*HEADER    STRUCTURAL PROTEIN                      17-NOV-06   2NX7              
*TITLE     STRUCTURE OF NOWA CYSTEINE RICH DOMAIN 8                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEMATOCYST OUTER WALL ANTIGEN;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: DOMAIN 8;                                                  
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HYDRA ATTENUATA;                                
*SOURCE   3 GENE: NOWA;                                                          
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PGEV2                                     
*KEYWDS    CYSTEINE RICH, DISULFIDE BONDS, RICH IN TURNS, STRUCTURAL             
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    S.MEIER, P.R.JENSEN, P.ADAMCZYK, H.P.BACHINGER,                       
*AUTHOR   2 T.W.HOLSTEIN, J.ENGEL, S.OZBEK, S.GRZESIEK                           
*REVDAT   1   02-OCT-07 2NX7    0                                                


assign (resid   2   and name  HN)  (resid      2   and name  HB# )    2.35589  0.166767  0.422356
assign (resid   2   and name  HN)  (resid      2   and name  HG# )    3.15506  0.406518  0.542024
assign (resid   2   and name  HN)  (resid      2   and name  HG# )    3.08934  0.386802  0.515736
assign (resid   2   and name  HN)  (resid      2   and name  HA )    2.86627  0.319881  0.426508
assign (resid   2   and name  HN)  (resid      1   and name  HA )    2.44135  0.192405  0.25654
assign (resid   3   and name  HD21)  (resid      14   and name  HB# )    3.47756  0.503268  0.671024
assign (resid   3   and name  HN)  (resid      3   and name  HD21 )    3.43912  0.591736  0.855648
assign (resid   3   and name  HN)  (resid      2   and name  HB2 )    3.31714  0.455142  0.606856
assign (resid   3   and name  HN)  (resid      2   and name  HA )    2.22521  0.127563  0.170084
assign (resid   3   and name  HN)  (resid      4   and name  HD# )    3.19743  0.419229  0.758972
assign (resid   3   and name  HN)  (resid      2   and name  HB1 )    3.13286  0.399858  0.533144
assign (resid   3   and name  HD21)  (resid      14   and name  HB# )    3.03793  0.371379  0.495172
assign (resid   3   and name  HN)  (resid      3   and name  HA )    2.84982  0.314946  0.419928
assign (resid   3   and name  HA)  (resid      4   and name  HD# )    2.75424  0.386272  0.481696
assign (resid   3   and name  HN)  (resid      3   and name  HB2 )    2.717  0.2751  0.5668
assign (resid   3   and name  HN)  (resid      3   and name  HB1 )    2.64074  0.252222  0.336296
assign (resid   3   and name  HD21)  (resid      3   and name  HB2 )    2.53071  0.219213  0.292284
assign (resid   3   and name  HN)  (resid      2   and name  HG# )    3.62379  0.547137  0.729516
assign (resid   4   and name  HG#)  (resid      17   and name  HB# )    3.19191  0.417573  0.956764
assign (resid   4   and name  HD#)  (resid      17   and name  HB# )    3.18918  0.416754  0.955672
assign (resid   4   and name  HD#)  (resid      17   and name  HB# )    2.77018  0.291054  0.788072
assign (resid   5   and name  HN)  (resid      4   and name  HD# )    3.31714  0.455142  0.606856
assign (resid   5   and name  HN)  (resid      4   and name  HB# )    3.22312  0.426936  0.569248
assign (resid   5   and name  HN)  (resid      5   and name  HB1 )    2.99023  0.157069  0.576092
assign (resid   5   and name  HN)  (resid      4   and name  HD# )    2.96823  0.350469  0.567292
assign (resid   5   and name  HN)  (resid      4   and name  HA )    2.70909  0.272727  0.563636
assign (resid   5   and name  HN)  (resid      5   and name  HB2 )    2.60735  0.142205  0.12294
assign (resid   5   and name  HN)  (resid      20   and name  HB# )    3.76266  0.588798  0.785064
assign (resid   5   and name  HN)  (resid      3   and name  HD22 )    3.74811  0.584433  0.779244
assign (resid   5   and name  HN)  (resid      17   and name  HB# )    3.6554  0.65662  1.64216
assign (resid   6   and name  HN)  (resid      5   and name  HB2 )    3.54714  0.524142  0.698856
assign (resid   6   and name  HN)  (resid      4   and name  HA )    3.50319  0.310957  0.681276
assign (resid   6   and name  HN)  (resid      3   and name  HB# )    3.37026  0.471078  0.628104
assign (resid   6   and name  HN)  (resid      5   and name  HB1 )    3.11171  0.393513  0.724684
assign (resid   6   and name  HN)  (resid      6   and name  HA )    2.6726  0.16178  0.14904
assign (resid   6   and name  HN)  (resid      12   and name  HB# )    3.89674  0.629022  0.838696
assign (resid   6   and name  HN)  (resid      6   and name  HB# )    2.49136  0.207408  0.276544
assign (resid   6   and name  HN)  (resid      8   and name  HG# )    3.60868  0.542604  0.723472
assign (resid   6   and name  HN)  (resid      5   and name  HN )    2.44515  0.103545  0.15806
assign (resid   7   and name  HN)  (resid      6   and name  HA )    3.26294  0.138882  0.185176
assign (resid   7   and name  HN)  (resid      6   and name  HB# )    2.91851  0.335553  0.447404
assign (resid   7   and name  HN)  (resid      7   and name  HA )    2.78468  0.195404  0.193872
assign (resid   7   and name  HN)  (resid      5   and name  HB# )    3.80224  0.600672  1.000896
assign (resid   7   and name  HN)  (resid      7   and name  HB2 )    2.51642  0.214926  0.286568
assign (resid   7   and name  HN)  (resid      7   and name  HB1 )    2.50922  0.212766  0.283688
assign (resid   8   and name  HN)  (resid      7   and name  HA )    3.25659  0.136977  0.182636
assign (resid   8   and name  HN)  (resid      8   and name  HA )    2.94264  0.342792  0.457056
assign (resid   8   and name  HN)  (resid      7   and name  HB1 )    2.92889  0.338667  0.451556
assign (resid   8   and name  HN)  (resid      8   and name  HG2 )    2.92293  0.336879  0.449172
assign (resid   8   and name  HN)  (resid      8   and name  HG1 )    2.88073  0.324219  0.432292
assign (resid   8   and name  HN)  (resid      7   and name  HB2 )    2.83521  0.310563  0.414084
assign (resid   8   and name  HN)  (resid      7   and name  HN )    2.56704  0.130112  0.206816
assign (resid   8   and name  HN)  (resid      8   and name  HB# )    2.49233  0.207699  0.276932
assign (resid   9   and name  HN)  (resid      10   and name  HD# )    3.42544  0.487632  0.650176
assign (resid   9   and name  HE21)  (resid      20   and name  HB# )    3.29952  0.449856  0.599808
assign (resid   9   and name  HN)  (resid      6   and name  HA )    3.26294  0.438882  0.585176
assign (resid   9   and name  HE21)  (resid      9   and name  HB# )    3.19191  0.417573  0.556764
assign (resid   9   and name  HN)  (resid      8   and name  HA )    3.14014  0.402042  0.536056
assign (resid   9   and name  HN)  (resid      9   and name  HG# )    3.11865  0.395595  0.52746
assign (resid   9   and name  HN)  (resid      8   and name  HB# )    2.86242  0.318726  0.424968
assign (resid   9   and name  HN)  (resid      9   and name  HA )    2.78153  0.294459  0.392612
assign (resid   9   and name  HE21)  (resid      9   and name  HG# )    2.64586  0.253758  0.338344
assign (resid   9   and name  HN)  (resid      9   and name  HB# )    2.63211  0.249633  0.332844
assign (resid   9   and name  HN)  (resid      6   and name  HB# )    3.83692  0.611076  0.814768
assign (resid   9   and name  HA)  (resid      10   and name  HD1 )    2.60338  0.241014  0.321352
assign (resid   9   and name  HA)  (resid      10   and name  HD2 )    2.5761  0.23283  0.31044
assign (resid   9   and name  HN)  (resid      9   and name  HG# )    3.59906  0.539718  0.719624
assign (resid   11   and name  HN)  (resid      10   and name  HB# )    3.32438  0.457314  0.609752
assign (resid   11   and name  HN)  (resid      10   and name  HA )    2.25269  0.135807  0.181076
assign (resid   11   and name  HN)  (resid      11   and name  HA2 )    2.77944  0.293832  0.391776
assign (resid   11   and name  HN)  (resid      12   and name  HN )    2.76816  0.190448  0.287264
assign (resid   11   and name  HN)  (resid      11   and name  HA1 )    2.52964  0.218892  0.291856
assign (resid   12   and name  HN)  (resid      12   and name  HB2 )    2.35263  0.165789  0.221052
assign (resid   12   and name  HN)  (resid      9   and name  HB# )    3.17049  0.411147  0.548196
assign (resid   12   and name  HN)  (resid      10   and name  HA )    3.12099  0.396297  0.528396
assign (resid   12   and name  HN)  (resid      11   and name  HA1 )    3.12099  0.396297  0.528396
assign (resid   12   and name  HB#)  (resid      5   and name  HB# )    3.11171  0.393513  0.524684
assign (resid   12   and name  HN)  (resid      11   and name  HA2 )    2.96007  0.348021  0.464028
assign (resid   12   and name  HA)  (resid      12   and name  HB1 )    2.8131  0.40393  0.20524
assign (resid   12   and name  HN)  (resid      12   and name  HA )    2.67418  0.102254  0.209672
assign (resid   12   and name  HN)  (resid      26   and name  HB# )    3.69741  0.669223  1.258964
assign (resid   12   and name  HN)  (resid      25   and name  HA )    3.62445  0.547335  0.72978
assign (resid   12   and name  HN)  (resid      12   and name  HB1 )    2.45201  0.295603  0.160804
assign (resid   13   and name  HN)  (resid      13   and name  HB2 )    2.38313  0.174939  0.233252
assign (resid   13   and name  HN)  (resid      13   and name  HB1 )    2.35589  0.166767  0.222356
assign (resid   13   and name  HN)  (resid      12   and name  HA )    2.11843  0.095529  0.127372
assign (resid   13   and name  HN)  (resid      25   and name  HA )    3.07222  0.381666  0.508888
assign (resid   13   and name  HN)  (resid      13   and name  HA )    2.62437  0.147311  0.139748
assign (resid   13   and name  HN)  (resid      12   and name  HB2 )    3.72256  0.176768  0.269024
assign (resid   13   and name  HN)  (resid      12   and name  HN )    3.65116  0.255348  0.740464
assign (resid   13   and name  HN)  (resid      12   and name  HB1 )    3.57425  0.132275  0.3097
assign (resid   14   and name  HN)  (resid      3   and name  HD21 )    3.39919  0.479757  0.639676
assign (resid   14   and name  HA)  (resid      17   and name  HB# )    3.26615  0.439845  0.9646
assign (resid   14   and name  HN)  (resid      13   and name  HA )    2.18604  0.115812  0.154416
assign (resid   14   and name  HN)  (resid      3   and name  HD22 )    3.15759  0.407277  0.543036
assign (resid   14   and name  HN)  (resid      13   and name  HB# )    3.11865  0.395595  0.52746
assign (resid   14   and name  HN)  (resid      14   and name  HB2 )    3.02834  0.368502  0.491336
assign (resid   14   and name  HN)  (resid      14   and name  HA )    2.94889  0.344667  0.459556
assign (resid   14   and name  HN)  (resid      14   and name  HB# )    2.55127  0.225381  0.300508
assign (resid   15   and name  HN)  (resid      14   and name  HB# )    2.3867  0.17601  0.23468
assign (resid   15   and name  HN)  (resid      14   and name  HA )    3.09153  0.287459  0.416612
assign (resid   15   and name  HN)  (resid      15   and name  HB2 )    2.09308  0.087924  0.317232
assign (resid   15   and name  HN)  (resid      15   and name  HA )    2.76014  0.088042  0.084056
assign (resid   15   and name  HN)  (resid      16   and name  HN )    2.5761  0.10283  0.10044
assign (resid   15   and name  HN)  (resid      14   and name  HN )    2.54279  0.122837  0.197116
assign (resid   16   and name  HN)  (resid      14   and name  HA )    3.26938  0.240814  0.387752
