32           2HB      HIS  32  -9.924   3.744  -0.075
  249    HD1  HIS  32           1HD      HIS  32 -10.282   3.540   2.927
  250    HD2  HIS  32           2HD      HIS  32  -6.967   2.005   0.856
  251    HE1  HIS  32           1HE      HIS  32  -8.394   3.440   4.622
  252    H    THR  33           H        THR  33 -11.078   0.586  -1.951
  253    HA   THR  33           HA       THR  33 -13.297   2.167  -3.180
  254    HB   THR  33           HB       THR  33 -11.113   2.873  -4.089
  255    HG1  THR  33           1HG      THR  33 -11.833   2.764  -6.198
  256   HG21  THR  33          3HG2      THR  33  -9.859   0.762  -4.080
  257   HG22  THR  33          1HG2      THR  33  -9.945   1.429  -5.709
  258   HG23  THR  33          2HG2      THR  33 -10.977   0.052  -5.260
  259    H    ASN  34           H        ASN  34 -14.449   1.089  -4.908
  260    HA   ASN  34           HA       ASN  34 -15.186  -1.602  -3.965
  261    HB2  ASN  34           1HB      ASN  34 -16.512   0.361  -5.877
  262    HB3  ASN  34           2HB      ASN  34 -17.182  -1.212  -5.461
  263   HD21  ASN  34          1HD2      ASN  34 -18.734   0.967  -5.006
  264   HD22  ASN  34          2HD2      ASN  34 -18.846   1.245  -3.273
  265    H    GLU  35           H        GLU  35 -15.624  -3.378  -5.310
  266    HA   GLU  35           HA       GLU  35 -13.865  -3.681  -7.676
  267    HB2  GLU  35           1HB      GLU  35 -13.780  -5.344  -5.839
  268    HB3  GLU  35           2HB      GLU  35 -15.487  -5.703  -6.082
  269    HG2  GLU  35           1HG      GLU  35 -14.090  -7.430  -7.055
  270    HG3  GLU  35           2HG      GLU  35 -15.004  -6.626  -8.317
  271    H    LYS  36           H        LYS  36 -14.670  -4.587  -9.658
  272    HA   LYS  36           HA       LYS  36 -17.592  -4.301 -10.204
  273    HB2  LYS  36           1HB      LYS  36 -16.447  -2.204 -10.882
  274    HB3  LYS  36           2HB      LYS  36 -15.396  -3.134 -11.959
  275    HG2  LYS  36           1HG      LYS  36 -17.387  -3.890 -13.246
  276    HG3  LYS  36           2HG      LYS  36 -18.441  -2.995 -12.134
  277    HD2  LYS  36           1HD      LYS  36 -17.369  -0.863 -12.830
  278    HD3  LYS  36           2HD      LYS  36 -16.257  -1.759 -13.868
  279    HE2  LYS  36           1HE      LYS  36 -17.955  -0.856 -15.281
  280    HE3  LYS  36           2HE      LYS  36 -18.188  -2.603 -15.206
  281    HZ1  LYS  36           3HZ      LYS  36 -19.990  -2.222 -13.604
  282    HZ2  LYS  36           1HZ      LYS  36 -20.284  -1.385 -14.970
  283    HZ3  LYS  36           2HZ      LYS  36 -19.746  -0.605 -13.644
  Start of MODEL   17
    1    H1   GLY   1           1H       GLY   1  18.567   6.147  10.825
    2    H2   GLY   1           2H       GLY   1  18.609   4.967   9.687
    3    H3   GLY   1           3H       GLY   1  19.674   4.939  10.936
    4    HA2  GLY   1           1HA      GLY   1  17.868   4.603  12.513
    5    HA3  GLY   1           2HA      GLY   1  16.753   4.590  11.134
    6    H    SER   2           H        SER   2  16.480   2.441  12.555
    7    HA   SER   2           HA       SER   2  18.370   0.300  12.007
    8    HB2  SER   2           1HB      SER   2  16.690  -1.086  13.200
    9    HB3  SER   2           2HB      SER   2  17.185   0.358  14.099
   10    HG   SER   2           HG       SER   2  14.900   0.058  14.119
   11    H    SER   3           H        SER   3  15.457   1.429  10.411
   12    HA   SER   3           HA       SER   3  15.871  -0.452   8.194
   13    HB2  SER   3           1HB      SER   3  14.370  -1.659   9.815
   14    HB3  SER   3           2HB      SER   3  13.184  -0.354   9.625
   15    HG   SER   3           HG       SER   3  12.847  -2.192   8.220
   16    H    GLY   4           H        GLY   4  14.710   0.152   6.291
   17    HA2  GLY   4           1HA      GLY   4  13.629   1.497   4.781
   18    HA3  GLY   4           2HA      GLY   4  12.975   2.432   6.123
   19    H    SER   5           H        SER   5  16.051   2.946   6.846
   20    HA   SER   5           HA       SER   5  16.247   5.536   5.755
   21    HB2  SER   5           1HB      SER   5  18.502   3.761   6.766
   22    HB3  SER   5           2HB      SER   5  18.562   5.522   6.567
   23    HG   SER   5           HG       SER   5  16.735   5.604   8.057
   24    H    SER   6           H        SER   6  16.916   6.358   3.897
   25    HA   SER   6           HA       SER   6  17.370   6.520   1.707
   26    HB2  SER   6           1HB      SER   6  19.660   4.614   2.258
   27    HB3  SER   6           2HB      SER   6  19.499   5.703   0.870
   28    HG   SER   6           HG       SER   6  20.804   6.607   2.531
   29    H    GLY   7           H        GLY   7  15.636   4.129   2.594
   30    HA2  GLY   7           1HA      GLY   7  15.740   2.366   0.203
   31    HA3  GLY   7           2HA      GLY   7  14.747   2.176   1.644
   32    H    LYS   8           H        LYS   8  12.994   1.764   0.249
   33    HA   LYS   8           HA       LYS   8  11.571   4.222  -0.656
   34    HB2  LYS   8           1HB      LYS   8  12.361   3.033  -2.654
   35    HB3  LYS   8           2HB      LYS   8  11.664   1.527  -2.068
   36    HG2  LYS   8           1HG      LYS   8  10.281   2.434  -3.811
   37    HG3  LYS   8           2HG      LYS   8   9.386   2.460  -2.297
   38    HD2  LYS   8           1HD      LYS   8   9.897   4.904  -2.059
   39    HD3  LYS   8           2HD      LYS   8  10.754   4.869  -3.601
   40    HE2  LYS   8           1HE      LYS   8   7.826   4.065  -3.245
   41    HE3  LYS   8           2HE      LYS   8   8.335   5.715  -3.604
   42    HZ1  LYS   8           3HZ      LYS   8   8.887   3.375  -5.347
   43    HZ2  LYS   8           1HZ      LYS   8   9.343   4.915  -5.662
   44    HZ3  LYS   8           2HZ      LYS   8   7.761   4.523  -5.627
   45    H    ILE   9           H        ILE   9   9.527   4.399  -0.071
   46    HA   ILE   9           HA       ILE   9   8.012   2.115   1.057
   47    HB   ILE   9           HB       ILE   9   6.933   3.629   2.699
   48   HG12  ILE   9          1HG1      ILE   9   9.272   5.538   2.255
   49   HG13  ILE   9          2HG1      ILE   9   7.682   5.791   1.533
   50   HG21  ILE   9          1HG2      ILE   9   8.663   3.399   4.384
   51   HG22  ILE   9          2HG2      ILE   9   8.719   2.005   3.301
   52   HG23  ILE   9          3HG2      ILE   9   9.929   3.297   3.142
   53   HD11  ILE   9          3HD1      ILE   9   6.636   5.849   3.752
   54   HD12  ILE   9          1HD1      ILE   9   8.233   5.648   4.520
   55   HD13  ILE   9          2HD1      ILE   9   7.878   7.098   3.563
   56    H    PHE  10           H        PHE  10   5.740   2.337   0.906
   57    HA   PHE  10           HA       PHE  10   4.715   4.278  -1.143
   58    HB2  PHE  10           1HB      PHE  10   4.162   1.305  -0.799
   59    HB3  PHE  10           2HB      PHE  10   3.157   2.370  -1.757
   60    HD1  PHE  10           2HD      PHE  10   6.565   0.876  -1.529
   61    HD2  PHE  10           1HD      PHE  10   3.776   3.104  -3.949
   62    HE1  PHE  10           2HE      PHE  10   7.980   0.473  -3.532
   63    HE2  PHE  10           1HE      PHE  10   5.183   2.691  -5.950
   64    HZ   PHE  10           HZ       PHE  10   7.254   1.337  -5.759
   65    H    THR  11           H        THR  11   3.052   5.506  -0.404
   66    HA   THR  11           HA       THR  11   1.815   4.797   2.225
   67    HB   THR  11           HB       THR  11   2.025   7.564   1.015
   68    HG1  THR  11           1HG      THR  11   3.820   7.859   2.283
   69   HG21  THR  11          3HG2      THR  11   1.869   8.180   3.479
   70   HG22  THR  11          1HG2      THR  11   1.494   6.477   3.820
   71   HG23  THR  11          2HG2      THR  11   0.409   7.456   2.797
   72    H    CYS  12           H        CYS  12  -0.326   4.661   2.470
   73    HA   CYS  12           HA       CYS  12  -2.201   4.777   0.304
   74    HB2  CYS  12           1HB      CYS  12  -2.329   3.318   2.291
   75    HB3  CYS  12           2HB      CYS  12  -2.526   4.747   3.323
   76    H    GLU  13           H        GLU  13  -3.337   6.415  -0.507
   77    HA   GLU  13           HA       GLU  13  -3.005   9.110   0.603
   78    HB2  GLU  13           1HB      GLU  13  -4.165   9.890  -1.355
   79    HB3  GLU  13           2HB      GLU  13  -2.924   8.727  -1.822
   80    HG2  GLU  13           1HG      GLU  13  -4.680   6.968  -2.051
   81    HG3  GLU  13           2HG      GLU  13  -5.913   8.161  -1.623
   82    H    TYR  14           H        TYR  14  -5.125   6.571   1.258
   83    HA   TYR  14           HA       TYR  14  -7.467   8.300   1.871
   84    HB2  TYR  14           1HB      TYR  14  -7.173   5.292   1.738
   85    HB3  TYR  14           2HB      TYR  14  -8.661   6.164   2.023
   86    HD1  TYR  14           1HD      TYR  14  -9.655   7.586   0.189
   87    HD2  TYR  14           2HD      TYR  14  -6.297   4.957  -0.498
   88    HE1  TYR  14           1HE      TYR  14 -10.100   7.647  -2.265
   89    HE2  TYR  14           2HE      TYR  14  -6.749   5.020  -2.941
   90    HH   TYR  14           HH       TYR  14  -8.089   5.834  -4.613
   91    H    CYS  15           H        CYS  15  -5.178   6.108   3.510
   92    HA   CYS  15           HA       CYS  15  -6.131   7.181   6.118
   93    HB2  CYS  15           1HB      CYS  15  -6.133   5.053   7.172
   94    HB3  CYS  15           2HB      CYS  15  -7.226   5.040   5.792
   95    H    ASN  16           H        ASN  16  -3.509   6.973   4.175
   96    HA   ASN  16           HA       ASN  16  -1.302   7.217   4.373
   97    HB2  ASN  16           1HB      ASN  16  -1.820   8.504   7.041
   98    HB3  ASN  16           2HB      ASN  16  -0.482   8.799   5.928
   99   HD21  ASN  16          1HD2      ASN  16  -1.948   9.030   3.434
  100   HD22  ASN  16          2HD2      ASN  16  -2.865  10.519   3.599
  101    H    LYS  17           H        LYS  17  -2.263   4.645   5.306
  102    HA   LYS  17           HA       LYS  17  -0.183   3.660   7.113
  103    HB2  LYS  17           1HB      LYS  17  -2.419   2.558   6.841
  104    HB3  LYS  17           2HB      LYS  17  -1.990   2.129   5.183
  105    HG2  LYS  17           1HG      LYS  17  -0.174   0.706   5.952
  106    HG3  LYS  17           2HG      LYS  17  -0.341   1.299   7.615
  107    HD2  LYS  17           1HD      LYS  17  -2.548   0.262   7.815
  108    HD3  LYS  17           2HD      LYS  17  -2.488  -0.273   6.122
  109    HE2  LYS  17           1HE      LYS  17  -0.488  -1.647   6.612
  110    HE3  LYS  17           2HE      LYS  17  -0.484  -1.075   8.284