assign (resid   16   and name  HN)  (resid      14   and name  HB# )    3.26294  0.438882  0.885176
assign (resid   16   and name  HN)  (resid      15   and name  HA )    3.13527  0.100581  0.234108
assign (resid   16   and name  HN)  (resid      16   and name  HA )    2.91414  0.234242  0.145656
assign (resid   16   and name  HN)  (resid      15   and name  HB# )    2.83045  0.309135  0.81218
assign (resid   16   and name  HN)  (resid      13   and name  HB1 )    3.73642  0.530926  0.274568
assign (resid   16   and name  HN)  (resid      16   and name  HB2 )    2.50367  0.111101  0.181468
assign (resid   16   and name  HN)  (resid      17   and name  HB# )    3.63798  0.551394  0.935192
assign (resid   17   and name  HN)  (resid      15   and name  HA )    3.35837  0.267511  0.223348
assign (resid   17   and name  HN)  (resid      16   and name  HB# )    3.32075  0.456225  0.6083
assign (resid   17   and name  HN)  (resid      14   and name  HA )    3.27922  0.243766  0.191688
assign (resid   17   and name  HN)  (resid      17   and name  HB# )    2.18028  0.114084  0.752112
assign (resid   17   and name  HN)  (resid      15   and name  HN )    3.06597  0.379791  0.906388
assign (resid   17   and name  HN)  (resid      17   and name  HA )    2.78892  0.196676  0.195568
assign (resid   17   and name  HA)  (resid      18   and name  HA )    2.78363  0.295089  0.193452
assign (resid   17   and name  HN)  (resid      5   and name  HB# )    3.94413  0.643239  0.857652
assign (resid   17   and name  HN)  (resid      15   and name  HB# )    3.78569  0.595707  0.994276
assign (resid   17   and name  HN)  (resid      16   and name  HA )    3.72498  0.577494  0.769992
assign (resid   18   and name  HA)  (resid      17   and name  HB# )    2.3217  0.15651  0.80868
assign (resid   19   and name  HN)  (resid      18   and name  HA )    3.44376  0.493128  0.657504
assign (resid   19   and name  HN)  (resid      18   and name  HD# )    3.40779  0.482337  0.643116
assign (resid   19   and name  HN)  (resid      19   and name  HB# )    2.12631  0.097893  0.430524
assign (resid   19   and name  HN)  (resid      17   and name  HA )    3.03024  0.369072  0.492096
assign (resid   19   and name  HN)  (resid      18   and name  HB# )    2.88747  0.326241  0.634988
assign (resid   19   and name  HN)  (resid      18   and name  HD# )    2.84612  0.313836  0.418448
assign (resid   19   and name  HN)  (resid      20   and name  HN )    2.63712  0.251136  0.334848
assign (resid   19   and name  HN)  (resid      19   and name  HA )    2.63353  0.250059  0.333412
assign (resid   19   and name  HN)  (resid      18   and name  HG1 )    3.7532  0.58596  0.78128
assign (resid   19   and name  HN)  (resid      18   and name  HG2 )    3.69895  0.569685  0.75958
assign (resid   19   and name  HN)  (resid      20   and name  HA )    3.65116  0.555348  0.940464
assign (resid   20   and name  HN)  (resid      19   and name  HA )    3.53579  0.520737  0.694316
assign (resid   20   and name  HN)  (resid      20   and name  HA )    2.25509  0.136527  0.182036
assign (resid   20   and name  HN)  (resid      20   and name  HB1 )    3.303  0.3109  0.3012
assign (resid   20   and name  HN)  (resid      20   and name  HB2 )    3.29608  0.148824  0.598432
assign (resid   20   and name  HN)  (resid      19   and name  HA )    3.00256  0.360768  0.481024
assign (resid   20   and name  HN)  (resid      19   and name  HB# )    2.64513  0.253539  0.538052
assign (resid   20   and name  HN)  (resid      17   and name  HA )    2.58664  0.235992  0.314656
assign (resid   21   and name  HB#)  (resid      24   and name  HB2 )    3.44845  0.494535  0.65938
assign (resid   21   and name  HN)  (resid      24   and name  HB2 )    3.44376  0.493128  0.657504
assign (resid   21   and name  HB#)  (resid      24   and name  HB1 )    3.41214  0.483642  0.644856
assign (resid   21   and name  HN)  (resid      20   and name  HB# )    3.25344  0.436032  0.581376
assign (resid   21   and name  HN)  (resid      24   and name  HB1 )    3.25032  0.435096  0.580128
assign (resid   21   and name  HN)  (resid      21   and name  HG# )    2.89849  0.329547  0.439396
assign (resid   21   and name  HN)  (resid      21   and name  HB# )    2.89571  0.428713  0.438284
assign (resid   21   and name  HN)  (resid      21   and name  HA )    2.75522  0.286566  0.382088
assign (resid   21   and name  HN)  (resid      20   and name  HN )    2.66476  0.259428  0.345904
assign (resid   21   and name  HN)  (resid      22   and name  HN )    3.82511  0.607533  0.810044
assign (resid   21   and name  HN)  (resid      20   and name  HA )    2.56347  0.229041  0.305388
assign (resid   21   and name  HN)  (resid      24   and name  HN )    3.75064  0.585192  0.780256
assign (resid   21   and name  HN)  (resid      21   and name  HG1 )    2.52802  0.218406  0.291208
assign (resid   21   and name  HN)  (resid      21   and name  HB2 )    2.46034  0.198102  0.264136
assign (resid   22   and name  HN)  (resid      22   and name  HD## )    3.46767  0.500301  0.967068
assign (resid   22   and name  HN)  (resid      22   and name  HB# )    2.05427  0.076281  0.101708
assign (resid   22   and name  HN)  (resid      21   and name  HA )    2.0432  0.07296  0.09728
assign (resid   22   and name  HA)  (resid      25   and name  HB2 )    2.93954  0.341862  0.455816
assign (resid   22   and name  HN)  (resid      22   and name  HB# )    2.76113  0.288339  0.384452
assign (resid   22   and name  HN)  (resid      25   and name  HB2 )    3.88143  0.624429  0.832572
assign (resid   22   and name  HN)  (resid      22   and name  HA )    2.53017  0.219051  0.292068
assign (resid   22   and name  HA)  (resid      25   and name  HB2 )    3.60417  0.541251  0.721668
assign (resid   23   and name  HN)  (resid      22   and name  HA )    3.07222  0.381666  0.508888
assign (resid   23   and name  HN)  (resid      24   and name  HN )    2.57855  0.233565  0.31142
assign (resid   23   and name  HN)  (resid      23   and name  HA )    2.54168  0.222504  0.296672
assign (resid   23   and name  HN)  (resid      22   and name  HN )    2.52964  0.218892  0.291856
assign (resid   23   and name  HN)  (resid      22   and name  HB# )    2.45115  0.195345  0.26046
assign (resid   24   and name  HA)  (resid      16   and name  HB# )    5.04793  0.974379  1.29917
assign (resid   24   and name  HN)  (resid      25   and name  HN )    2.33068  0.159204  0.212272
assign (resid   24   and name  HN)  (resid      23   and name  HB# )    3.35447  0.466341  0.621788
assign (resid   24   and name  HN)  (resid      23   and name  HA )    3.303  0.4509  0.6012
assign (resid   24   and name  HA)  (resid      24   and name  HB2 )    3.22902  0.528706  0.571608
assign (resid   24   and name  HN)  (resid      21   and name  HB1 )    3.16528  0.409584  0.546112
assign (resid   24   and name  HN)  (resid      21   and name  HB2 )    2.98163  0.354489  0.472652
assign (resid   24   and name  HA)  (resid      24   and name  HB2 )    2.78468  0.295404  0.393872
assign (resid   24   and name  HN)  (resid      24   and name  HA )    2.73517  0.280551  0.374068
assign (resid   24   and name  HN)  (resid      23   and name  HN )    2.67418  0.262254  0.349672
assign (resid   24   and name  HN)  (resid      24   and name  HB2 )    2.65482  0.156446  0.141928
assign (resid   24   and name  HN)  (resid      25   and name  HB2 )    3.86132  0.618396  0.824528
assign (resid   24   and name  HN)  (resid      22   and name  HA )    3.84797  0.614391  0.819188
assign (resid   24   and name  HN)  (resid      28   and name  HA# )    3.82706  0.608118  0.810824
assign (resid   24   and name  HN)  (resid      27   and name  HB# )    3.76266  0.588798  0.785064
assign (resid   24   and name  HN)  (resid      24   and name  HB1 )    2.55471  0.126413  0.101884
assign (resid   25   and name  HN)  (resid      24   and name  HA )    3.52468  0.517404  0.689872
assign (resid   25   and name  HA)  (resid      25   and name  HB2 )    3.3506  0.36518  0.22024
assign (resid   25   and name  HN)  (resid      24   and name  HN )    2.26988  0.140964  0.187952
assign (resid   25   and name  HN)  (resid      24   and name  HB2 )    3.32075  0.456225  0.6083
assign (resid   25   and name  HN)  (resid      25   and name  HB1 )    2.99197  0.157591  0.576788
assign (resid   25   and name  HA)  (resid      25   and name  HB1 )    2.89571  0.428713  0.238284
assign (resid   25   and name  HN)  (resid      22   and name  HA )    2.88341  0.325023  0.433364
assign (resid   25   and name  HN)  (resid      25   and name  HA )    2.71523  0.274569  0.366092
assign (resid   25   and name  HN)  (resid      20   and name  HB# )    3.85306  0.615918  0.821224
assign (resid   25   and name  HN)  (resid      24   and name  HB1 )    2.59685  0.239055  0.31874
assign (resid   25   and name  HN)  (resid      26   and name  HN )    2.57184  0.231552  0.308736
assign (resid   25   and name  HN)  (resid      25   and name  HB2 )    2.43142  0.189426  0.152568
assign (resid   26   and name  HN)  (resid      25   and name  HB1 )    3.39075  0.477225  0.6363
assign (resid   26   and name  HN)  (resid      22   and name  HA )    3.36626  0.469878  0.626504
assign (resid   26   and name  HN)  (resid      26   and name  HB# )    2.27496  0.142488  0.189984
assign (resid   26   and name  HN)  (resid      25   and name  HA )    3.07013  0.381039  0.508052
assign (resid   26   and name  HN)  (resid      24   and name  HA )    2.8902  0.32706  2.03608
assign (resid   26   and name  HN)  (resid      25   and name  HB2 )    2.8586  0.31758  0.42344
assign (resid   26   and name  HN)  (resid      27   and name  HN )    2.70563  0.271689  0.362252
assign (resid   26   and name  HN)  (resid      26   and name  HA )    2.63712  0.251136  0.334848
assign (resid   26   and name  HN)  (resid      24   and name  HN )    3.66686  0.560058  0.746744
assign (resid   27   and name  HN)  (resid      26   and name  HB# )    2.91851  0.335553  0.447404
assign (resid   27   and name  HN)  (resid      26   and name  HA )    2.89157  0.327471  0.436628
assign (resid   27   and name  HN)  (resid      27   and name  HA )    2.83401  0.310203  0.413604
assign (resid   27   and name  HN)  (resid      27   and name  HB2 )    2.80083  0.300249  0.400332
assign (resid   27   and name  HN)  (resid      27   and name  HB1 )    2.56704  0.230112  0.306816
assign (resid   28   and name  HN)  (resid      27   and name  HA )    3.06805  0.380415  0.50722
assign (resid   28   and name  HN)  (resid      27   and name  HN )    3.00435  0.361305  0.48174
assign (resid   28   and name  HN)  (resid      27   and name  HB# )    3.77494  0.592482  0.789976
assign (resid   16   and name  HN)  (resid      13   and name  O  )   2.1 0.3 0.3
assign (resid   17   and name  HN)  (resid      14   and name  O  )   2.1 0.3 0.3
assign (resid   16   and name   N)  (resid      13   and name  O  )   2.8 0.3 0.2
assign (resid   17   and name   N)  (resid      14   and name  O  )   2.8 0.3 0.2
assign (resid    9   and name   N)  (resid       5   and name  O  )   2.8 0.3 0.2
assign (resid    8   and name   N)  (resid       4   and name  O  )   2.8 0.3 0.2
assign (resid    9   and name  HN)  (resid       5   and name  O  )   2.1 0.3 0.3
assign (resid    8   and name  HN)  (resid       4   and name  O  )   2.1 0.3 0.3
assign (resid   28   and name  HN)  (resid      28   and name  HA# )    2.48943  0.206829  0.275772
                                  
assign (resid   5  and name C ) (resid   6 and name N)
       (resid   6  and name CA) (resid   6 and name C)  3.9725  0.4000
                                  
assign (resid   6  and name C ) (resid   7 and name N)
       (resid   7  and name CA) (resid   7 and name C)  5.2476  0.4000
                                  
assign (resid   7  and name C ) (resid   8 and name N)
       (resid   8  and name CA) (resid   8 and name C)  7.6081  0.4000
                                  
assign (resid   8  and name C ) (resid   9 and name N)
       (resid   9  and name CA) (resid   9 and name C)  8.6714  0.4000
                                                                   
assign (resid  11  and name C ) (resid  12 and name N)
       (resid  12  and name CA) (resid  12 and name C)  3.5694  0.4000
                                  
assign (resid  12  and name C ) (resid  13 and name N)
       (resid  13  and name CA) (resid  13 and name C)  3.3394  0.4000
                                  
assign (resid  13  and name C ) (resid  14 and name N)
       (resid  14  and name CA) (resid  14 and name C)  4.0668  0.4000
                                  
assign (resid  14  and name C ) (resid  15 and name N)
       (resid  15  and name CA) (resid  15 and name C)  4.6350  0.4000
                                  
assign (resid  15  and name C ) (resid  16 and name N)
       (resid  16  and name CA) (resid  16 and name C)  7.1080  0.4000
                                  
assign (resid  16  and name C ) (resid  17 and name N)
       (resid  17  and name CA) (resid  17 and name C)  5.5728  0.4000
                                  
assign (resid  18  and name C ) (resid  19 and name N)
       (resid  19  and name CA) (resid  19 and name C)  4.7959  0.4000
                                  
assign (resid  19  and name C ) (resid  20 and name N)
       (resid  20  and name CA) (resid  20 and name C)  6.2377  0.4000
                                  
assign (resid  20  and name C ) (resid  21 and name N)
       (resid  21  and name CA) (resid  21 and name C)  4.9613  0.4000
                                  
assign (resid  21  and name C ) (resid  22 and name N)
       (resid  22  and name CA) (resid  22 and name C)  2.5234  0.4000
                                  
assign (resid  22  and name C ) (resid  23 and name N)
       (resid  23  and name CA) (resid  23 and name C)  3.5718  0.4000
                                  
assign (resid  23  and name C ) (resid  24 and name N)
       (resid  24  and name CA) (resid  24 and name C)  8.2773  0.4000
                                  
assign (resid  24  and name C ) (resid  25 and name N)
       (resid  25  and name CA) (resid  25 and name C)  3.8009  0.4000
                                  
assign (resid  25  and name C ) (resid  26 and name N)
       (resid  26  and name CA) (resid  26 and name C)  5.7801  0.4000
assign (resid 11 and name ha1) (resid 11 and name ca)
       (resid 11 and name n ) (resid 11 and name hn)
       (resid 11 and name ha2) (resid 11 and name ca)
       (resid 11 and name n ) (resid 11 and name hn)
5.0480  0.4000
6.7588  0.4000