  111    HZ1  LYS  17           3HZ      LYS  17  -2.657  -2.689   7.051
  112    HZ2  LYS  17           1HZ      LYS  17  -2.650  -2.150   8.595
  113    HZ3  LYS  17           2HZ      LYS  17  -1.546  -3.246   8.108
  114    H    VAL  18           H        VAL  18   1.687   2.596   6.517
  115    HA   VAL  18           HA       VAL  18   2.636   3.065   3.734
  116    HB   VAL  18           HB       VAL  18   4.960   3.102   4.904
  117   HG11  VAL  18          1HG1      VAL  18   3.016   5.425   5.065
  118   HG12  VAL  18          2HG1      VAL  18   4.782   5.549   5.121
  119   HG13  VAL  18          3HG1      VAL  18   3.996   4.941   3.655
  120   HG21  VAL  18          3HG2      VAL  18   3.254   4.214   7.159
  121   HG22  VAL  18          1HG2      VAL  18   4.071   2.621   7.224
  122   HG23  VAL  18          2HG2      VAL  18   5.023   4.113   7.081
  123    H    PHE  19           H        PHE  19   3.805   1.678   2.662
  124    HA   PHE  19           HA       PHE  19   4.216  -1.084   3.727
  125    HB2  PHE  19           1HB      PHE  19   3.178  -0.353   0.976
  126    HB3  PHE  19           2HB      PHE  19   3.371  -1.958   1.634
  127    HD1  PHE  19           2HD      PHE  19   1.307   1.133   1.848
  128    HD2  PHE  19           1HD      PHE  19   1.719  -2.986   3.044
  129    HE1  PHE  19           2HE      PHE  19  -0.965   1.202   2.866
  130    HE2  PHE  19           1HE      PHE  19  -0.573  -2.936   4.000
  131    HZ   PHE  19           HZ       PHE  19  -1.897  -0.835   3.936
  132    H    LYS  20           H        LYS  20   5.622  -2.383   2.359
  133    HA   LYS  20           HA       LYS  20   8.140  -0.999   1.812
  134    HB2  LYS  20           1HB      LYS  20   7.256  -3.917   1.691
  135    HB3  LYS  20           2HB      LYS  20   8.927  -3.387   1.506
  136    HG2  LYS  20           1HG      LYS  20   7.232  -2.834   3.985
  137    HG3  LYS  20           2HG      LYS  20   8.274  -4.253   3.787
  138    HD2  LYS  20           1HD      LYS  20  10.216  -2.707   3.355
  139    HD3  LYS  20           2HD      LYS  20   9.193  -1.340   3.810
  140    HE2  LYS  20           1HE      LYS  20   9.851  -3.743   5.580
  141    HE3  LYS  20           2HE      LYS  20  10.685  -2.189   5.645
  142    HZ1  LYS  20           3HZ      LYS  20   7.803  -2.596   6.245
  143    HZ2  LYS  20           1HZ      LYS  20   8.565  -1.147   6.268
  144    HZ3  LYS  20           2HZ      LYS  20   8.973  -2.305   7.339
  145    H    PHE  21           H        PHE  21   5.645  -2.452  -0.180
  146    HA   PHE  21           HA       PHE  21   7.178  -1.844  -2.666
  147    HB2  PHE  21           1HB      PHE  21   5.754  -4.444  -1.972
  148    HB3  PHE  21           2HB      PHE  21   6.419  -4.042  -3.545
  149    HD1  PHE  21           1HD      PHE  21   8.908  -3.765  -3.851
  150    HD2  PHE  21           2HD      PHE  21   7.194  -5.252  -0.183
  151    HE1  PHE  21           1HE      PHE  21  11.122  -4.668  -3.178
  152    HE2  PHE  21           2HE      PHE  21   9.410  -6.147   0.489
  153    HZ   PHE  21           HZ       PHE  21  11.376  -5.860  -1.009
  154    H    LYS  22           H        LYS  22   5.912  -1.683  -4.576
  155    HA   LYS  22           HA       LYS  22   3.607  -0.089  -4.338
  156    HB2  LYS  22           1HB      LYS  22   5.176  -0.203  -6.303
  157    HB3  LYS  22           2HB      LYS  22   4.479  -1.764  -6.743
  158    HG2  LYS  22           1HG      LYS  22   2.251  -0.694  -6.950
  159    HG3  LYS  22           2HG      LYS  22   2.963   0.880  -6.536
  160    HD2  LYS  22           1HD      LYS  22   4.451   0.715  -8.535
  161    HD3  LYS  22           2HD      LYS  22   3.687  -0.832  -8.961
  162    HE2  LYS  22           1HE      LYS  22   1.481   0.318  -9.122
  163    HE3  LYS  22           2HE      LYS  22   2.257   1.855  -8.710
  164    HZ1  LYS  22           3HZ      LYS  22   3.585   1.653 -10.747
  165    HZ2  LYS  22           1HZ      LYS  22   1.996   1.612 -11.113
  166    HZ3  LYS  22           2HZ      LYS  22   2.868   0.234 -11.128
  167    H    HIS  23           H        HIS  23   3.751  -3.549  -5.245
  168    HA   HIS  23           HA       HIS  23   0.951  -3.872  -5.586
  169    HB2  HIS  23           1HB      HIS  23   1.461  -6.302  -5.485
  170    HB3  HIS  23           2HB      HIS  23   2.490  -5.403  -6.587
  171    HD1  HIS  23           1HD      HIS  23   5.070  -5.732  -6.249
  172    HD2  HIS  23           2HD      HIS  23   2.687  -7.009  -3.020
  173    HE1  HIS  23           1HE      HIS  23   6.643  -6.888  -4.611
  174    H    SER  24           H        SER  24   2.826  -3.825  -2.655
  175    HA   SER  24           HA       SER  24   0.910  -5.190  -0.938
  176    HB2  SER  24           1HB      SER  24   3.087  -3.174  -0.282
  177    HB3  SER  24           2HB      SER  24   2.156  -4.104   0.885
  178    HG   SER  24           HG       SER  24   3.070  -6.009   0.027
  179    H    LEU  25           H        LEU  25   1.607  -1.735  -1.635
  180    HA   LEU  25           HA       LEU  25  -0.580  -0.697  -0.071
  181    HB2  LEU  25           1HB      LEU  25   1.277   0.742  -0.667
  182    HB3  LEU  25           2HB      LEU  25   1.063   0.410  -2.386
  183    HG   LEU  25           HG       LEU  25  -1.124   1.576  -2.375
  184   HD11  LEU  25          1HD1      LEU  25  -1.742   1.196   0.027
  185   HD12  LEU  25          2HD1      LEU  25  -1.854   2.872  -0.474
  186   HD13  LEU  25          3HD1      LEU  25  -0.465   2.338   0.502
  187   HD21  LEU  25          3HD2      LEU  25   1.090   3.255  -1.176
  188   HD22  LEU  25          1HD2      LEU  25  -0.284   3.832  -2.138
  189   HD23  LEU  25          2HD2      LEU  25   0.947   2.802  -2.892
  190    H    GLN  26           H        GLN  26  -0.209  -1.575  -3.504
  191    HA   GLN  26           HA       GLN  26  -2.720  -0.522  -4.394
  192    HB2  GLN  26           1HB      GLN  26  -0.884  -2.649  -5.520
  193    HB3  GLN  26           2HB      GLN  26  -2.364  -2.186  -6.344
  194    HG2  GLN  26           1HG      GLN  26  -0.188  -0.188  -5.577
  195    HG3  GLN  26           2HG      GLN  26  -0.267  -0.998  -7.137
  196   HE21  GLN  26          1HE2      GLN  26  -0.440   1.923  -6.550
  197   HE22  GLN  26          2HE2      GLN  26  -1.985   2.402  -7.236
  198    H    ALA  27           H        ALA  27  -1.949  -3.699  -3.067
  199    HA   ALA  27           HA       ALA  27  -4.593  -4.852  -3.377
  200    HB1  ALA  27           1HB      ALA  27  -2.266  -5.416  -1.502
  201    HB2  ALA  27           2HB      ALA  27  -3.653  -6.501  -1.772
  202    HB3  ALA  27           3HB      ALA  27  -2.519  -6.154  -3.105
  203    H    HIS  28           H        HIS  28  -3.016  -2.909  -0.803
  204    HA   HIS  28           HA       HIS  28  -5.140  -3.201   1.140
  205    HB2  HIS  28           1HB      HIS  28  -3.026  -2.567   1.952
  206    HB3  HIS  28           2HB      HIS  28  -2.809  -1.302   0.760
  207    HD1  HIS  28           1HD      HIS  28  -4.770  -1.939   4.008
  208    HD2  HIS  28           2HD      HIS  28  -3.789   1.099   1.272
  209    HE1  HIS  28           1HE      HIS  28  -5.490   0.235   5.103
  210    H    LEU  29           H        LEU  29  -4.647  -0.957  -1.604
  211    HA   LEU  29           HA       LEU  29  -6.652   0.929  -1.010
  212    HB2  LEU  29           1HB      LEU  29  -6.024  -0.162  -3.777
  213    HB3  LEU  29           2HB      LEU  29  -6.793   1.376  -3.398
  214    HG   LEU  29           HG       LEU  29  -3.938   0.572  -2.819
  215   HD11  LEU  29          1HD1      LEU  29  -4.459   1.133  -5.142
  216   HD12  LEU  29          2HD1      LEU  29  -3.364   2.317  -4.402
  217   HD13  LEU  29          3HD1      LEU  29  -5.086   2.720  -4.619
  218   HD21  LEU  29          3HD2      LEU  29  -3.686   3.017  -2.100
  219   HD22  LEU  29          1HD2      LEU  29  -4.615   2.025  -0.974
  220   HD23  LEU  29          2HD2      LEU  29  -5.463   3.121  -2.082
  221    H    ARG  30           H        ARG  30  -7.137  -2.368  -2.080
  222    HA   ARG  30           HA       ARG  30  -9.760  -2.144  -3.140
  223    HB2  ARG  30           1HB      ARG  30  -8.622  -4.512  -1.629
  224    HB3  ARG  30           2HB      ARG  30  -9.960  -4.508  -2.792
  225    HG2  ARG  30           1HG      ARG  30  -8.449  -3.899  -4.625
  226    HG3  ARG  30           2HG      ARG  30  -7.073  -3.819  -3.528
  227    HD2  ARG  30           1HD      ARG  30  -8.735  -6.309  -4.063
  228    HD3  ARG  30           2HD      ARG  30  -7.164  -5.942  -4.802
  229    HE   ARG  30           HE       ARG  30  -6.759  -5.748  -2.037
  230   HH11  ARG  30          2HH1      ARG  30  -7.606  -8.346  -4.235
  231   HH12  ARG  30          1HH1      ARG  30  -6.958  -9.571  -3.179
  232   HH21  ARG  30          2HH2      ARG  30  -6.013  -7.350  -0.720
  233   HH22  ARG  30          1HH2      ARG  30  -6.060  -9.010  -1.239
  234    H    ILE  31           H        ILE  31  -8.803  -1.960   0.231
  235    HA   ILE  31           HA       ILE  31 -11.513  -2.460   1.231
  236    HB   ILE  31           HB       ILE  31 -10.774  -2.045   3.351
  237   HG12  ILE  31          1HG1      ILE  31  -8.399  -0.479   2.303
  238   HG13  ILE  31          2HG1      ILE  31  -9.788   0.136   3.184
  239   HG21  ILE  31          1HG2      ILE  31  -8.264  -3.174   2.044
  240   HG22  ILE  31          2HG2      ILE  31  -8.916  -3.535   3.653
  241   HG23  ILE  31          3HG2      ILE  31  -9.789  -4.072   2.217
  242   HD11  ILE  31          3HD1      ILE  31  -9.122  -1.237   5.167
  243   HD12  ILE  31          1HD1      ILE  31  -7.619  -1.661   4.306
  244   HD13  ILE  31          2HD1      ILE  31  -7.968   0.029   4.709
  245    H    HIS  32           H        HIS  32  -9.751   0.278   0.028
  246    HA   HIS  32           HA       HIS  32 -11.647   2.294   0.997
  247    HB2  HIS  32           1HB      HIS  32  -9.109   2.431  -0.682
  248    HB3  HIS  32           2HB      HIS  32 -10.024   3.815  -0.169
  249    HD1  HIS  32           1HD      HIS  32 -10.338   3.762   2.786
  250    HD2  HIS  32           2HD      HIS  32  -7.053   2.034   0.822
  251    HE1  HIS  32           1HE      HIS  32  -8.467   3.686   4.504
  252    H    THR  33           H        THR  33 -10.951   0.528  -2.037
  253    HA   THR  33           HA       THR  33 -12.754   2.164  -3.654
  254    HB   THR  33           HB       THR  33 -12.550   0.464  -5.357
  255    HG1  THR  33           1HG      THR  33 -11.465  -1.416  -5.002
  256   HG21  THR  33          3HG2      THR  33  -9.805   0.806  -4.095