assign ( resid  23  and name C   )
       ( resid  24  and name N   )
       ( resid  24  and name CA  )  
       ( resid  24  and name C   )   1.0  -80.55   30.52     2
assign ( resid  24  and name N   )
       ( resid  24  and name CA  )
       ( resid  24  and name C   )
       ( resid  25  and name N   )   1.0  -50.0   15.91     2

assign ( resid  25  and name C   )
       ( resid  26  and name N   )
       ( resid  26  and name CA  )  
       ( resid  26  and name C   )   1.0  -80.55   30.52     2
assign ( resid  26  and name N   )
       ( resid  26  and name CA  )
       ( resid  26  and name C   )
       ( resid  27  and name N   )   1.0  -50.0   15.91     2


assign ( resid  19  and name C   )
       ( resid  20  and name N   )
       ( resid  20  and name CA  )
       ( resid  20  and name C   )   2.0  60.5    5.52     2
assign ( resid  20  and name N   )
       ( resid  20  and name CA  )
       ( resid  20  and name C   )
       ( resid  21  and name N   )   2.0  50.85    5.91     2

assign ( resid  12  and name N   )
       ( resid  12  and name CA  )
       ( resid  12  and name C   )
       ( resid  13  and name N   )   2.0  130.85   10.91     2

assign ( resid  15  and name N   )
       ( resid  15  and name CA  )
       ( resid  15  and name C   )
       ( resid  16  and name N   )   2.0  -30.00   15.91     2

assign ( resid  6  and name C   )
       ( resid  7  and name N   )
       ( resid  7  and name CA  )  
       ( resid  7  and name C   )   1.0  -80.55   30.52     2
assign ( resid  7  and name N   )
       ( resid  7  and name CA  )
       ( resid  7  and name C   )
       ( resid  8  and name N   )   1.0  -50.0   15.91     2

assign ( resid  7  and name C   )
       ( resid  8  and name N   )
       ( resid  8  and name CA  )  
       ( resid  8  and name C   )   1.0  -80.55   30.52     2
assign ( resid  8  and name N   )
       ( resid  8  and name CA  )
       ( resid  8  and name C   )
       ( resid  9  and name N   )   1.0  -50.0   15.91     2
assign (resid 25 and name n ) (resid 25 and name ca)
        (resid 25 and name cb) (resid 25 and name sg)   1.0   -60.0    15.0 2
assign (resid 24 and name n ) (resid 24 and name ca)
        (resid 24 and name cb) (resid 24 and name sg)   1.0  -180.0    10.0 2
assign (resid 20 and name n ) (resid 20 and name ca)
        (resid 20 and name cb) (resid 20 and name sg)   1.0   -60.0    10.0 2
assign (resid 16 and name n ) (resid 16 and name ca)
        (resid 16 and name cb) (resid 16 and name sg)   1.0   -60.0    15.0 2
assign (resid 12 and name n ) (resid 12 and name ca)
        (resid 12 and name cb) (resid 12 and name sg)   1.0  -180.0    10.0 2
assign (resid  5 and name n ) (resid  5 and name ca)
        (resid  5 and name cb) (resid  5 and name sg)   1.0   -60.0    10.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   ALA   1           HA       ALA   1   7.795 -12.351  -1.319
    2    H1   ALA   1           1H       ALA   1   7.458 -13.957  -3.181
    3    H2   ALA   1           2H       ALA   1   8.937 -14.036  -2.316
    4    H3   ALA   1           3H       ALA   1   8.885 -13.298  -3.864
    5    HB1  ALA   1           3HB      ALA   1  10.183 -11.896  -2.325
    6    HB2  ALA   1           1HB      ALA   1   9.270 -10.614  -1.528
    7    HB3  ALA   1           2HB      ALA   1   9.304 -10.708  -3.288
    8    H    GLN   2           H        GLN   2   5.592 -12.372  -1.820
    9    HA   GLN   2           HA       GLN   2   4.734 -10.827  -4.154
   10    HB2  GLN   2           1HB      GLN   2   3.499 -12.914  -2.457
   11    HB3  GLN   2           2HB      GLN   2   2.415 -11.691  -3.094
   12    HG2  GLN   2           1HG      GLN   2   4.056 -12.508  -5.229
   13    HG3  GLN   2           2HG      GLN   2   3.531 -13.971  -4.397
   14   HE21  GLN   2          1HE2      GLN   2   2.616 -11.340  -6.393
   15   HE22  GLN   2          2HE2      GLN   2   0.970 -11.806  -6.640
   16    H    ASN   3           H        ASN   3   3.080  -9.219  -3.934
   17    HA   ASN   3           HA       ASN   3   3.217  -7.811  -1.364
   18    HB2  ASN   3           1HB      ASN   3   4.204  -6.341  -2.814
   19    HB3  ASN   3           2HB      ASN   3   3.279  -6.907  -4.192
   20   HD21  ASN   3          1HD2      ASN   3   2.762  -4.925  -4.859
   21   HD22  ASN   3          2HD2      ASN   3   1.650  -3.884  -4.038
   22    HA   PRO   4           HA       PRO   4  -1.205  -9.089  -1.759
   23    HB2  PRO   4           1HB      PRO   4  -1.812  -8.929   0.886
   24    HB3  PRO   4           2HB      PRO   4  -1.078 -10.353   0.142
   25    HG2  PRO   4           1HG      PRO   4   0.226  -8.131   1.672
   26    HG3  PRO   4           2HG      PRO   4   0.505  -9.880   1.782
   27    HD2  PRO   4           1HD      PRO   4   2.149  -8.255   0.439
   28    HD3  PRO   4           2HD      PRO   4   1.829  -9.915  -0.107
   29    H    CYS   5           H        CYS   5   0.249  -6.276  -0.452
   30    HA   CYS   5           HA       CYS   5  -2.015  -4.839   0.273
   31    HB2  CYS   5           1HB      CYS   5   0.566  -3.701  -0.821
   32    HB3  CYS   5           2HB      CYS   5  -0.605  -2.901   0.215
   33    H    SER   6           H        SER   6  -0.513  -5.415  -2.830
   34    HA   SER   6           HA       SER   6  -1.904  -3.487  -4.339
   35    HG   SER   6           HG       SER   6   0.655  -4.645  -6.307
   36    HB2  SER   6           1HB      SER   6  -0.614  -6.112  -5.015
   37    HB3  SER   6           2HB      SER   6  -1.534  -5.226  -6.229
   38    H    LEU   7           H        LEU   7  -2.720  -6.686  -3.231
   39    HA   LEU   7           HA       LEU   7  -5.055  -7.097  -4.784
   40    HG   LEU   7           HG       LEU   7  -6.369  -9.014  -4.155
   41    HB2  LEU   7           1HB      LEU   7  -3.572  -8.681  -3.218
   42    HB3  LEU   7           2HB      LEU   7  -4.835  -8.297  -2.084
   43   HD11  LEU   7          1HD1      LEU   7  -5.273 -11.089  -5.121
   44   HD12  LEU   7          2HD1      LEU   7  -3.745 -10.419  -4.550
   45   HD13  LEU   7          3HD1      LEU   7  -4.707  -9.535  -5.734
   46   HD21  LEU   7          3HD2      LEU   7  -6.553 -11.212  -3.117
   47   HD22  LEU   7          1HD2      LEU   7  -6.454  -9.943  -1.896
   48   HD23  LEU   7          2HD2      LEU   7  -5.041 -10.938  -2.249
   49    H    GLN   8           H        GLN   8  -4.421  -5.735  -1.654
   50    HA   GLN   8           HA       GLN   8  -7.230  -5.302  -1.076
   51    HB2  GLN   8           1HB      GLN   8  -6.511  -4.391   1.017
   52    HB3  GLN   8           2HB      GLN   8  -5.580  -5.844   0.705
   53    HG2  GLN   8           1HG      GLN   8  -3.642  -4.741   0.617
   54    HG3  GLN   8           2HG      GLN   8  -4.338  -3.350  -0.204
   55   HE21  GLN   8          1HE2      GLN   8  -2.927  -4.355   2.574
   56   HE22  GLN   8          2HE2      GLN   8  -3.520  -3.149   3.659
   57    H    GLN   9           H        GLN   9  -4.513  -3.544  -2.261
   58    HA   GLN   9           HA       GLN   9  -6.233  -1.283  -2.951
   59    HB2  GLN   9           1HB      GLN   9  -3.642  -1.102  -1.419
   60    HB3  GLN   9           2HB      GLN   9  -4.341   0.267  -2.272
   61    HG2  GLN   9           1HG      GLN   9  -6.463  -0.321  -0.860
   62    HG3  GLN   9           2HG      GLN   9  -5.293  -1.120   0.188
   63   HE21  GLN   9          1HE2      GLN   9  -3.589   0.197   1.129
   64   HE22  GLN   9          2HE2      GLN   9  -3.840   1.889   1.353
   65    HA   PRO  10           HA       PRO  10  -4.006  -2.675  -6.717
   66    HB2  PRO  10           1HB      PRO  10  -5.688  -0.392  -7.668
   67    HB3  PRO  10           2HB      PRO  10  -5.395  -1.963  -8.424
   68    HG2  PRO  10           1HG      PRO  10  -7.678  -1.500  -7.156
   69    HG3  PRO  10           2HG      PRO  10  -6.865  -3.069  -7.003
   70    HD2  PRO  10           1HD      PRO  10  -7.039  -0.822  -5.055
   71    HD3  PRO  10           2HD      PRO  10  -6.985  -2.573  -4.759
   72    H    GLY  11           H        GLY  11  -2.398  -1.749  -7.973
   73    HA2  GLY  11           1HA      GLY  11  -0.802  -0.192  -8.627
   74    HA3  GLY  11           2HA      GLY  11  -1.741   1.039  -7.818
   75    H    CYS  12           H        CYS  12  -1.567  -0.602  -5.240
   76    HA   CYS  12           HA       CYS  12   0.493   0.745  -4.031
   77    HB2  CYS  12           1HB      CYS  12  -1.281  -0.474  -2.863
   78    HB3  CYS  12           2HB      CYS  12  -0.502  -1.975  -3.305
   79    H    SER  13           H        SER  13   2.481   0.711  -4.309
   80    HA   SER  13           HA       SER  13   4.053  -1.142  -5.675
   81    HG   SER  13           HG       SER  13   6.809   0.467  -3.922
   82    HB2  SER  13           1HB      SER  13   4.841   1.101  -5.465
   83    HB3  SER  13           2HB      SER  13   4.791   1.021  -3.708
   84    H    SER  14           H        SER  14   5.112  -2.955  -5.046
   85    HA   SER  14           HA       SER  14   4.439  -4.268  -2.647
   86    HG   SER  14           HG       SER  14   5.334  -4.871  -5.762
   87    HB2  SER  14           1HB      SER  14   6.932  -4.730  -4.276
   88    HB3  SER  14           2HB      SER  14   6.097  -5.894  -3.250
   89    H    ALA  15           H        ALA  15   7.022  -2.146  -3.548
   90    HA   ALA  15           HA       ALA  15   8.742  -2.522  -1.367
   91    HB1  ALA  15           3HB      ALA  15   9.900  -1.393  -2.934
   92    HB2  ALA  15           1HB      ALA  15   9.268   0.028  -2.102
   93    HB3  ALA  15           2HB      ALA  15   8.466  -0.576  -3.553
   94    H    CYS  16           H        CYS  16   5.680  -1.124  -1.528
   95    HA   CYS  16           HA       CYS  16   6.105   0.792   0.602
   96    HB2  CYS  16           1HB      CYS  16   3.609  -0.238  -0.763
   97    HB3  CYS  16           2HB      CYS  16   3.549   0.853   0.612
   98    H    ALA  17           H        ALA  17   5.436  -2.555   0.246
   99    HA   ALA  17           HA       ALA  17   4.157  -2.949   2.777
  100    HB1  ALA  17           3HB      ALA  17   5.454  -5.340   1.990
  101    HB2  ALA  17           1HB      ALA  17   4.850  -4.558   0.530
  102    HB3  ALA  17           2HB      ALA  17   3.742  -4.932   1.851
  103    HA   PRO  18           HA       PRO  18   4.216  -4.961   4.144
  104    HB2  PRO  18           1HB      PRO  18   4.243  -5.112   6.810
  105    HB3  PRO  18           2HB      PRO  18   5.256  -6.157   5.807
  106    HG2  PRO  18           1HG      PRO  18   5.988  -3.659   7.293
  107    HG3  PRO  18           2HG      PRO  18   6.870  -5.194   7.186
  108    HD2  PRO  18           1HD      PRO  18   7.496  -3.009   5.682
  109    HD3  PRO  18           2HD      PRO  18   7.780  -4.675   5.150
  110    H    ALA  19           H        ALA  19   5.021  -1.775   5.011
  111    HA   ALA  19           HA       ALA  19   2.843  -1.090   6.661
  112    HB1  ALA  19           3HB      ALA  19   3.588   1.221   5.281
  113    HB2  ALA  19           1HB      ALA  19   5.063   0.264   5.427