  257   HG22  THR  33          1HG2      THR  33 -10.620   2.044  -5.082
  258   HG23  THR  33          2HG2      THR  33 -10.178   0.474  -5.790
  259    H    ASN  34           H        ASN  34 -13.150  -0.756  -1.697
  260    HA   ASN  34           HA       ASN  34 -15.641  -1.569  -2.821
  261    HB2  ASN  34           1HB      ASN  34 -14.086  -3.098  -1.709
  262    HB3  ASN  34           2HB      ASN  34 -14.297  -2.247  -0.175
  263   HD21  ASN  34          1HD2      ASN  34 -16.094  -4.143  -2.655
  264   HD22  ASN  34          2HD2      ASN  34 -17.292  -4.730  -1.513
  265    H    GLU  35           H        GLU  35 -17.734  -1.437  -2.141
  266    HA   GLU  35           HA       GLU  35 -18.497   0.187   0.218
  267    HB2  GLU  35           1HB      GLU  35 -19.597   0.614  -2.595
  268    HB3  GLU  35           2HB      GLU  35 -20.298   1.276  -1.117
  269    HG2  GLU  35           1HG      GLU  35 -18.157   2.495  -0.672
  270    HG3  GLU  35           2HG      GLU  35 -17.542   1.934  -2.231
  271    H    LYS  36           H        LYS  36 -20.648  -0.217   0.927
  272    HA   LYS  36           HA       LYS  36 -22.228  -1.594   1.754
  273    HB2  LYS  36           1HB      LYS  36 -23.173  -0.809  -0.431
  274    HB3  LYS  36           2HB      LYS  36 -22.731  -2.368  -1.134
  275    HG2  LYS  36           1HG      LYS  36 -24.182  -3.506   0.565
  276    HG3  LYS  36           2HG      LYS  36 -24.604  -1.925   1.243
  277    HD2  LYS  36           1HD      LYS  36 -25.575  -1.244  -0.931
  278    HD3  LYS  36           2HD      LYS  36 -25.172  -2.816  -1.627
  279    HE2  LYS  36           1HE      LYS  36 -27.016  -2.387   0.771
  280    HE3  LYS  36           2HE      LYS  36 -27.573  -2.539  -0.897
  281    HZ1  LYS  36           3HZ      LYS  36 -27.701  -4.664   0.239
  282    HZ2  LYS  36           1HZ      LYS  36 -26.111  -4.650   0.597
  283    HZ3  LYS  36           2HZ      LYS  36 -26.601  -4.774  -0.959
  Start of MODEL   18
    1    H1   GLY   1           1H       GLY   1  23.316  -7.442  11.596
    2    H2   GLY   1           2H       GLY   1  24.438  -6.821  12.612
    3    H3   GLY   1           3H       GLY   1  24.784  -6.993  11.019
    4    HA2  GLY   1           1HA      GLY   1  24.348  -4.681  11.521
    5    HA3  GLY   1           2HA      GLY   1  23.143  -5.353  10.407
    6    H    SER   2           H        SER   2  22.606  -3.072  11.885
    7    HA   SER   2           HA       SER   2  21.000  -3.721  14.252
    8    HB2  SER   2           1HB      SER   2  20.571  -1.329  14.328
    9    HB3  SER   2           2HB      SER   2  22.299  -1.645  14.122
   10    HG   SER   2           HG       SER   2  21.589  -0.006  12.701
   11    H    SER   3           H        SER   3  18.734  -2.806  14.389
   12    HA   SER   3           HA       SER   3  17.042  -4.079  12.445
   13    HB2  SER   3           1HB      SER   3  16.289  -2.189  14.700
   14    HB3  SER   3           2HB      SER   3  15.214  -3.321  13.861
   15    HG   SER   3           HG       SER   3  15.986  -4.173  15.852
   16    H    GLY   4           H        GLY   4  18.437  -0.979  12.289
   17    HA2  GLY   4           1HA      GLY   4  16.253   0.531  11.127
   18    HA3  GLY   4           2HA      GLY   4  17.957   0.967  11.122
   19    H    SER   5           H        SER   5  16.141   1.357   8.971
   20    HA   SER   5           HA       SER   5  17.594   0.005   6.794
   21    HB2  SER   5           1HB      SER   5  15.566  -0.699   5.634
   22    HB3  SER   5           2HB      SER   5  15.697  -1.495   7.208
   23    HG   SER   5           HG       SER   5  13.580  -0.713   6.836
   24    H    SER   6           H        SER   6  17.239   0.955   4.702
   25    HA   SER   6           HA       SER   6  16.398   3.824   4.749
   26    HB2  SER   6           1HB      SER   6  18.326   4.257   3.274
   27    HB3  SER   6           2HB      SER   6  18.806   3.615   4.852
   28    HG   SER   6           HG       SER   6  19.910   2.579   3.113
   29    H    GLY   7           H        GLY   7  15.237   1.087   3.552
   30    HA2  GLY   7           1HA      GLY   7  15.149   1.429   0.712
   31    HA3  GLY   7           2HA      GLY   7  14.094   0.394   1.666
   32    H    LYS   8           H        LYS   8  13.435   1.947  -0.652
   33    HA   LYS   8           HA       LYS   8  11.821   4.253   0.108
   34    HB2  LYS   8           1HB      LYS   8  13.023   3.932  -2.067
   35    HB3  LYS   8           2HB      LYS   8  11.887   2.664  -2.509
   36    HG2  LYS   8           1HG      LYS   8  10.908   5.447  -1.780
   37    HG3  LYS   8           2HG      LYS   8  11.623   5.144  -3.363
   38    HD2  LYS   8           1HD      LYS   8   9.929   3.457  -3.895
   39    HD3  LYS   8           2HD      LYS   8   9.212   3.631  -2.292
   40    HE2  LYS   8           1HE      LYS   8   9.039   6.178  -2.897
   41    HE3  LYS   8           2HE      LYS   8   9.278   5.640  -4.566
   42    HZ1  LYS   8           3HZ      LYS   8   7.307   4.167  -4.220
   43    HZ2  LYS   8           1HZ      LYS   8   6.923   5.749  -4.023
   44    HZ3  LYS   8           2HZ      LYS   8   7.124   4.788  -2.710
   45    H    ILE   9           H        ILE   9   9.676   4.426   0.389
   46    HA   ILE   9           HA       ILE   9   8.046   1.944   0.645
   47    HB   ILE   9           HB       ILE   9   6.935   3.123   2.577
   48   HG12  ILE   9          1HG1      ILE   9   8.327   4.703   3.882
   49   HG13  ILE   9          2HG1      ILE   9   9.434   4.890   2.545
   50   HG21  ILE   9          1HG2      ILE   9   8.507   1.231   2.795
   51   HG22  ILE   9          2HG2      ILE   9   9.868   2.369   2.900
   52   HG23  ILE   9          3HG2      ILE   9   8.617   2.348   4.159
   53   HD11  ILE   9          3HD1      ILE   9   7.742   6.026   1.220
   54   HD12  ILE   9          1HD1      ILE   9   6.467   5.593   2.389
   55   HD13  ILE   9          2HD1      ILE   9   7.745   6.743   2.833
   56    H    PHE  10           H        PHE  10   5.758   2.287   0.706
   57    HA   PHE  10           HA       PHE  10   4.764   4.419  -1.161
   58    HB2  PHE  10           1HB      PHE  10   4.177   1.438  -1.054
   59    HB3  PHE  10           2HB      PHE  10   3.119   2.579  -1.852
   60    HD1  PHE  10           2HD      PHE  10   6.477   1.010  -1.997
   61    HD2  PHE  10           1HD      PHE  10   3.672   3.647  -3.940
   62    HE1  PHE  10           2HE      PHE  10   7.776   0.842  -4.105
   63    HE2  PHE  10           1HE      PHE  10   4.976   3.494  -6.038
   64    HZ   PHE  10           HZ       PHE  10   6.982   2.021  -6.161
   65    H    THR  11           H        THR  11   2.973   5.528  -0.509
   66    HA   THR  11           HA       THR  11   1.833   4.832   2.172
   67    HB   THR  11           HB       THR  11   1.931   7.591   0.931
   68    HG1  THR  11           1HG      THR  11   3.775   7.940   2.130
   69   HG21  THR  11          3HG2      THR  11   0.399   7.407   2.793
   70   HG22  THR  11          1HG2      THR  11   1.850   8.228   3.378
   71   HG23  THR  11          2HG2      THR  11   1.600   6.512   3.767
   72    H    CYS  12           H        CYS  12  -0.290   4.679   2.483
   73    HA   CYS  12           HA       CYS  12  -2.210   4.727   0.342
   74    HB2  CYS  12           1HB      CYS  12  -2.289   3.261   2.318
   75    HB3  CYS  12           2HB      CYS  12  -2.505   4.680   3.363
   76    H    GLU  13           H        GLU  13  -3.283   6.375  -0.516
   77    HA   GLU  13           HA       GLU  13  -3.050   9.054   0.626
   78    HB2  GLU  13           1HB      GLU  13  -4.198   9.823  -1.345
   79    HB3  GLU  13           2HB      GLU  13  -2.939   8.677  -1.803
   80    HG2  GLU  13           1HG      GLU  13  -4.671   6.897  -2.050
   81    HG3  GLU  13           2HG      GLU  13  -5.922   8.074  -1.631
   82    H    TYR  14           H        TYR  14  -5.112   6.489   1.293
   83    HA   TYR  14           HA       TYR  14  -7.502   8.167   1.882
   84    HB2  TYR  14           1HB      TYR  14  -7.119   5.171   1.714
   85    HB3  TYR  14           2HB      TYR  14  -8.629   5.984   2.040
   86    HD1  TYR  14           1HD      TYR  14  -9.686   7.432   0.249
   87    HD2  TYR  14           2HD      TYR  14  -6.289   4.882  -0.545
   88    HE1  TYR  14           1HE      TYR  14 -10.171   7.535  -2.196
   89    HE2  TYR  14           2HE      TYR  14  -6.777   4.997  -2.979
   90    HH   TYR  14           HH       TYR  14  -8.157   5.818  -4.614
   91    H    CYS  15           H        CYS  15  -5.132   6.101   3.533
   92    HA   CYS  15           HA       CYS  15  -6.159   7.094   6.136
   93    HB2  CYS  15           1HB      CYS  15  -6.137   4.973   7.193
   94    HB3  CYS  15           2HB      CYS  15  -7.210   4.931   5.801
   95    H    ASN  16           H        ASN  16  -3.519   6.921   4.207
   96    HA   ASN  16           HA       ASN  16  -1.356   7.272   4.422
   97    HB2  ASN  16           1HB      ASN  16  -2.655   9.135   5.923
   98    HB3  ASN  16           2HB      ASN  16  -1.473   8.547   7.089
   99   HD21  ASN  16          1HD2      ASN  16  -1.653   9.362   3.578
  100   HD22  ASN  16          2HD2      ASN  16  -0.186  10.338   3.586
  101    H    LYS  17           H        LYS  17  -2.163   4.686   5.376
  102    HA   LYS  17           HA       LYS  17  -0.005   3.813   7.162
  103    HB2  LYS  17           1HB      LYS  17  -2.174   2.611   7.018
  104    HB3  LYS  17           2HB      LYS  17  -1.870   2.246   5.317
  105    HG2  LYS  17           1HG      LYS  17   0.046   0.859   5.890
  106    HG3  LYS  17           2HG      LYS  17  -0.040   1.361   7.590
  107    HD2  LYS  17           1HD      LYS  17  -2.171   0.208   7.885
  108    HD3  LYS  17           2HD      LYS  17  -2.288  -0.110   6.154
  109    HE2  LYS  17           1HE      LYS  17  -1.603  -2.147   7.205
  110    HE3  LYS  17           2HE      LYS  17  -0.242  -1.528   6.264
  111    HZ1  LYS  17           3HZ      LYS  17  -0.555  -1.220   9.209
  112    HZ2  LYS  17           1HZ      LYS  17   0.731  -0.698   8.338
  113    HZ3  LYS  17           2HZ      LYS  17   0.432  -2.294   8.482
  114    H    VAL  18           H        VAL  18   1.902   2.853   6.526
  115    HA   VAL  18           HA       VAL  18   2.709   3.204   3.681
  116    HB   VAL  18           HB       VAL  18   5.096   3.110   4.738
  117   HG11  VAL  18          1HG1      VAL  18   3.377   5.593   4.862
  118   HG12  VAL  18          2HG1      VAL  18   5.152   5.535   4.798
  119   HG13  VAL  18          3HG1      VAL  18   4.213   4.937   3.427