  114    HB3  ALA  19           2HB      ALA  19   4.145   0.696   6.869
  115    H    CYS  20           H        CYS  20   3.446  -0.392   3.266
  116    HA   CYS  20           HA       CYS  20   2.161   0.078   1.547
  117    HB2  CYS  20           1HB      CYS  20   0.164  -1.753   2.847
  118    HB3  CYS  20           2HB      CYS  20   0.351  -1.391   1.145
  119    H    ARG  21           H        ARG  21   2.026   2.102   3.308
  120    HA   ARG  21           HA       ARG  21  -0.576   2.784   4.198
  121    HE   ARG  21           HE       ARG  21   4.034   5.429   4.386
  122    HB2  ARG  21           1HB      ARG  21   1.706   4.657   3.559
  123    HB3  ARG  21           2HB      ARG  21   0.307   5.019   4.556
  124    HG2  ARG  21           1HG      ARG  21   1.550   4.432   6.295
  125    HG3  ARG  21           2HG      ARG  21   1.376   2.767   5.739
  126    HD2  ARG  21           1HD      ARG  21   3.685   3.068   5.998
  127    HD3  ARG  21           2HD      ARG  21   3.406   3.224   4.265
  128   HH11  ARG  21          1HH1      ARG  21   3.548   4.194   7.615
  129   HH12  ARG  21          2HH1      ARG  21   4.237   5.584   8.384
  130   HH21  ARG  21          1HH2      ARG  21   4.940   7.256   5.397
  131   HH22  ARG  21          2HH2      ARG  21   5.027   7.322   7.125
  132    H    LEU  22           H        LEU  22  -2.027   4.274   3.393
  133    HA   LEU  22           HA       LEU  22  -2.838   4.052   0.814
  134    HG   LEU  22           HG       LEU  22  -3.878   6.547   0.020
  135    HB2  LEU  22           1HB      LEU  22  -4.266   5.009   2.525
  136    HB3  LEU  22           2HB      LEU  22  -3.235   6.425   2.628
  137   HD11  LEU  22          1HD1      LEU  22  -6.304   6.047  -0.166
  138   HD12  LEU  22          2HD1      LEU  22  -6.208   5.210   1.383
  139   HD13  LEU  22          3HD1      LEU  22  -5.293   4.612  -0.001
  140   HD21  LEU  22          3HD2      LEU  22  -5.562   7.573   2.302
  141   HD22  LEU  22          1HD2      LEU  22  -5.564   8.200   0.653
  142   HD23  LEU  22          2HD2      LEU  22  -4.117   8.344   1.650
  143    H    SER  23           H        SER  23  -1.056   6.786   2.130
  144    HA   SER  23           HA       SER  23  -0.685   8.195  -0.239
  145    HG   SER  23           HG       SER  23   1.886   8.558   2.888
  146    HB2  SER  23           1HB      SER  23   1.193   9.307   0.907
  147    HB3  SER  23           2HB      SER  23  -0.214   9.156   1.960
  148    H    CYS  24           H        CYS  24   0.972   5.365   0.917
  149    HA   CYS  24           HA       CYS  24   3.072   5.670  -1.068
  150    HB2  CYS  24           1HB      CYS  24   3.577   4.882   1.304
  151    HB3  CYS  24           2HB      CYS  24   2.724   3.396   0.902
  152    H    CYS  25           H        CYS  25   0.393   3.419  -0.351
  153    HA   CYS  25           HA       CYS  25   0.999   1.620  -2.377
  154    HB2  CYS  25           1HB      CYS  25  -1.543   2.331  -0.983
  155    HB3  CYS  25           2HB      CYS  25  -1.545   1.172  -2.299
  156    H    SER  26           H        SER  26  -1.542   4.081  -2.552
  157    HA   SER  26           HA       SER  26  -1.628   3.875  -5.395
  158    HG   SER  26           HG       SER  26  -3.617   6.017  -2.743
  159    HB2  SER  26           1HB      SER  26  -3.396   5.479  -5.313
  160    HB3  SER  26           2HB      SER  26  -3.609   4.332  -3.990
  161    H    LEU  27           H        LEU  27  -0.711   6.442  -3.197
  162    HA   LEU  27           HA       LEU  27   0.542   7.923  -5.372
  163    HG   LEU  27           HG       LEU  27   1.830  10.036  -4.111
  164    HB2  LEU  27           1HB      LEU  27  -0.948   9.005  -3.654
  165    HB3  LEU  27           2HB      LEU  27   0.306   8.700  -2.467
  166   HD11  LEU  27          1HD1      LEU  27   0.884  11.340  -5.702
  167   HD12  LEU  27          2HD1      LEU  27  -0.631  11.515  -4.817
  168   HD13  LEU  27          3HD1      LEU  27  -0.300  10.033  -5.714
  169   HD21  LEU  27          3HD2      LEU  27  -0.306  11.385  -2.465
  170   HD22  LEU  27          1HD2      LEU  27   1.208  12.118  -2.993
  171   HD23  LEU  27          2HD2      LEU  27   1.231  10.764  -1.863
  172    H    GLY  28           H        GLY  28   1.852   5.522  -4.776
  173    HA2  GLY  28           1HA      GLY  28   4.487   6.527  -4.234
  174    HA3  GLY  28           2HA      GLY  28   3.879   5.507  -2.937
  Start of MODEL    2
    1    HA   ALA   1           HA       ALA   1   7.256 -12.460   0.024
    2    H1   ALA   1           1H       ALA   1   8.285 -14.373  -0.502
    3    H2   ALA   1           2H       ALA   1   8.655 -13.878  -2.103
    4    H3   ALA   1           3H       ALA   1   7.047 -14.309  -1.685
    5    HB1  ALA   1           3HB      ALA   1   8.930 -10.963  -0.163
    6    HB2  ALA   1           1HB      ALA   1   9.018 -11.119  -1.917
    7    HB3  ALA   1           2HB      ALA   1   9.786 -12.325  -0.885
    8    H    GLN   2           H        GLN   2   5.134 -12.455  -0.744
    9    HA   GLN   2           HA       GLN   2   4.675 -11.247  -3.377
   10    HB2  GLN   2           1HB      GLN   2   2.616 -12.482  -1.548
   11    HB3  GLN   2           2HB      GLN   2   2.441 -12.102  -3.255
   12    HG2  GLN   2           1HG      GLN   2   2.950 -14.224  -3.641
   13    HG3  GLN   2           2HG      GLN   2   4.606 -13.800  -3.207
   14   HE21  GLN   2          1HE2      GLN   2   1.546 -14.578  -1.580
   15   HE22  GLN   2          2HE2      GLN   2   2.242 -15.642  -0.409
   16    H    ASN   3           H        ASN   3   3.178  -9.508  -3.619
   17    HA   ASN   3           HA       ASN   3   3.163  -7.708  -1.321
   18    HB2  ASN   3           1HB      ASN   3   4.148  -6.785  -3.293
   19    HB3  ASN   3           2HB      ASN   3   2.785  -7.291  -4.278
   20   HD21  ASN   3          1HD2      ASN   3   2.297  -5.374  -5.027
   21   HD22  ASN   3          2HD2      ASN   3   1.669  -4.068  -4.080
   22    HA   PRO   4           HA       PRO   4  -1.258  -9.206  -1.509
   23    HB2  PRO   4           1HB      PRO   4  -1.769  -8.901   1.156
   24    HB3  PRO   4           2HB      PRO   4  -1.095 -10.376   0.450
   25    HG2  PRO   4           1HG      PRO   4   0.316  -8.115   1.820
   26    HG3  PRO   4           2HG      PRO   4   0.565  -9.863   1.998
   27    HD2  PRO   4           1HD      PRO   4   2.191  -8.351   0.517
   28    HD3  PRO   4           2HD      PRO   4   1.789 -10.013   0.042
   29    H    CYS   5           H        CYS   5   0.260  -6.349  -0.380
   30    HA   CYS   5           HA       CYS   5  -1.981  -4.862   0.337
   31    HB2  CYS   5           1HB      CYS   5   0.596  -3.809  -0.854
   32    HB3  CYS   5           2HB      CYS   5  -0.548  -2.942   0.159
   33    H    SER   6           H        SER   6  -0.561  -5.609  -2.756
   34    HA   SER   6           HA       SER   6  -1.906  -3.722  -4.347
   35    HG   SER   6           HG       SER   6  -0.684  -5.084  -7.132
   36    HB2  SER   6           1HB      SER   6  -0.015  -5.202  -5.095
   37    HB3  SER   6           2HB      SER   6  -1.172  -6.530  -5.167
   38    H    LEU   7           H        LEU   7  -2.789  -6.839  -3.081
   39    HA   LEU   7           HA       LEU   7  -5.202  -7.224  -4.522
   40    HG   LEU   7           HG       LEU   7  -6.305  -9.115  -4.114
   41    HB2  LEU   7           1HB      LEU   7  -3.692  -8.784  -2.931
   42    HB3  LEU   7           2HB      LEU   7  -4.928  -8.332  -1.793
   43   HD11  LEU   7          1HD1      LEU   7  -3.905 -10.811  -3.556
   44   HD12  LEU   7          2HD1      LEU   7  -4.567 -10.283  -5.103
   45   HD13  LEU   7          3HD1      LEU   7  -5.391 -11.533  -4.171
   46   HD21  LEU   7          3HD2      LEU   7  -6.740 -11.177  -2.556
   47   HD22  LEU   7          1HD2      LEU   7  -7.350  -9.580  -2.124
   48   HD23  LEU   7          2HD2      LEU   7  -5.880 -10.197  -1.369
   49    H    GLN   8           H        GLN   8  -4.318  -5.666  -1.567
   50    HA   GLN   8           HA       GLN   8  -7.053  -5.157  -0.763
   51    HB2  GLN   8           1HB      GLN   8  -6.185  -4.375   1.233
   52    HB3  GLN   8           2HB      GLN   8  -4.965  -5.533   0.743
   53    HG2  GLN   8           1HG      GLN   8  -3.400  -3.935   0.350
   54    HG3  GLN   8           2HG      GLN   8  -4.583  -2.706  -0.062
   55   HE21  GLN   8          1HE2      GLN   8  -4.474  -4.749   2.804
   56   HE22  GLN   8          2HE2      GLN   8  -4.278  -3.460   3.936
   57    H    GLN   9           H        GLN   9  -4.449  -3.503  -2.348
   58    HA   GLN   9           HA       GLN   9  -6.257  -1.342  -3.072
   59    HB2  GLN   9           1HB      GLN   9  -3.597  -0.975  -1.707
   60    HB3  GLN   9           2HB      GLN   9  -4.350   0.302  -2.652
   61    HG2  GLN   9           1HG      GLN   9  -6.389  -0.070  -1.128
   62    HG3  GLN   9           2HG      GLN   9  -5.258  -0.909  -0.071
   63   HE21  GLN   9          1HE2      GLN   9  -3.459   0.316   0.809
   64   HE22  GLN   9          2HE2      GLN   9  -3.585   2.031   0.960
   65    HA   PRO  10           HA       PRO  10  -4.217  -2.304  -6.923
   66    HB2  PRO  10           1HB      PRO  10  -5.275  -0.335  -8.455
   67    HB3  PRO  10           2HB      PRO  10  -6.185  -1.770  -7.970
   68    HG2  PRO  10           1HG      PRO  10  -6.234   0.987  -6.816
   69    HG3  PRO  10           2HG      PRO  10  -7.581  -0.124  -7.126
   70    HD2  PRO  10           1HD      PRO  10  -6.486   0.243  -4.665
   71    HD3  PRO  10           2HD      PRO  10  -7.237  -1.284  -5.173
   72    H    GLY  11           H        GLY  11  -2.475  -1.659  -8.092
   73    HA2  GLY  11           1HA      GLY  11  -0.691  -0.350  -8.799
   74    HA3  GLY  11           2HA      GLY  11  -1.512   1.037  -8.125
   75    H    CYS  12           H        CYS  12  -1.504  -0.609  -5.441
   76    HA   CYS  12           HA       CYS  12   0.556   0.727  -4.214
   77    HB2  CYS  12           1HB      CYS  12  -1.245  -0.437  -3.044
   78    HB3  CYS  12           2HB      CYS  12  -0.511  -1.964  -3.473
   79    H    SER  13           H        SER  13   2.546   0.658  -4.458
   80    HA   SER  13           HA       SER  13   4.111  -1.241  -5.770
   81    HG   SER  13           HG       SER  13   6.905   0.471  -4.135
   82    HB2  SER  13           1HB      SER  13   4.925   0.994  -5.596
   83    HB3  SER  13           2HB      SER  13   4.851   0.954  -3.841
   84    H    SER  14           H        SER  14   5.125  -3.055  -5.101
   85    HA   SER  14           HA       SER  14   4.435  -4.314  -2.666
   86    HG   SER  14           HG       SER  14   7.277  -6.397  -3.149
   87    HB2  SER  14           1HB      SER  14   5.258  -5.593  -4.604
   88    HB3  SER  14           2HB      SER  14   6.830  -4.806  -4.435
   89    H    ALA  15           H        ALA  15   7.036  -2.251  -3.637
   90    HA   ALA  15           HA       ALA  15   8.768  -2.584  -1.460
   91    HB1  ALA  15           3HB      ALA  15   9.912  -1.504  -3.077
   92    HB2  ALA  15           1HB      ALA  15   9.315  -0.063  -2.254
   93    HB3  ALA  15           2HB      ALA  15   8.479  -0.672  -3.682
   94    H    CYS  16           H        CYS  16   5.711  -1.184  -1.647
   95    HA   CYS  16           HA       CYS  16   6.151   0.784   0.439
   96    HB2  CYS  16           1HB      CYS  16   3.647  -0.267  -0.893
   97    HB3  CYS  16           2HB      CYS  16   3.592   0.844   0.465
   98    H    ALA  17           H        ALA  17   5.474  -2.564   0.167
   99    HA   ALA  17           HA       ALA  17   4.213  -2.911   2.712
  100    HB1  ALA  17           3HB      ALA  17   4.878  -4.556   0.487
  101    HB2  ALA  17           1HB      ALA  17   3.800  -4.916   1.835
  102    HB3  ALA  17           2HB      ALA  17   5.516  -5.311   1.947
  103    HA   PRO  18           HA       PRO  18   4.294  -4.913   4.106
  104    HB2  PRO  18           1HB      PRO  18   4.336  -5.011   6.776
  105    HB3  PRO  18           2HB      PRO  18   5.343  -6.074   5.787
  106    HG2  PRO  18           1HG      PRO  18   6.084  -3.551   7.221
  107    HG3  PRO  18           2HG      PRO  18   6.967  -5.086   7.131
  108    HD2  PRO  18           1HD      PRO  18   7.578  -2.924   5.588
  109    HD3  PRO  18           2HD      PRO  18   7.860  -4.599   5.081
  110    H    ALA  19           H        ALA  19   5.091  -1.709   4.917
  111    HA   ALA  19           HA       ALA  19   2.910  -1.004   6.555
  112    HB1  ALA  19           3HB      ALA  19   5.071   0.382   5.169
  113    HB2  ALA  19           1HB      ALA  19   4.333   0.708   6.737
  114    HB3  ALA  19           2HB      ALA  19   3.579   1.317   5.265
  115    H    CYS  20           H        CYS  20   3.511  -0.355   3.152
  116    HA   CYS  20           HA       CYS  20   2.227   0.091   1.426
  117    HB2  CYS  20           1HB      CYS  20   0.226  -1.722   2.743
  118    HB3  CYS  20           2HB      CYS  20   0.416  -1.378   1.038
  119    H    ARG  21           H        ARG  21   2.100   2.130   3.164
  120    HA   ARG  21           HA       ARG  21  -0.502   2.829   4.047
  121    HE   ARG  21           HE       ARG  21   4.022   3.548   7.316
  122    HB2  ARG  21           1HB      ARG  21   1.877   4.593   3.447
  123    HB3  ARG  21           2HB      ARG  21   0.413   5.129   4.252
  124    HG2  ARG  21           1HG      ARG  21   1.160   4.425   6.211
  125    HG3  ARG  21           2HG      ARG  21   1.461   2.808   5.574
  126    HD2  ARG  21           1HD      ARG  21   3.659   3.272   5.067
  127    HD3  ARG  21           2HD      ARG  21   3.370   5.003   4.919
  128   HH11  ARG  21          1HH1      ARG  21   2.591   6.456   6.020
  129   HH12  ARG  21          2HH1      ARG  21   2.854   7.377   7.462
  130   HH21  ARG  21          1HH2      ARG  21   4.368   4.758   9.213
  131   HH22  ARG  21          2HH2      ARG  21   3.863   6.415   9.274
  132    H    LEU  22           H        LEU  22  -1.946   4.321   3.230
  133    HA   LEU  22           HA       LEU  22  -2.771   4.080   0.664
  134    HG   LEU  22           HG       LEU  22  -4.428   4.045   2.809
  135    HB2  LEU  22           1HB      LEU  22  -3.153   6.255   2.674
  136    HB3  LEU  22           2HB      LEU  22  -3.827   6.423   1.065
  137   HD11  LEU  22          1HD1      LEU  22  -5.379   5.585   4.172
  138   HD12  LEU  22          2HD1      LEU  22  -6.678   5.459   2.985
  139   HD13  LEU  22          3HD1      LEU  22  -5.526   6.792   2.894
  140   HD21  LEU  22          3HD2      LEU  22  -4.821   4.205   0.226
  141   HD22  LEU  22          1HD2      LEU  22  -6.209   5.182   0.705
  142   HD23  LEU  22          2HD2      LEU  22  -6.059   3.521   1.278
  143    H    SER  23           H        SER  23  -0.970   6.816   1.945
  144    HA   SER  23           HA       SER  23  -0.602   8.201  -0.437
  145    HG   SER  23           HG       SER  23   0.223   9.509   2.933
  146    HB2  SER  23           1HB      SER  23   1.571   8.205   1.617
  147    HB3  SER  23           2HB      SER  23   0.870   9.555   0.724
  148    H    CYS  24           H        CYS  24   1.041   5.370   0.729
  149    HA   CYS  24           HA       CYS  24   3.137   5.652  -1.260
  150    HB2  CYS  24           1HB      CYS  24   3.647   4.872   1.113
  151    HB3  CYS  24           2HB      CYS  24   2.782   3.391   0.722
  152    H    CYS  25           H        CYS  25   0.449   3.417  -0.524
  153    HA   CYS  25           HA       CYS  25   1.038   1.608  -2.549
  154    HB2  CYS  25           1HB      CYS  25  -1.491   2.337  -1.139
  155    HB3  CYS  25           2HB      CYS  25  -1.512   1.179  -2.455
  156    H    SER  26           H        SER  26  -1.493   4.080  -2.721
  157    HA   SER  26           HA       SER  26  -1.595   3.849  -5.561
  158    HG   SER  26           HG       SER  26  -3.292   5.900  -6.314
  159    HB2  SER  26           1HB      SER  26  -3.668   4.316  -4.751
  160    HB3  SER  26           2HB      SER  26  -3.063   5.430  -3.524
  161    H    LEU  27           H        LEU  27  -0.124   6.051  -3.332
  162    HA   LEU  27           HA       LEU  27   0.986   7.558  -5.609
  163    HG   LEU  27           HG       LEU  27   1.634   9.762  -5.315
  164    HB2  LEU  27           1HB      LEU  27  -0.597   8.650  -3.818
  165    HB3  LEU  27           2HB      LEU  27   0.864   8.701  -2.854
  166   HD11  LEU  27          1HD1      LEU  27  -0.405  10.222  -6.239
  167   HD12  LEU  27          2HD1      LEU  27  -0.144  11.698  -5.309
  168   HD13  LEU  27          3HD1      LEU  27  -1.193  10.429  -4.675
  169   HD21  LEU  27          3HD2      LEU  27   0.742  11.477  -3.030
  170   HD22  LEU  27          1HD2      LEU  27   2.144  11.658  -4.085
  171   HD23  LEU  27          2HD2      LEU  27   2.124  10.396  -2.853
  172    H    GLY  28           H        GLY  28   2.297   5.259  -4.901
  173    HA2  GLY  28           1HA      GLY  28   4.877   6.296  -4.193
  174    HA3  GLY  28           2HA      GLY  28   4.195   5.285  -2.927
  Start of MODEL    3
    1    HA   ALA   1           HA       ALA   1   8.646 -10.035  -2.188
    2    H1   ALA   1           1H       ALA   1   9.049 -12.760  -3.148
    3    H2   ALA   1           2H       ALA   1   8.180 -12.461  -1.699
    4    H3   ALA   1           3H       ALA   1   9.803 -11.926  -1.855
    5    HB1  ALA   1           3HB      ALA   1   9.493 -11.403  -4.665
    6    HB2  ALA   1           1HB      ALA   1  10.023  -9.870  -3.974
    7    HB3  ALA   1           2HB      ALA   1   8.503  -9.957  -4.865
    8    H    GLN   2           H        GLN   2   6.567 -10.467  -1.219
    9    HA   GLN   2           HA       GLN   2   4.433 -11.107  -3.132
   10    HB2  GLN   2           1HB      GLN   2   4.383 -11.010  -0.113
   11    HB3  GLN   2           2HB      GLN   2   3.006 -11.405  -1.130
   12    HG2  GLN   2           1HG      GLN   2   4.748 -13.204  -2.057
   13    HG3  GLN   2           2HG      GLN   2   5.368 -13.024  -0.416
   14   HE21  GLN   2          1HE2      GLN   2   2.663 -14.010  -2.372
   15   HE22  GLN   2          2HE2      GLN   2   1.827 -14.880  -1.135
   16    H    ASN   3           H        ASN   3   2.691  -9.746  -3.444
   17    HA   ASN   3           HA       ASN   3   2.921  -7.053  -2.311
   18    HB2  ASN   3           1HB      ASN   3   3.667  -7.238  -4.708
   19    HB3  ASN   3           2HB      ASN   3   2.020  -7.698  -5.123
   20   HD21  ASN   3          1HD2      ASN   3   2.855  -5.382  -2.672
   21   HD22  ASN   3          2HD2      ASN   3   2.238  -3.989  -3.486
   22    HA   PRO   4           HA       PRO   4  -1.365  -9.042  -1.769