  120   HG21  VAL  18          3HG2      VAL  18   5.314   4.203   6.878
  121   HG22  VAL  18          1HG2      VAL  18   3.558   4.396   7.024
  122   HG23  VAL  18          2HG2      VAL  18   4.293   2.769   7.102
  123    H    PHE  19           H        PHE  19   3.852   1.765   2.604
  124    HA   PHE  19           HA       PHE  19   4.101  -1.018   3.658
  125    HB2  PHE  19           1HB      PHE  19   3.105  -0.150   0.924
  126    HB3  PHE  19           2HB      PHE  19   3.285  -1.798   1.482
  127    HD1  PHE  19           2HD      PHE  19   1.275   1.309   1.888
  128    HD2  PHE  19           1HD      PHE  19   1.636  -2.870   2.879
  129    HE1  PHE  19           2HE      PHE  19  -0.983   1.360   2.931
  130    HE2  PHE  19           1HE      PHE  19  -0.641  -2.830   3.872
  131    HZ   PHE  19           HZ       PHE  19  -1.929  -0.708   3.929
  132    H    LYS  20           H        LYS  20   5.601  -2.336   2.559
  133    HA   LYS  20           HA       LYS  20   8.093  -0.967   1.920
  134    HB2  LYS  20           1HB      LYS  20   7.384  -3.931   1.967
  135    HB3  LYS  20           2HB      LYS  20   9.018  -3.241   1.945
  136    HG2  LYS  20           1HG      LYS  20   8.461  -2.073   4.131
  137    HG3  LYS  20           2HG      LYS  20   6.931  -2.971   4.155
  138    HD2  LYS  20           1HD      LYS  20   8.225  -5.119   4.076
  139    HD3  LYS  20           2HD      LYS  20   9.735  -4.182   4.135
  140    HE2  LYS  20           1HE      LYS  20   9.023  -3.198   6.309
  141    HE3  LYS  20           2HE      LYS  20   7.534  -4.152   6.247
  142    HZ1  LYS  20           3HZ      LYS  20   9.224  -5.241   7.610
  143    HZ2  LYS  20           1HZ      LYS  20  10.278  -5.291   6.365
  144    HZ3  LYS  20           2HZ      LYS  20   8.901  -6.171   6.310
  145    H    PHE  21           H        PHE  21   5.605  -2.393  -0.015
  146    HA   PHE  21           HA       PHE  21   7.193  -2.043  -2.505
  147    HB2  PHE  21           1HB      PHE  21   5.441  -4.444  -1.848
  148    HB3  PHE  21           2HB      PHE  21   6.366  -4.180  -3.314
  149    HD1  PHE  21           2HD      PHE  21   8.952  -4.086  -3.138
  150    HD2  PHE  21           1HD      PHE  21   6.411  -5.547   0.026
  151    HE1  PHE  21           2HE      PHE  21  10.899  -5.221  -2.093
  152    HE2  PHE  21           1HE      PHE  21   8.365  -6.658   1.083
  153    HZ   PHE  21           HZ       PHE  21  10.611  -6.502   0.020
  154    H    LYS  22           H        LYS  22   5.949  -1.689  -4.385
  155    HA   LYS  22           HA       LYS  22   3.639  -0.060  -4.124
  156    HB2  LYS  22           1HB      LYS  22   5.194   0.014  -6.026
  157    HB3  LYS  22           2HB      LYS  22   4.716  -1.606  -6.526
  158    HG2  LYS  22           1HG      LYS  22   2.455  -0.874  -6.991
  159    HG3  LYS  22           2HG      LYS  22   2.775   0.750  -6.360
  160    HD2  LYS  22           1HD      LYS  22   4.453  -0.370  -8.633
  161    HD3  LYS  22           2HD      LYS  22   2.855   0.342  -8.951
  162    HE2  LYS  22           1HE      LYS  22   3.595   2.444  -7.846
  163    HE3  LYS  22           2HE      LYS  22   5.194   1.727  -7.582
  164    HZ1  LYS  22           3HZ      LYS  22   3.961   2.201 -10.246
  165    HZ2  LYS  22           1HZ      LYS  22   5.436   1.541 -10.003
  166    HZ3  LYS  22           2HZ      LYS  22   5.158   3.095  -9.593
  167    H    HIS  23           H        HIS  23   3.818  -3.490  -5.178
  168    HA   HIS  23           HA       HIS  23   1.040  -3.796  -5.622
  169    HB2  HIS  23           1HB      HIS  23   1.517  -6.230  -5.546
  170    HB3  HIS  23           2HB      HIS  23   2.609  -5.321  -6.580
  171    HD1  HIS  23           1HD      HIS  23   5.155  -5.738  -6.154
  172    HD2  HIS  23           2HD      HIS  23   2.625  -6.978  -3.024
  173    HE1  HIS  23           1HE      HIS  23   6.634  -6.964  -4.480
  174    H    SER  24           H        SER  24   2.801  -3.887  -2.610
  175    HA   SER  24           HA       SER  24   0.756  -5.188  -1.007
  176    HB2  SER  24           1HB      SER  24   3.067  -3.358  -0.269
  177    HB3  SER  24           2HB      SER  24   1.974  -4.120   0.886
  178    HG   SER  24           HG       SER  24   3.771  -5.458   0.613
  179    H    LEU  25           H        LEU  25   1.583  -1.731  -1.628
  180    HA   LEU  25           HA       LEU  25  -0.641  -0.671  -0.138
  181    HB2  LEU  25           1HB      LEU  25   1.223   0.766  -0.688
  182    HB3  LEU  25           2HB      LEU  25   1.062   0.422  -2.412
  183    HG   LEU  25           HG       LEU  25  -1.127   1.581  -2.476
  184   HD11  LEU  25          1HD1      LEU  25  -1.916   2.895  -0.609
  185   HD12  LEU  25          2HD1      LEU  25  -0.561   2.362   0.416
  186   HD13  LEU  25          3HD1      LEU  25  -1.825   1.223  -0.095
  187   HD21  LEU  25          3HD2      LEU  25  -0.302   3.840  -2.230
  188   HD22  LEU  25          1HD2      LEU  25   0.954   2.806  -2.935
  189   HD23  LEU  25          2HD2      LEU  25   1.040   3.272  -1.217
  190    H    GLN  26           H        GLN  26  -0.207  -1.561  -3.577
  191    HA   GLN  26           HA       GLN  26  -2.701  -0.501  -4.495
  192    HB2  GLN  26           1HB      GLN  26  -0.946  -2.721  -5.599
  193    HB3  GLN  26           2HB      GLN  26  -2.372  -2.129  -6.436
  194    HG2  GLN  26           1HG      GLN  26   0.005  -0.371  -5.680
  195    HG3  GLN  26           2HG      GLN  26  -0.235  -1.125  -7.252
  196   HE21  GLN  26          1HE2      GLN  26  -2.447  -0.520  -8.359
  197   HE22  GLN  26          2HE2      GLN  26  -2.932   1.155  -8.139
  198    H    ALA  27           H        ALA  27  -1.986  -3.693  -3.163
  199    HA   ALA  27           HA       ALA  27  -4.666  -4.773  -3.496
  200    HB1  ALA  27           1HB      ALA  27  -2.633  -6.152  -3.254
  201    HB2  ALA  27           2HB      ALA  27  -2.360  -5.467  -1.632
  202    HB3  ALA  27           3HB      ALA  27  -3.786  -6.489  -1.936
  203    H    HIS  28           H        HIS  28  -3.012  -2.973  -0.850
  204    HA   HIS  28           HA       HIS  28  -5.131  -3.203   1.074
  205    HB2  HIS  28           1HB      HIS  28  -2.983  -2.577   1.833
  206    HB3  HIS  28           2HB      HIS  28  -2.826  -1.276   0.668
  207    HD1  HIS  28           1HD      HIS  28  -4.711  -2.039   3.942
  208    HD2  HIS  28           2HD      HIS  28  -3.777   1.093   1.297
  209    HE1  HIS  28           1HE      HIS  28  -5.411   0.096   5.123
  210    H    LEU  29           H        LEU  29  -4.696  -0.972  -1.688
  211    HA   LEU  29           HA       LEU  29  -6.731   0.891  -1.079
  212    HB2  LEU  29           1HB      LEU  29  -6.142  -0.221  -3.845
  213    HB3  LEU  29           2HB      LEU  29  -6.905   1.318  -3.458
  214    HG   LEU  29           HG       LEU  29  -4.029   0.524  -2.972
  215   HD11  LEU  29          1HD1      LEU  29  -5.276   2.638  -4.744
  216   HD12  LEU  29          2HD1      LEU  29  -4.593   1.071  -5.269
  217   HD13  LEU  29          3HD1      LEU  29  -3.537   2.304  -4.558
  218   HD21  LEU  29          3HD2      LEU  29  -3.731   2.943  -2.251
  219   HD22  LEU  29          1HD2      LEU  29  -4.654   1.973  -1.101
  220   HD23  LEU  29          2HD2      LEU  29  -5.503   3.085  -2.193
  221    H    ARG  30           H        ARG  30  -7.134  -2.436  -2.086
  222    HA   ARG  30           HA       ARG  30  -9.778  -2.311  -3.123
  223    HB2  ARG  30           1HB      ARG  30  -8.448  -4.641  -1.736
  224    HB3  ARG  30           2HB      ARG  30  -9.894  -4.679  -2.756
  225    HG2  ARG  30           1HG      ARG  30  -8.541  -3.778  -4.684
  226    HG3  ARG  30           2HG      ARG  30  -7.104  -3.837  -3.671
  227    HD2  ARG  30           1HD      ARG  30  -7.079  -5.788  -4.991
  228    HD3  ARG  30           2HD      ARG  30  -7.483  -6.274  -3.328
  229    HE   ARG  30           HE       ARG  30  -9.881  -5.827  -4.863
  230   HH11  ARG  30          2HH1      ARG  30  -7.346  -8.229  -4.582
  231   HH12  ARG  30          1HH1      ARG  30  -8.375  -9.514  -5.155
  232   HH21  ARG  30          1HH2      ARG  30 -11.141  -7.512  -5.576
  233   HH22  ARG  30          2HH2      ARG  30 -10.466  -9.109  -5.704
  234    H    ILE  31           H        ILE  31  -8.817  -1.959   0.197
  235    HA   ILE  31           HA       ILE  31 -11.522  -2.522   1.226
  236    HB   ILE  31           HB       ILE  31 -10.784  -2.095   3.339
  237   HG12  ILE  31          1HG1      ILE  31  -8.412  -0.538   2.277
  238   HG13  ILE  31          2HG1      ILE  31  -9.790   0.074   3.176
  239   HG21  ILE  31          1HG2      ILE  31  -8.935  -3.591   3.655
  240   HG22  ILE  31          2HG2      ILE  31  -9.808  -4.135   2.222
  241   HG23  ILE  31          3HG2      ILE  31  -8.280  -3.244   2.044
  242   HD11  ILE  31          3HD1      ILE  31  -7.606  -1.723   4.268
  243   HD12  ILE  31          1HD1      ILE  31  -7.945  -0.033   4.674
  244   HD13  ILE  31          2HD1      ILE  31  -9.095  -1.296   5.151
  245    H    HIS  32           H        HIS  32  -9.774   0.214  -0.003
  246    HA   HIS  32           HA       HIS  32 -11.621   2.242   1.053
  247    HB2  HIS  32           1HB      HIS  32  -9.083   2.362  -0.627
  248    HB3  HIS  32           2HB      HIS  32  -9.976   3.757  -0.085
  249    HD1  HIS  32           1HD      HIS  32 -10.308   3.623   2.869
  250    HD2  HIS  32           2HD      HIS  32  -7.013   1.968   0.859
  251    HE1  HIS  32           1HE      HIS  32  -8.431   3.535   4.578
  252    H    THR  33           H        THR  33 -11.052   0.513  -2.000
  253    HA   THR  33           HA       THR  33 -12.622   2.265  -3.686
  254    HB   THR  33           HB       THR  33 -12.776   0.292  -5.194
  255    HG1  THR  33           1HG      THR  33 -11.806  -1.590  -4.619
  256   HG21  THR  33          3HG2      THR  33  -9.959   0.756  -4.129
  257   HG22  THR  33          1HG2      THR  33 -10.789   1.749  -5.346
  258   HG23  THR  33          2HG2      THR  33 -10.391   0.054  -5.697
  259    H    ASN  34           H        ASN  34 -13.503  -0.232  -1.404
  260    HA   ASN  34           HA       ASN  34 -16.312  -0.324  -2.335
  261    HB2  ASN  34           1HB      ASN  34 -15.040  -2.422  -1.909
  262    HB3  ASN  34           2HB      ASN  34 -14.840  -1.947  -0.219
  263   HD21  ASN  34          1HD2      ASN  34 -17.474  -2.403  -2.674
  264   HD22  ASN  34          2HD2      ASN  34 -18.578  -3.121  -1.513
  265    H    GLU  35           H        GLU  35 -18.095   0.016  -0.880
  266    HA   GLU  35           HA       GLU  35 -17.745   2.384   0.753
  267    HB2  GLU  35           1HB      GLU  35 -20.144   2.376   0.974
  268    HB3  GLU  35           2HB      GLU  35 -19.668   2.125  -0.704
  269    HG2  GLU  35           1HG      GLU  35 -20.103  -0.328  -0.444
  270    HG3  GLU  35           2HG      GLU  35 -20.617  -0.046   1.221
  271    H    LYS  36           H        LYS  36 -18.458   2.715   2.913
  272    HA   LYS  36           HA       LYS  36 -18.554   0.401   4.757
  273    HB2  LYS  36           1HB      LYS  36 -16.150   1.211   4.391
  274    HB3  LYS  36           2HB      LYS  36 -16.600   2.697   5.212
  275    HG2  LYS  36           1HG      LYS  36 -16.818  -0.110   6.405
  276    HG3  LYS  36           2HG      LYS  36 -15.424   0.953   6.589
  277    HD2  LYS  36           1HD      LYS  36 -16.892   2.646   7.723
  278    HD3  LYS  36           2HD      LYS  36 -18.220   1.463   7.675
  279    HE2  LYS  36           1HE      LYS  36 -16.831  -0.157   8.933
  280    HE3  LYS  36           2HE      LYS  36 -15.515   1.022   9.001
  281    HZ1  LYS  36           3HZ      LYS  36 -16.987   2.492  10.274
  282    HZ2  LYS  36           1HZ      LYS  36 -16.840   1.056  11.035
  283    HZ3  LYS  36           2HZ      LYS  36 -18.204   1.403  10.210
  Start of MODEL   19
    1    H1   GLY   1           1H       GLY   1  19.244  -6.824   6.988
    2    H2   GLY   1           2H       GLY   1  18.152  -7.798   6.254
    3    H3   GLY   1           3H       GLY   1  17.888  -7.279   7.786
    4    HA2  GLY   1           1HA      GLY   1  16.488  -6.056   6.269
    5    HA3  GLY   1           2HA      GLY   1  17.679  -4.999   7.048
    6    H    SER   2           H        SER   2  17.440  -3.523   5.271
    7    HA   SER   2           HA       SER   2  18.251  -4.312   2.557
    8    HB2  SER   2           1HB      SER   2  17.674  -1.584   3.771
    9    HB3  SER   2           2HB      SER   2  18.046  -1.887   2.067
   10    HG   SER   2           HG       SER   2  15.844  -2.983   3.524
   11    H    SER   3           H        SER   3  20.092  -3.678   1.456
   12    HA   SER   3           HA       SER   3  22.377  -2.501   2.984
   13    HB2  SER   3           1HB      SER   3  22.493  -4.958   1.192
   14    HB3  SER   3           2HB      SER   3  23.893  -4.105   1.869
   15    HG   SER   3           HG       SER   3  23.274  -5.924   3.138
   16    H    GLY   4           H        GLY   4  23.600  -1.071   1.868
   17    HA2  GLY   4           1HA      GLY   4  24.405   0.262   0.179
   18    HA3  GLY   4           2HA      GLY   4  23.753  -0.870  -1.002
   19    H    SER   5           H        SER   5  21.074  -0.117   0.682
   20    HA   SER   5           HA       SER   5  20.430   2.523  -0.502
   21    HB2  SER   5           1HB      SER   5  18.868  -0.038  -1.058
   22    HB3  SER   5           2HB      SER   5  18.258   1.595  -1.363
   23    HG   SER   5           HG       SER   5  20.588   0.436  -2.527
   24    H    SER   6           H        SER   6  18.677   3.558   0.495
   25    HA   SER   6           HA       SER   6  18.318   2.886   3.290
   26    HB2  SER   6           1HB      SER   6  17.171   5.204   1.704
   27    HB3  SER   6           2HB      SER   6  17.303   5.081   3.469
   28    HG   SER   6           HG       SER   6  19.022   6.302   2.556
   29    H    GLY   7           H        GLY   7  16.787   1.269   1.119
   30    HA2  GLY   7           1HA      GLY   7  14.787   0.056   1.162
   31    HA3  GLY   7           2HA      GLY   7  14.235   1.001   2.542
   32    H    LYS   8           H        LYS   8  12.284   0.608   1.169
   33    HA   LYS   8           HA       LYS   8  11.652   3.076  -0.367
   34    HB2  LYS   8           1HB      LYS   8  10.972   0.208  -1.163
   35    HB3  LYS   8           2HB      LYS   8  10.133   1.604  -1.822
   36    HG2  LYS   8           1HG      LYS   8  13.126   1.109  -2.126
   37    HG3  LYS   8           2HG      LYS   8  11.888   0.670  -3.304
   38    HD2  LYS   8           1HD      LYS   8  11.228   3.074  -3.518
   39    HD3  LYS   8           2HD      LYS   8  12.483   3.508  -2.353
   40    HE2  LYS   8           1HE      LYS   8  13.357   3.969  -4.503
   41    HE3  LYS   8           2HE      LYS   8  14.220   2.569  -3.860
   42    HZ1  LYS   8           3HZ      LYS   8  13.577   2.266  -6.193
   43    HZ2  LYS   8           1HZ      LYS   8  11.998   2.447  -5.839
   44    HZ3  LYS   8           2HZ      LYS   8  12.824   1.151  -5.277
   45    H    ILE   9           H        ILE   9   9.654   3.843  -0.114
   46    HA   ILE   9           HA       ILE   9   7.682   2.315   1.464
   47    HB   ILE   9           HB       ILE   9   6.862   4.270   2.640
   48   HG12  ILE   9          1HG1      ILE   9   9.431   5.728   1.904
   49   HG13  ILE   9          2HG1      ILE   9   7.894   6.020   1.093
   50   HG21  ILE   9          1HG2      ILE   9   9.774   3.675   3.300
   51   HG22  ILE   9          2HG2      ILE   9   8.505   4.209   4.422
   52   HG23  ILE   9          3HG2      ILE   9   8.401   2.612   3.679
   53   HD11  ILE   9          3HD1      ILE   9   8.208   7.697   2.798
   54   HD12  ILE   9          1HD1      ILE   9   6.840   6.660   3.240
   55   HD13  ILE   9          2HD1      ILE   9   8.414   6.467   4.054
   56    H    PHE  10           H        PHE  10   5.630   2.476   0.917
   57    HA   PHE  10           HA       PHE  10   4.720   4.356  -1.233
   58    HB2  PHE  10           1HB      PHE  10   4.203   1.376  -0.859
   59    HB3  PHE  10           2HB      PHE  10   3.166   2.401  -1.827
   60    HD1  PHE  10           2HD      PHE  10   6.635   1.051  -1.575
   61    HD2  PHE  10           1HD      PHE  10   3.749   3.125  -4.023
   62    HE1  PHE  10           2HE      PHE  10   8.091   0.730  -3.564
   63    HE2  PHE  10           1HE      PHE  10   5.193   2.782  -6.012
   64    HZ   PHE  10           HZ       PHE  10   7.326   1.542  -5.803
   65    H    THR  11           H        THR  11   3.097   5.639  -0.498
   66    HA   THR  11           HA       THR  11   1.822   4.945   2.105
   67    HB   THR  11           HB       THR  11   1.929   7.695   0.854
   68    HG1  THR  11           1HG      THR  11   3.776   8.048   2.043
   69   HG21  THR  11          3HG2      THR  11   1.866   8.334   3.309
   70   HG22  THR  11          1HG2      THR  11   1.591   6.623   3.696
   71   HG23  THR  11          2HG2      THR  11   0.401   7.536   2.720
   72    H    CYS  12           H        CYS  12  -0.296   4.757   2.387
   73    HA   CYS  12           HA       CYS  12  -2.216   4.809   0.251
   74    HB2  CYS  12           1HB      CYS  12  -2.272   3.355   2.247
   75    HB3  CYS  12           2HB      CYS  12  -2.490   4.785   3.277
   76    H    GLU  13           H        GLU  13  -3.396   6.428  -0.543
   77    HA   GLU  13           HA       GLU  13  -3.091   9.124   0.572
   78    HB2  GLU  13           1HB      GLU  13  -4.305   9.889  -1.366
   79    HB3  GLU  13           2HB      GLU  13  -3.046   8.757  -1.856
   80    HG2  GLU  13           1HG      GLU  13  -4.763   6.959  -2.070
   81    HG3  GLU  13           2HG      GLU  13  -6.016   8.120  -1.610
   82    H    TYR  14           H        TYR  14  -5.158   6.545   1.242
   83    HA   TYR  14           HA       TYR  14  -7.529   8.220   1.885
   84    HB2  TYR  14           1HB      TYR  14  -7.162   5.220   1.764
   85    HB3  TYR  14           2HB      TYR  14  -8.667   6.054   2.067
   86    HD1  TYR  14           1HD      TYR  14  -9.730   7.436   0.244
   87    HD2  TYR  14           2HD      TYR  14  -6.302   4.907  -0.486
   88    HE1  TYR  14           1HE      TYR  14 -10.210   7.485  -2.198
   89    HE2  TYR  14           2HE      TYR  14  -6.791   4.964  -2.928
   90    HH   TYR  14           HH       TYR  14  -9.572   6.773  -4.279
   91    H    CYS  15           H        CYS  15  -5.164   6.097   3.508
   92    HA   CYS  15           HA       CYS  15  -6.116   7.158   6.121
   93    HB2  CYS  15           1HB      CYS  15  -6.018   5.034   7.189
   94    HB3  CYS  15           2HB      CYS  15  -7.143   4.982   5.839
   95    H    ASN  16           H        ASN  16  -3.520   7.037   4.140
   96    HA   ASN  16           HA       ASN  16  -1.317   7.368   4.309
   97    HB2  ASN  16           1HB      ASN  16  -1.869   8.671   6.962
   98    HB3  ASN  16           2HB      ASN  16  -0.546   8.999   5.842
   99   HD21  ASN  16          1HD2      ASN  16  -2.021   9.129   3.348
  100   HD22  ASN  16          2HD2      ASN  16  -2.999  10.582   3.487
  101    H    LYS  17           H        LYS  17  -2.180   4.782   5.282
  102    HA   LYS  17           HA       LYS  17  -0.034   3.879   7.063
  103    HB2  LYS  17           1HB      LYS  17  -2.239   2.719   6.892
  104    HB3  LYS  17           2HB      LYS  17  -1.888   2.307   5.212
  105    HG2  LYS  17           1HG      LYS  17  -0.013   0.910   5.876
  106    HG3  LYS  17           2HG      LYS  17  -0.120   1.476   7.555
  107    HD2  LYS  17           1HD      LYS  17  -2.273   0.367   7.857
  108    HD3  LYS  17           2HD      LYS  17  -2.364  -0.019   6.140
  109    HE2  LYS  17           1HE      LYS  17  -1.726  -2.022   7.280
  110    HE3  LYS  17           2HE      LYS  17  -0.334  -1.457   6.351
  111    HZ1  LYS  17           3HZ      LYS  17   0.277  -2.143   8.611
  112    HZ2  LYS  17           1HZ      LYS  17  -0.715  -1.033   9.273
  113    HZ3  LYS  17           2HZ      LYS  17   0.597  -0.557   8.417
  114    H    VAL  18           H        VAL  18   1.858   2.885   6.432
  115    HA   VAL  18           HA       VAL  18   2.676   3.224   3.588
  116    HB   VAL  18           HB       VAL  18   5.052   3.196   4.634
  117   HG11  VAL  18          1HG1      VAL  18   4.088   5.041   3.376
  118   HG12  VAL  18          2HG1      VAL  18   3.264   5.630   4.842
  119   HG13  VAL  18          3HG1      VAL  18   5.037   5.629   4.747
  120   HG21  VAL  18          3HG2      VAL  18   3.509   4.419   6.952
  121   HG22  VAL  18          1HG2      VAL  18   4.274   2.805   7.006
  122   HG23  VAL  18          2HG2      VAL  18   5.266   4.260   6.790
  123    H    PHE  19           H        PHE  19   3.691   1.742   2.494
  124    HA   PHE  19           HA       PHE  19   4.134  -0.979   3.656
  125    HB2  PHE  19           1HB      PHE  19   3.092  -0.338   0.884
  126    HB3  PHE  19           2HB      PHE  19   3.306  -1.922   1.581
  127    HD1  PHE  19           2HD      PHE  19   1.236   1.170   1.782
  128    HD2  PHE  19           1HD      PHE  19   1.653  -2.949   2.968
  129    HE1  PHE  19           2HE      PHE  19  -0.997   1.265   2.881
  130    HE2  PHE  19           1HE      PHE  19  -0.603  -2.875   4.012
  131    HZ   PHE  19           HZ       PHE  19  -1.899  -0.759   4.005
  132    H    LYS  20           H        LYS  20   5.603  -2.301   2.369
  133    HA   LYS  20           HA       LYS  20   8.085  -0.879   1.844
  134    HB2  LYS  20           1HB      LYS  20   7.254  -3.808   1.622
  135    HB3  LYS  20           2HB      LYS  20   8.921  -3.242   1.495
  136    HG2  LYS  20           1HG      LYS  20   7.157  -2.767   3.941
  137    HG3  LYS  20           2HG      LYS  20   8.213  -4.175   3.742
  138    HD2  LYS  20           1HD      LYS  20  10.160  -2.631   3.403
  139    HD3  LYS  20           2HD      LYS  20   9.127  -1.260   3.816
  140    HE2  LYS  20           1HE      LYS  20   9.697  -3.659   5.620
  141    HE3  LYS  20           2HE      LYS  20  10.551  -2.118   5.704
  142    HZ1  LYS  20           3HZ      LYS  20   8.781  -2.194   7.338
  143    HZ2  LYS  20           1HZ      LYS  20   7.644  -2.477   6.207
  144    HZ3  LYS  20           2HZ      LYS  20   8.430  -1.039   6.244
  145    H    PHE  21           H        PHE  21   5.668  -2.331  -0.237
  146    HA   PHE  21           HA       PHE  21   7.231  -1.615  -2.673
  147    HB2  PHE  21           1HB      PHE  21   5.885  -4.278  -2.069
  148    HB3  PHE  21           2HB      PHE  21   6.594  -3.825  -3.609
  149    HD1  PHE  21           2HD      PHE  21   9.097  -3.365  -3.763
  150    HD2  PHE  21           1HD      PHE  21   7.266  -5.146  -0.289
  151    HE1  PHE  21           2HE      PHE  21  11.317  -4.194  -3.016
  152    HE2  PHE  21           1HE      PHE  21   9.486  -5.975   0.456
  153    HZ   PHE  21           HZ       PHE  21  11.515  -5.500  -0.906
  154    H    LYS  22           H        LYS  22   5.978  -1.552  -4.628
  155    HA   LYS  22           HA       LYS  22   3.670   0.034  -4.405
  156    HB2  LYS  22           1HB      LYS  22   5.251  -0.063  -6.359
  157    HB3  LYS  22           2HB      LYS  22   4.564  -1.627  -6.807
  158    HG2  LYS  22           1HG      LYS  22   2.339  -0.578  -7.026
  159    HG3  LYS  22           2HG      LYS  22   3.004   0.986  -6.544
  160    HD2  LYS  22           1HD      LYS  22   2.743   0.979  -8.938
  161    HD3  LYS  22           2HD      LYS  22   4.470   0.987  -8.556
  162    HE2  LYS  22           1HE      LYS  22   4.581  -1.459  -8.992
  163    HE3  LYS  22           2HE      LYS  22   2.842  -1.487  -9.317
  164    HZ1  LYS  22           3HZ      LYS  22   4.849   0.029 -10.906
  165    HZ2  LYS  22           1HZ      LYS  22   3.243   0.000 -11.210
  166    HZ3  LYS  22           2HZ      LYS  22   4.130  -1.359 -11.373
  167    H    HIS  23           H        HIS  23   3.787  -3.403  -5.398
  168    HA   HIS  23           HA       HIS  23   0.999  -3.710  -5.719
  169    HB2  HIS  23           1HB      HIS  23   1.413  -6.070  -5.811
  170    HB3  HIS  23           2HB      HIS  23   2.738  -5.246  -6.620
  171    HD1  HIS  23           1HD      HIS  23   2.043  -7.569  -3.704
  172    HD2  HIS  23           2HD      HIS  23   5.165  -5.199  -5.235
  173    HE1  HIS  23           1HE      HIS  23   4.165  -8.319  -2.507
  174    H    SER  24           H        SER  24   2.904  -3.821  -2.799
  175    HA   SER  24           HA       SER  24   0.990  -5.121  -1.064
  176    HB2  SER  24           1HB      SER  24   3.160  -3.095  -0.414
  177    HB3  SER  24           2HB      SER  24   2.248  -4.046   0.752
  178    HG   SER  24           HG       SER  24   3.162  -5.935  -0.154
  179    H    LEU  25           H        LEU  25   1.655  -1.651  -1.725
  180    HA   LEU  25           HA       LEU  25  -0.543  -0.651  -0.152
  181    HB2  LEU  25           1HB      LEU  25   1.292   0.818  -0.734
  182    HB3  LEU  25           2HB      LEU  25   1.087   0.492  -2.456
  183    HG   LEU  25           HG       LEU  25  -1.115   1.630  -2.444
  184   HD11  LEU  25          1HD1      LEU  25  -0.466   2.406   0.432
  185   HD12  LEU  25          2HD1      LEU  25  -1.719   1.237  -0.037
  186   HD13  LEU  25          3HD1      LEU  25  -1.867   2.909  -0.544
  187   HD21  LEU  25          3HD2      LEU  25   1.083   3.326  -1.245
  188   HD22  LEU  25          1HD2      LEU  25  -0.299   3.894  -2.202
  189   HD23  LEU  25          2HD2      LEU  25   0.939   2.878  -2.963
  190    H    GLN  26           H        GLN  26  -0.181  -1.509  -3.592
  191    HA   GLN  26           HA       GLN  26  -2.706  -0.472  -4.463
  192    HB2  GLN  26           1HB      GLN  26  -0.875  -2.597  -5.605
  193    HB3  GLN  26           2HB      GLN  26  -2.352  -2.120  -6.422
  194    HG2  GLN  26           1HG      GLN  26  -0.167  -0.133  -5.652
  195    HG3  GLN  26           2HG      GLN  26  -0.236  -0.951  -7.207
  196   HE21  GLN  26          1HE2      GLN  26  -0.303   1.909  -6.902
  197   HE22  GLN  26          2HE2      GLN  26  -1.877   2.427  -7.486
  198    H    ALA  27           H        ALA  27  -1.912  -3.656  -3.151
  199    HA   ALA  27           HA       ALA  27  -4.579  -4.781  -3.439
  200    HB1  ALA  27           1HB      ALA  27  -2.523  -6.127  -3.220
  201    HB2  ALA  27           2HB      ALA  27  -2.236  -5.428  -1.607
  202    HB3  ALA  27           3HB      ALA  27  -3.651  -6.472  -1.883
  203    H    HIS  28           H        HIS  28  -2.917  -2.931  -0.829
  204    HA   HIS  28           HA       HIS  28  -5.007  -3.204   1.128
  205    HB2  HIS  28           1HB      HIS  28  -2.886  -2.522   1.884
  206    HB3  HIS  28           2HB      HIS  28  -2.738  -1.244   0.692
  207    HD1  HIS  28           1HD      HIS  28  -4.647  -1.962   3.966
  208    HD2  HIS  28           2HD      HIS  28  -3.708   1.131   1.276
  209    HE1  HIS  28           1HE      HIS  28  -5.369   0.188   5.104
  210    H    LEU  29           H        LEU  29  -4.643  -0.962  -1.636
  211    HA   LEU  29           HA       LEU  29  -6.706   0.859  -1.004
  212    HB2  LEU  29           1HB      LEU  29  -6.126  -0.227  -3.780
  213    HB3  LEU  29           2HB      LEU  29  -6.902   1.301  -3.375
  214    HG   LEU  29           HG       LEU  29  -4.016   0.533  -2.909
  215   HD11  LEU  29          1HD1      LEU  29  -4.632   1.088  -5.204
  216   HD12  LEU  29          2HD1      LEU  29  -3.526   2.287  -4.507
  217   HD13  LEU  29          3HD1      LEU  29  -5.262   2.666  -4.657
  218   HD21  LEU  29          3HD2      LEU  29  -4.645   1.970  -1.030
  219   HD22  LEU  29          1HD2      LEU  29  -5.513   3.077  -2.114
  220   HD23  LEU  29          2HD2      LEU  29  -3.739   2.956  -2.180
  221    H    ARG  30           H        ARG  30  -7.062  -2.471  -1.998
  222    HA   ARG  30           HA       ARG  30  -9.719  -2.421  -2.999
  223    HB2  ARG  30           1HB      ARG  30  -8.321  -4.695  -1.590
  224    HB3  ARG  30           2HB      ARG  30  -9.781  -4.781  -2.588
  225    HG2  ARG  30           1HG      ARG  30  -8.510  -3.928  -4.557
  226    HG3  ARG  30           2HG      ARG  30  -7.045  -3.857  -3.585
  227    HD2  ARG  30           1HD      ARG  30  -6.951  -5.874  -4.833
  228    HD3  ARG  30           2HD      ARG  30  -7.222  -6.275  -3.136
  229    HE   ARG  30           HE       ARG  30  -9.300  -7.174  -3.654
  230   HH11  ARG  30          2HH1      ARG  30  -8.202  -5.479  -6.523
  231   HH12  ARG  30          1HH1      ARG  30  -9.482  -6.138  -7.505
  232   HH21  ARG  30          2HH2      ARG  30 -10.901  -7.964  -4.963
  233   HH22  ARG  30          1HH2      ARG  30 -10.963  -7.507  -6.639
  234    H    ILE  31           H        ILE  31  -8.715  -1.991   0.302
  235    HA   ILE  31           HA       ILE  31 -11.390  -2.599   1.383
  236    HB   ILE  31           HB       ILE  31 -10.628  -2.135   3.475
  237   HG12  ILE  31          1HG1      ILE  31  -8.287  -0.553   2.379
  238   HG13  ILE  31          2HG1      ILE  31  -9.677   0.057   3.262
  239   HG21  ILE  31          1HG2      ILE  31  -9.628  -4.167   2.367
  240   HG22  ILE  31          2HG2      ILE  31  -8.121  -3.248   2.155
  241   HG23  ILE  31          3HG2      ILE  31  -8.743  -3.591   3.780
  242   HD11  ILE  31          3HD1      ILE  31  -7.844   0.001   4.774
  243   HD12  ILE  31          1HD1      ILE  31  -8.976  -1.273   5.261
  244   HD13  ILE  31          2HD1      ILE  31  -7.475  -1.690   4.396
  245    H    HIS  32           H        HIS  32  -9.734   0.153   0.080
  246    HA   HIS  32           HA       HIS  32 -11.606   2.157   1.141
  247    HB2  HIS  32           1HB      HIS  32  -9.103   2.306  -0.589
  248    HB3  HIS  32           2HB      HIS  32 -10.017   3.690  -0.059
  249    HD1  HIS  32           1HD      HIS  32 -10.291   3.608   2.907
  250    HD2  HIS  32           2HD      HIS  32  -7.000   1.986   0.866
  251    HE1  HIS  32           1HE      HIS  32  -8.382   3.587   4.583
  252    H    THR  33           H        THR  33 -11.106   0.346  -1.858
  253    HA   THR  33           HA       THR  33 -12.678   2.072  -3.571
  254    HB   THR  33           HB       THR  33 -12.749   0.092  -5.086
  255    HG1  THR  33           1HG      THR  33 -11.744  -1.758  -4.490
  256   HG21  THR  33          3HG2      THR  33  -9.976   0.674  -3.978
  257   HG22  THR  33          1HG2      THR  33 -10.821   1.603  -5.231
  258   HG23  THR  33          2HG2      THR  33 -10.347  -0.081  -5.536
  259    H    ASN  34           H        ASN  34 -13.684  -0.009  -1.065
  260    HA   ASN  34           HA       ASN  34 -16.452  -0.238  -2.167
  261    HB2  ASN  34           1HB      ASN  34 -15.205  -2.370  -2.354
  262    HB3  ASN  34           2HB      ASN  34 -14.830  -2.315  -0.630
  263   HD21  ASN  34          1HD2      ASN  34 -17.605  -2.430  -2.931
  264   HD22  ASN  34          2HD2      ASN  34 -18.649  -3.291  -1.812
  265    H    GLU  35           H        GLU  35 -18.169  -0.293  -0.660
  266    HA   GLU  35           HA       GLU  35 -17.637   0.330   2.177
  267    HB2  GLU  35           1HB      GLU  35 -17.804   2.516   0.991
  268    HB3  GLU  35           2HB      GLU  35 -19.412   2.069   0.411
  269    HG2  GLU  35           1HG      GLU  35 -20.243   1.979   2.734
  270    HG3  GLU  35           2HG      GLU  35 -18.617   2.286   3.349
  271    H    LYS  36           H        LYS  36 -19.222  -0.407   3.555
  272    HA   LYS  36           HA       LYS  36 -21.730  -1.594   2.525
  273    HB2  LYS  36           1HB      LYS  36 -19.976  -3.373   2.431
  274    HB3  LYS  36           2HB      LYS  36 -19.696  -3.168   4.167
  275    HG2  LYS  36           1HG      LYS  36 -22.048  -3.834   4.619
  276    HG3  LYS  36           2HG      LYS  36 -22.340  -3.992   2.875
  277    HD2  LYS  36           1HD      LYS  36 -20.579  -5.744   2.751
  278    HD3  LYS  36           2HD      LYS  36 -20.328  -5.632   4.495
  279    HE2  LYS  36           1HE      LYS  36 -22.957  -6.394   3.135
  280    HE3  LYS  36           2HE      LYS  36 -21.775  -7.552   3.747
  281    HZ1  LYS  36           3HZ      LYS  36 -23.517  -7.184   5.371
  282    HZ2  LYS  36           1HZ      LYS  36 -23.237  -5.579   5.418
  283    HZ3  LYS  36           2HZ      LYS  36 -22.111  -6.626   5.979
  Start of MODEL   20
    1    H1   GLY   1           1H       GLY   1  12.976   3.818 -13.234
    2    H2   GLY   1           2H       GLY   1  13.881   2.520 -12.814
    3    H3   GLY   1           3H       GLY   1  14.439   4.031 -12.526
    4    HA2  GLY   1           1HA      GLY   1  12.673   4.451 -10.939
    5    HA3  GLY   1           2HA      GLY   1  12.084   2.807 -11.244
    6    H    SER   2           H        SER   2  12.343   2.504  -8.917
    7    HA   SER   2           HA       SER   2  14.990   1.392  -8.248
    8    HB2  SER   2           1HB      SER   2  14.986   3.786  -7.446
    9    HB3  SER   2           2HB      SER   2  13.635   3.366  -6.373
   10    HG   SER   2           HG       SER   2  15.723   3.193  -5.363
   11    H    SER   3           H        SER   3  14.927  -0.142  -6.548
   12    HA   SER   3           HA       SER   3  12.514  -1.727  -6.512
   13    HB2  SER   3           1HB      SER   3  15.096  -2.061  -4.943
   14    HB3  SER   3           2HB      SER   3  13.822  -3.281  -5.130
   15    HG   SER   3           HG       SER   3  15.542  -3.567  -6.640
   16    H    GLY   4           H        GLY   4  11.142  -2.275  -4.844
   17    HA2  GLY   4           1HA      GLY   4  10.623  -0.460  -2.671
   18    HA3  GLY   4           2HA      GLY   4   9.938  -2.066  -2.873
   19    H    SER   5           H        SER   5  10.579  -1.090  -0.412
   20    HA   SER   5           HA       SER   5  11.625  -1.312   1.526
   21    HB2  SER   5           1HB      SER   5  12.387  -3.401   2.250
   22    HB3  SER   5           2HB      SER   5  11.124  -3.713   1.055
   23    HG   SER   5           HG       SER   5  12.951  -3.898  -0.488
   24    H    SER   6           H        SER   6  13.875  -1.321  -1.141
   25    HA   SER   6           HA       SER   6  16.260  -0.911   0.429
   26    HB2  SER   6           1HB      SER   6  15.703  -0.385  -2.512
   27    HB3  SER   6           2HB      SER   6  17.303  -0.376  -1.740
   28    HG   SER   6           HG       SER   6  16.884  -2.402  -2.676
   29    H    GLY   7           H        GLY   7  14.859   0.766   1.721
   30    HA2  GLY   7           1HA      GLY   7  14.829   2.955   2.527
   31    HA3  GLY   7           2HA      GLY   7  15.728   3.508   1.112
   32    H    LYS   8           H        LYS   8  13.452   1.937  -0.449
   33    HA   LYS   8           HA       LYS   8  11.640   4.210  -0.820
   34    HB2  LYS   8           1HB      LYS   8  12.468   3.021  -2.770
   35    HB3  LYS   8           2HB      LYS   8  11.895   1.485  -2.128
   36    HG2  LYS   8           1HG      LYS   8  10.460   2.245  -3.929
   37    HG3  LYS   8           2HG      LYS   8   9.568   2.158  -2.414
   38    HD2  LYS   8           1HD      LYS   8   9.811   4.654  -2.172
   39    HD3  LYS   8           2HD      LYS   8  10.624   4.702  -3.745
   40    HE2  LYS   8           1HE      LYS   8   8.663   4.003  -4.904
   41    HE3  LYS   8           2HE      LYS   8   7.914   3.378  -3.429
   42    HZ1  LYS   8           3HZ      LYS   8   7.584   5.564  -2.622
   43    HZ2  LYS   8           1HZ      LYS   8   6.949   5.505  -4.126
   44    HZ3  LYS   8           2HZ      LYS   8   8.378   6.266  -3.886
   45    H    ILE   9           H        ILE   9   9.658   4.421  -0.119
   46    HA   ILE   9           HA       ILE   9   8.100   2.139   0.966
   47    HB   ILE   9           HB       ILE   9   7.055   3.702   2.601
   48   HG12  ILE   9          1HG1      ILE   9   9.477   5.512   2.265
   49   HG13  ILE   9          2HG1      ILE   9   7.982   5.820   1.382
   50   HG21  ILE   9          1HG2      ILE   9   8.751   2.017   3.237
   51   HG22  ILE   9          2HG2      ILE   9  10.034   3.229   3.031
   52   HG23  ILE   9          3HG2      ILE   9   8.797   3.439   4.287
   53   HD11  ILE   9          3HD1      ILE   9   8.079   7.143   3.436
   54   HD12  ILE   9          1HD1      ILE   9   6.712   6.019   3.441
   55   HD13  ILE   9          2HD1      ILE   9   8.164   5.664   4.414
   56    H    PHE  10           H        PHE  10   5.826   2.440   0.895
   57    HA   PHE  10           HA       PHE  10   4.780   4.386  -1.132
   58    HB2  PHE  10           1HB      PHE  10   4.149   1.424  -0.785
   59    HB3  PHE  10           2HB      PHE  10   3.210   2.524  -1.771
   60    HD1  PHE  10           2HD      PHE  10   6.487   0.800  -1.469
   61    HD2  PHE  10           1HD      PHE  10   3.978   3.290  -3.939
   62    HE1  PHE  10           2HE      PHE  10   7.945   0.327  -3.428
   63    HE2  PHE  10           1HE      PHE  10   5.436   2.820  -5.892
   64    HZ   PHE  10           HZ       PHE  10   7.387   1.306  -5.654
   65    H    THR  11           H        THR  11   2.961   5.497  -0.456
   66    HA   THR  11           HA       THR  11   1.857   4.814   2.250
   67    HB   THR  11           HB       THR  11   1.958   7.564   0.987
   68    HG1  THR  11           1HG      THR  11   3.769   7.934   2.217
   69   HG21  THR  11          3HG2      THR  11   1.823   8.224   3.429
   70   HG22  THR  11          1HG2      THR  11   1.563   6.510   3.827
   71   HG23  THR  11          2HG2      THR  11   0.383   7.404   2.815
   72    H    CYS  12           H        CYS  12  -0.279   4.649   2.555
   73    HA   CYS  12           HA       CYS  12  -2.184   4.658   0.401
   74    HB2  CYS  12           1HB      CYS  12  -2.277   3.234   2.414
   75    HB3  CYS  12           2HB      CYS  12  -2.494   4.677   3.423
   76    H    GLU  13           H        GLU  13  -3.344   6.303  -0.450
   77    HA   GLU  13           HA       GLU  13  -2.991   9.017   0.482
   78    HB2  GLU  13           1HB      GLU  13  -3.025   8.580  -1.854
   79    HB3  GLU  13           2HB      GLU  13  -4.365   7.454  -1.724
   80    HG2  GLU  13           1HG      GLU  13  -5.093   9.343  -2.867
   81    HG3  GLU  13           2HG      GLU  13  -5.941   9.195  -1.337
   82    H    TYR  14           H        TYR  14  -5.141   6.415   1.230
   83    HA   TYR  14           HA       TYR  14  -7.450   8.151   1.874
   84    HB2  TYR  14           1HB      TYR  14  -7.146   5.147   1.702
   85    HB3  TYR  14           2HB      TYR  14  -8.645   6.006   1.973
   86    HD1  TYR  14           1HD      TYR  14  -9.537   7.550   0.148
   87    HD2  TYR  14           2HD      TYR  14  -6.279   4.791  -0.529
   88    HE1  TYR  14           1HE      TYR  14  -9.898   7.721  -2.309
   89    HE2  TYR  14           2HE      TYR  14  -6.645   4.977  -2.984
   90    HH   TYR  14           HH       TYR  14  -9.212   7.044  -4.386
   91    H    CYS  15           H        CYS  15  -5.187   5.971   3.551
   92    HA   CYS  15           HA       CYS  15  -6.206   7.050   6.135
   93    HB2  CYS  15           1HB      CYS  15  -6.159   4.947   7.228
   94    HB3  CYS  15           2HB      CYS  15  -7.226   4.866   5.832
   95    H    ASN  16           H        ASN  16  -3.567   6.892   4.221
   96    HA   ASN  16           HA       ASN  16  -1.378   7.267   4.446
   97    HB2  ASN  16           1HB      ASN  16  -2.020   8.599   7.062
   98    HB3  ASN  16           2HB      ASN  16  -0.685   8.941   5.960
   99   HD21  ASN  16          1HD2      ASN  16  -2.112   8.997   3.438
  100   HD22  ASN  16          2HD2      ASN  16  -3.142  10.417   3.533
  101    H    LYS  17           H        LYS  17  -2.185   4.659   5.404
  102    HA   LYS  17           HA       LYS  17  -0.019   3.888   7.246
  103    HB2  LYS  17           1HB      LYS  17  -2.080   2.521   7.178
  104    HB3  LYS  17           2HB      LYS  17  -1.823   2.185   5.457
  105    HG2  LYS  17           1HG      LYS  17   0.290   1.060   5.957
  106    HG3  LYS  17           2HG      LYS  17   0.143   1.455   7.679
  107    HD2  LYS  17           1HD      LYS  17  -1.852  -0.008   7.808
  108    HD3  LYS  17           2HD      LYS  17  -1.700  -0.384   6.088
  109    HE2  LYS  17           1HE      LYS  17   0.330  -1.001   8.288
  110    HE3  LYS  17           2HE      LYS  17  -0.717  -2.166   7.481
  111    HZ1  LYS  17           3HZ      LYS  17   0.476  -1.636   5.385
  112    HZ2  LYS  17           1HZ      LYS  17   1.481  -2.246   6.522
  113    HZ3  LYS  17           2HZ      LYS  17   1.504  -0.649   6.187
  114    H    VAL  18           H        VAL  18   1.909   2.968   6.632
  115    HA   VAL  18           HA       VAL  18   2.718   3.273   3.787
  116    HB   VAL  18           HB       VAL  18   5.101   3.176   4.846
  117   HG11  VAL  18          1HG1      VAL  18   3.299   5.611   5.007
  118   HG12  VAL  18          2HG1      VAL  18   5.070   5.636   5.041
  119   HG13  VAL  18          3HG1      VAL  18   4.231   5.047   3.597
  120   HG21  VAL  18          3HG2      VAL  18   3.543   4.436   7.133
  121   HG22  VAL  18          1HG2      VAL  18   4.250   2.792   7.212
  122   HG23  VAL  18          2HG2      VAL  18   5.298   4.214   7.015
  123    H    PHE  19           H        PHE  19   3.956   1.845   2.756
  124    HA   PHE  19           HA       PHE  19   4.206  -0.952   3.758
  125    HB2  PHE  19           1HB      PHE  19   3.209  -0.093   1.022
  126    HB3  PHE  19           2HB      PHE  19   3.417  -1.736   1.569
  127    HD1  PHE  19           2HD      PHE  19   1.377   1.355   2.177
  128    HD2  PHE  19           1HD      PHE  19   1.671  -2.923   2.632
  129    HE1  PHE  19           2HE      PHE  19  -0.917   1.298   3.108
  130    HE2  PHE  19           1HE      PHE  19  -0.660  -2.988   3.490
  131    HZ   PHE  19           HZ       PHE  19  -1.926  -0.868   3.790
  132    H    LYS  20           H        LYS  20   5.612  -2.236   2.352
  133    HA   LYS  20           HA       LYS  20   8.126  -0.817   1.768
  134    HB2  LYS  20           1HB      LYS  20   7.302  -3.752   1.856
  135    HB3  LYS  20           2HB      LYS  20   8.959  -3.206   1.614
  136    HG2  LYS  20           1HG      LYS  20   7.271  -2.510   4.061
  137    HG3  LYS  20           2HG      LYS  20   8.343  -3.917   3.957
  138    HD2  LYS  20           1HD      LYS  20  10.241  -2.344   3.387
  139    HD3  LYS  20           2HD      LYS  20   9.184  -0.987   3.795
  140    HE2  LYS  20           1HE      LYS  20   9.942  -3.288   5.659
  141    HE3  LYS  20           2HE      LYS  20  10.741  -1.715   5.637
  142    HZ1  LYS  20           3HZ      LYS  20   8.612  -0.691   6.260
  143    HZ2  LYS  20           1HZ      LYS  20   9.067  -1.793   7.372
  144    HZ3  LYS  20           2HZ      LYS  20   7.881  -2.158   6.318
  145    H    PHE  21           H        PHE  21   5.641  -2.416  -0.113
  146    HA   PHE  21           HA       PHE  21   7.140  -1.918  -2.642
  147    HB2  PHE  21           1HB      PHE  21   5.666  -4.463  -1.853
  148    HB3  PHE  21           2HB      PHE  21   6.310  -4.116  -3.448
  149    HD1  PHE  21           1HD      PHE  21   7.166  -5.021   0.017
  150    HD2  PHE  21           2HD      PHE  21   8.719  -4.177  -3.908
  151    HE1  PHE  21           1HE      PHE  21   9.383  -5.923   0.706
  152    HE2  PHE  21           2HE      PHE  21  10.933  -5.097  -3.230
  153    HZ   PHE  21           HZ       PHE  21  11.264  -5.965  -0.924
  154    H    LYS  22           H        LYS  22   5.869  -1.620  -4.492
  155    HA   LYS  22           HA       LYS  22   3.556  -0.061  -4.132
  156    HB2  LYS  22           1HB      LYS  22   5.152  -0.074  -6.125
  157    HB3  LYS  22           2HB      LYS  22   4.340  -1.536  -6.686
  158    HG2  LYS  22           1HG      LYS  22   2.178  -0.293  -6.659
  159    HG3  LYS  22           2HG      LYS  22   3.013   1.164  -6.134
  160    HD2  LYS  22           1HD      LYS  22   2.598   1.332  -8.502
  161    HD3  LYS  22           2HD      LYS  22   4.340   1.174  -8.238
  162    HE2  LYS  22           1HE      LYS  22   4.217  -1.236  -8.826
  163    HE3  LYS  22           2HE      LYS  22   2.464  -1.108  -9.022
  164    HZ1  LYS  22           3HZ      LYS  22   4.471   0.341 -10.669
  165    HZ2  LYS  22           1HZ      LYS  22   2.851   0.457 -10.852
  166    HZ3  LYS  22           2HZ      LYS  22   3.609  -0.955 -11.157
  167    H    HIS  23           H        HIS  23   3.720  -3.432  -5.331
  168    HA   HIS  23           HA       HIS  23   0.938  -3.763  -5.704
  169    HB2  HIS  23           1HB      HIS  23   1.477  -6.202  -5.716
  170    HB3  HIS  23           2HB      HIS  23   2.478  -5.221  -6.775
  171    HD1  HIS  23           1HD      HIS  23   5.049  -5.589  -6.520
  172    HD2  HIS  23           2HD      HIS  23   2.762  -6.934  -3.250
  173    HE1  HIS  23           1HE      HIS  23   6.670  -6.774  -4.951
  174    H    SER  24           H        SER  24   2.766  -3.880  -2.724
  175    HA   SER  24           HA       SER  24   0.778  -5.350  -1.165
  176    HB2  SER  24           1HB      SER  24   3.012  -3.478  -0.294
  177    HB3  SER  24           2HB      SER  24   1.977  -4.432   0.773
  178    HG   SER  24           HG       SER  24   3.897  -5.579   0.339
  179    H    LEU  25           H        LEU  25   1.524  -1.880  -1.645
  180    HA   LEU  25           HA       LEU  25  -0.685  -0.887  -0.082
  181    HB2  LEU  25           1HB      LEU  25   1.184   0.567  -0.591
  182    HB3  LEU  25           2HB      LEU  25   0.997   0.297  -2.326
  183    HG   LEU  25           HG       LEU  25  -1.207   1.455  -2.284
  184   HD11  LEU  25          1HD1      LEU  25  -0.516   2.192   0.590
  185   HD12  LEU  25          2HD1      LEU  25  -1.781   1.032   0.129
  186   HD13  LEU  25          3HD1      LEU  25  -1.928   2.712  -0.360
  187   HD21  LEU  25          3HD2      LEU  25   0.852   2.666  -2.818
  188   HD22  LEU  25          1HD2      LEU  25   1.043   3.092  -1.097
  189   HD23  LEU  25          2HD2      LEU  25  -0.348   3.700  -2.021
  190    H    GLN  26           H        GLN  26  -0.286  -1.704  -3.535
  191    HA   GLN  26           HA       GLN  26  -2.760  -0.658  -4.480
  192    HB2  GLN  26           1HB      GLN  26  -1.105  -2.994  -5.497
  193    HB3  GLN  26           2HB      GLN  26  -2.552  -2.417  -6.315
  194    HG2  GLN  26           1HG      GLN  26  -1.567  -0.192  -6.620
  195    HG3  GLN  26           2HG      GLN  26  -0.101  -0.687  -5.799
  196   HE21  GLN  26          1HE2      GLN  26  -1.983  -0.991  -8.800
  197   HE22  GLN  26          2HE2      GLN  26  -0.723  -1.838  -9.683
  198    H    ALA  27           H        ALA  27  -2.077  -3.855  -3.104
  199    HA   ALA  27           HA       ALA  27  -4.748  -4.926  -3.375
  200    HB1  ALA  27           1HB      ALA  27  -3.875  -6.604  -1.777
  201    HB2  ALA  27           2HB      ALA  27  -2.714  -6.292  -3.095
  202    HB3  ALA  27           3HB      ALA  27  -2.453  -5.572  -1.486
  203    H    HIS  28           H        HIS  28  -3.116  -3.019  -0.812
  204    HA   HIS  28           HA       HIS  28  -5.247  -3.228   1.126
  205    HB2  HIS  28           1HB      HIS  28  -3.086  -2.651   1.885
  206    HB3  HIS  28           2HB      HIS  28  -2.898  -1.355   0.720
  207    HD1  HIS  28           1HD      HIS  28  -4.753  -2.077   4.013
  208    HD2  HIS  28           2HD      HIS  28  -3.825   1.033   1.338
  209    HE1  HIS  28           1HE      HIS  28  -5.385   0.072   5.206
  210    H    LEU  29           H        LEU  29  -4.760  -1.050  -1.670
  211    HA   LEU  29           HA       LEU  29  -6.745   0.874  -1.061
  212    HB2  LEU  29           1HB      LEU  29  -6.182  -0.226  -3.835
  213    HB3  LEU  29           2HB      LEU  29  -6.870   1.343  -3.427
  214    HG   LEU  29           HG       LEU  29  -4.040   0.403  -2.934
  215   HD11  LEU  29          1HD1      LEU  29  -3.427   2.132  -4.517
  216   HD12  LEU  29          2HD1      LEU  29  -5.137   2.598  -4.700
  217   HD13  LEU  29          3HD1      LEU  29  -4.575   0.987  -5.236
  218   HD21  LEU  29          3HD2      LEU  29  -5.379   3.042  -2.170
  219   HD22  LEU  29          1HD2      LEU  29  -3.617   2.791  -2.195
  220   HD23  LEU  29          2HD2      LEU  29  -4.620   1.878  -1.063
  221    H    ARG  30           H        ARG  30  -7.228  -2.430  -2.053
  222    HA   ARG  30           HA       ARG  30  -9.881  -2.271  -3.100
  223    HB2  ARG  30           1HB      ARG  30  -8.563  -4.582  -1.619
  224    HB3  ARG  30           2HB      ARG  30  -9.964  -4.678  -2.689
  225    HG2  ARG  30           1HG      ARG  30  -8.608  -4.019  -4.626
  226    HG3  ARG  30           2HG      ARG  30  -7.184  -3.797  -3.603
  227    HD2  ARG  30           1HD      ARG  30  -7.271  -6.182  -2.952
  228    HD3  ARG  30           2HD      ARG  30  -8.653  -6.423  -4.042
  229    HE   ARG  30           HE       ARG  30  -6.710  -5.287  -5.659
  230   HH11  ARG  30          2HH1      ARG  30  -6.807  -8.214  -3.733
  231   HH12  ARG  30          1HH1      ARG  30  -5.650  -9.030  -4.748
  232   HH21  ARG  30          2HH2      ARG  30  -5.248  -6.391  -6.918
  233   HH22  ARG  30          1HH2      ARG  30  -4.799  -8.019  -6.505
  234    H    ILE  31           H        ILE  31  -8.913  -1.853   0.187
  235    HA   ILE  31           HA       ILE  31 -11.636  -2.360   1.220
  236    HB   ILE  31           HB       ILE  31 -10.881  -1.966   3.330
  237   HG12  ILE  31          1HG1      ILE  31  -8.479  -0.463   2.265
  238   HG13  ILE  31          2HG1      ILE  31  -9.832   0.170   3.187
  239   HG21  ILE  31          1HG2      ILE  31  -9.076  -3.516   3.644
  240   HG22  ILE  31          2HG2      ILE  31  -9.962  -4.031   2.208
  241   HG23  ILE  31          3HG2      ILE  31  -8.409  -3.183   2.034
  242   HD11  ILE  31          3HD1      ILE  31  -7.967   0.007   4.660
  243   HD12  ILE  31          1HD1      ILE  31  -9.141  -1.234   5.140
  244   HD13  ILE  31          2HD1      ILE  31  -7.674  -1.687   4.232
  245    H    HIS  32           H        HIS  32  -9.807   0.302  -0.028
  246    HA   HIS  32           HA       HIS  32 -11.570   2.403   1.041
  247    HB2  HIS  32           1HB      HIS  32  -9.007   2.417  -0.605
  248    HB3  HIS  32           2HB      HIS  32  -9.846   3.852  -0.074
  249    HD1  HIS  32           1HD      HIS  32 -10.274   3.634   2.894
  250    HD2  HIS  32           2HD      HIS  32  -6.962   1.988   0.902
  251    HE1  HIS  32           1HE      HIS  32  -8.441   3.451   4.639
  252    H    THR  33           H        THR  33 -10.808   0.859  -2.082
  253    HA   THR  33           HA       THR  33 -13.154   2.285  -3.278
  254    HB   THR  33           HB       THR  33 -11.182   2.966  -4.442
  255    HG1  THR  33           1HG      THR  33 -11.925   2.409  -6.472
  256   HG21  THR  33          3HG2      THR  33 -10.684   0.032  -5.125
  257   HG22  THR  33          1HG2      THR  33  -9.636   1.097  -4.164
  258   HG23  THR  33          2HG2      THR  33  -9.887   1.429  -5.876
  259    H    ASN  34           H        ASN  34 -14.831   1.135  -3.874
  260    HA   ASN  34           HA       ASN  34 -14.784  -1.750  -4.334
  261    HB2  ASN  34           1HB      ASN  34 -14.679  -1.369  -1.783
  262    HB3  ASN  34           2HB      ASN  34 -16.274  -0.634  -1.906
  263   HD21  ASN  34          1HD2      ASN  34 -16.546  -2.486  -0.246
  264   HD22  ASN  34          2HD2      ASN  34 -17.037  -4.031  -0.928
  265    H    GLU  35           H        GLU  35 -17.118  -2.535  -4.681
  266    HA   GLU  35           HA       GLU  35 -18.535  -0.660  -6.422
  267    HB2  GLU  35           1HB      GLU  35 -19.891  -2.545  -7.050
  268    HB3  GLU  35           2HB      GLU  35 -18.190  -2.996  -7.060
  269    HG2  GLU  35           1HG      GLU  35 -18.467  -4.134  -4.868
  270    HG3  GLU  35           2HG      GLU  35 -20.163  -3.654  -4.821
  271    H    LYS  36           H        LYS  36 -18.656  -0.917  -3.177
  272    HA   LYS  36           HA       LYS  36 -21.550  -0.209  -2.892
  273    HB2  LYS  36           1HB      LYS  36 -20.797  -2.230  -1.646
  274    HB3  LYS  36           2HB      LYS  36 -19.578  -1.254  -0.839
  275    HG2  LYS  36           1HG      LYS  36 -21.769   0.234  -0.191
  276    HG3  LYS  36           2HG      LYS  36 -22.588  -1.275  -0.524
  277    HD2  LYS  36           1HD      LYS  36 -22.090  -0.998   1.866
  278    HD3  LYS  36           2HD      LYS  36 -21.286  -2.418   1.207
  279    HE2  LYS  36           1HE      LYS  36 -19.889  -1.105   2.811
  280    HE3  LYS  36           2HE      LYS  36 -19.136  -1.347   1.237
  281    HZ1  LYS  36           3HZ      LYS  36 -19.696   0.913   0.626
  282    HZ2  LYS  36           1HZ      LYS  36 -18.909   0.949   2.054
  283    HZ3  LYS  36           2HZ      LYS  36 -20.527   1.155   2.026