   23    HB2  PRO   4           1HB      PRO   4  -1.479  -8.712   0.944
   24    HB3  PRO   4           2HB      PRO   4  -0.910 -10.188   0.157
   25    HG2  PRO   4           1HG      PRO   4   0.675  -7.912   1.288
   26    HG3  PRO   4           2HG      PRO   4   0.967  -9.657   1.423
   27    HD2  PRO   4           1HD      PRO   4   2.346  -8.136  -0.302
   28    HD3  PRO   4           2HD      PRO   4   1.868  -9.799  -0.705
   29    H    CYS   5           H        CYS   5   0.203  -6.247  -0.440
   30    HA   CYS   5           HA       CYS   5  -2.021  -4.776   0.324
   31    HB2  CYS   5           1HB      CYS   5   0.598  -3.699  -0.746
   32    HB3  CYS   5           2HB      CYS   5  -0.552  -2.868   0.289
   33    H    SER   6           H        SER   6  -0.601  -5.349  -2.792
   34    HA   SER   6           HA       SER   6  -1.845  -3.282  -4.253
   35    HG   SER   6           HG       SER   6  -2.021  -5.927  -6.700
   36    HB2  SER   6           1HB      SER   6  -0.164  -4.381  -5.441
   37    HB3  SER   6           2HB      SER   6  -0.769  -5.982  -5.017
   38    H    LEU   7           H        LEU   7  -2.858  -6.465  -3.286
   39    HA   LEU   7           HA       LEU   7  -5.302  -6.593  -4.729
   40    HG   LEU   7           HG       LEU   7  -6.630  -8.437  -4.299
   41    HB2  LEU   7           1HB      LEU   7  -3.863  -8.375  -3.315
   42    HB3  LEU   7           2HB      LEU   7  -5.050  -7.961  -2.113
   43   HD11  LEU   7          1HD1      LEU   7  -4.289  -9.325  -5.229
   44   HD12  LEU   7          2HD1      LEU   7  -5.831 -10.067  -5.649
   45   HD13  LEU   7          3HD1      LEU   7  -4.827 -10.778  -4.386
   46   HD21  LEU   7          3HD2      LEU   7  -7.007 -10.684  -3.199
   47   HD22  LEU   7          1HD2      LEU   7  -7.190  -9.270  -2.160
   48   HD23  LEU   7          2HD2      LEU   7  -5.723 -10.244  -2.072
   49    H    GLN   8           H        GLN   8  -4.274  -5.339  -1.698
   50    HA   GLN   8           HA       GLN   8  -6.940  -4.759  -0.730
   51    HB2  GLN   8           1HB      GLN   8  -4.395  -3.659   0.444
   52    HB3  GLN   8           2HB      GLN   8  -5.913  -4.011   1.256
   53    HG2  GLN   8           1HG      GLN   8  -5.217  -6.479   0.374
   54    HG3  GLN   8           2HG      GLN   8  -3.631  -5.760   0.667
   55   HE21  GLN   8          1HE2      GLN   8  -4.041  -4.198   2.817
   56   HE22  GLN   8          2HE2      GLN   8  -4.517  -5.146   4.180
   57    H    GLN   9           H        GLN   9  -4.317  -3.118  -2.330
   58    HA   GLN   9           HA       GLN   9  -6.027  -0.816  -2.832
   59    HB2  GLN   9           1HB      GLN   9  -3.265  -0.638  -1.622
   60    HB3  GLN   9           2HB      GLN   9  -4.105   0.726  -2.344
   61    HG2  GLN   9           1HG      GLN   9  -5.470   0.999  -0.585
   62    HG3  GLN   9           2HG      GLN   9  -5.616  -0.730  -0.285
   63   HE21  GLN   9          1HE2      GLN   9  -3.842  -1.787   0.857
   64   HE22  GLN   9          2HE2      GLN   9  -2.881  -0.871   1.959
   65    HA   PRO  10           HA       PRO  10  -4.359  -2.256  -6.835
   66    HB2  PRO  10           1HB      PRO  10  -5.715   0.327  -7.512
   67    HB3  PRO  10           2HB      PRO  10  -5.728  -1.210  -8.385
   68    HG2  PRO  10           1HG      PRO  10  -7.802  -0.513  -6.887
   69    HG3  PRO  10           2HG      PRO  10  -7.227  -2.191  -6.904
   70    HD2  PRO  10           1HD      PRO  10  -6.930  -0.105  -4.807
   71    HD3  PRO  10           2HD      PRO  10  -7.065  -1.868  -4.638
   72    H    GLY  11           H        GLY  11  -2.570  -1.756  -7.947
   73    HA2  GLY  11           1HA      GLY  11  -0.732  -0.564  -8.720
   74    HA3  GLY  11           2HA      GLY  11  -1.489   0.888  -8.109
   75    H    CYS  12           H        CYS  12  -1.494  -0.754  -5.366
   76    HA   CYS  12           HA       CYS  12   0.568   0.608  -4.169
   77    HB2  CYS  12           1HB      CYS  12  -1.204  -0.568  -2.971
   78    HB3  CYS  12           2HB      CYS  12  -0.461  -2.089  -3.404
   79    H    SER  13           H        SER  13   2.556   0.560  -4.435
   80    HA   SER  13           HA       SER  13   4.135  -1.329  -5.749
   81    HG   SER  13           HG       SER  13   6.517  -0.819  -5.382
   82    HB2  SER  13           1HB      SER  13   4.920   0.921  -5.594
   83    HB3  SER  13           2HB      SER  13   4.866   0.885  -3.837
   84    H    SER  14           H        SER  14   5.216  -3.120  -5.060
   85    HA   SER  14           HA       SER  14   4.530  -4.367  -2.623
   86    HG   SER  14           HG       SER  14   5.576  -5.237  -5.751
   87    HB2  SER  14           1HB      SER  14   7.030  -4.864  -4.235
   88    HB3  SER  14           2HB      SER  14   6.217  -5.994  -3.154
   89    H    ALA  15           H        ALA  15   7.100  -2.254  -3.579
   90    HA   ALA  15           HA       ALA  15   8.816  -2.548  -1.386
   91    HB1  ALA  15           3HB      ALA  15   9.915  -1.486  -3.066
   92    HB2  ALA  15           1HB      ALA  15   9.402  -0.066  -2.157
   93    HB3  ALA  15           2HB      ALA  15   8.490  -0.583  -3.575
   94    H    CYS  16           H        CYS  16   5.744  -1.188  -1.589
   95    HA   CYS  16           HA       CYS  16   6.143   0.792   0.486
   96    HB2  CYS  16           1HB      CYS  16   3.664  -0.307  -0.855
   97    HB3  CYS  16           2HB      CYS  16   3.586   0.822   0.489
   98    H    ALA  17           H        ALA  17   5.501  -2.566   0.215
   99    HA   ALA  17           HA       ALA  17   4.235  -2.913   2.758
  100    HB1  ALA  17           3HB      ALA  17   5.538  -5.312   2.035
  101    HB2  ALA  17           1HB      ALA  17   4.955  -4.569   0.546
  102    HB3  ALA  17           2HB      ALA  17   3.831  -4.910   1.860
  103    HA   PRO  18           HA       PRO  18   4.316  -4.880   4.178
  104    HB2  PRO  18           1HB      PRO  18   4.375  -4.986   6.843
  105    HB3  PRO  18           2HB      PRO  18   5.387  -6.039   5.850
  106    HG2  PRO  18           1HG      PRO  18   6.113  -3.511   7.283
  107    HG3  PRO  18           2HG      PRO  18   7.006  -5.040   7.196
  108    HD2  PRO  18           1HD      PRO  18   7.600  -2.878   5.646
  109    HD3  PRO  18           2HD      PRO  18   7.895  -4.552   5.145
  110    H    ALA  19           H        ALA  19   5.122  -1.676   4.971
  111    HA   ALA  19           HA       ALA  19   2.967  -0.958   6.639
  112    HB1  ALA  19           3HB      ALA  19   4.433   0.732   6.775
  113    HB2  ALA  19           1HB      ALA  19   3.590   1.362   5.360
  114    HB3  ALA  19           2HB      ALA  19   5.078   0.436   5.162
  115    H    CYS  20           H        CYS  20   3.519  -0.380   3.217
  116    HA   CYS  20           HA       CYS  20   2.209   0.023   1.493
  117    HB2  CYS  20           1HB      CYS  20   0.210  -1.715   2.910
  118    HB3  CYS  20           2HB      CYS  20   0.384  -1.443   1.191
  119    H    ARG  21           H        ARG  21   2.110   2.115   3.208
  120    HA   ARG  21           HA       ARG  21  -0.491   2.833   4.081
  121    HE   ARG  21           HE       ARG  21   2.412   4.925   8.269
  122    HB2  ARG  21           1HB      ARG  21   1.917   4.556   3.478
  123    HB3  ARG  21           2HB      ARG  21   0.432   5.158   4.194
  124    HG2  ARG  21           1HG      ARG  21   1.108   3.001   5.789
  125    HG3  ARG  21           2HG      ARG  21   2.653   3.772   5.426
  126    HD2  ARG  21           1HD      ARG  21   1.005   5.907   5.977
  127    HD3  ARG  21           2HD      ARG  21   0.455   4.677   7.115
  128   HH11  ARG  21          1HH1      ARG  21   2.796   6.335   5.100
  129   HH12  ARG  21          2HH1      ARG  21   4.347   7.019   5.455
  130   HH21  ARG  21          1HH2      ARG  21   4.452   5.824   8.737
  131   HH22  ARG  21          2HH2      ARG  21   5.287   6.729   7.519
  132    H    LEU  22           H        LEU  22  -1.957   4.273   3.237
  133    HA   LEU  22           HA       LEU  22  -2.765   3.984   0.665
  134    HG   LEU  22           HG       LEU  22  -3.805   6.539  -0.148
  135    HB2  LEU  22           1HB      LEU  22  -4.205   4.965   2.351
  136    HB3  LEU  22           2HB      LEU  22  -3.184   6.391   2.428
  137   HD11  LEU  22          1HD1      LEU  22  -5.763   4.656   1.014
  138   HD12  LEU  22          2HD1      LEU  22  -5.181   4.813  -0.643
  139   HD13  LEU  22          3HD1      LEU  22  -6.403   5.926  -0.028
  140   HD21  LEU  22          3HD2      LEU  22  -5.996   7.386   1.664
  141   HD22  LEU  22          1HD2      LEU  22  -5.130   8.297   0.427
  142   HD23  LEU  22          2HD2      LEU  22  -4.375   8.001   1.993
  143    H    SER  23           H        SER  23  -1.000   6.758   1.917
  144    HA   SER  23           HA       SER  23  -0.652   8.121  -0.482
  145    HG   SER  23           HG       SER  23  -0.736   9.989   0.994
  146    HB2  SER  23           1HB      SER  23   1.064   8.039   2.001
  147    HB3  SER  23           2HB      SER  23   1.363   9.145   0.661
  148    H    CYS  24           H        CYS  24   1.025   5.321   0.730
  149    HA   CYS  24           HA       CYS  24   3.105   5.595  -1.282
  150    HB2  CYS  24           1HB      CYS  24   3.634   4.850   1.098
  151    HB3  CYS  24           2HB      CYS  24   2.782   3.356   0.729
  152    H    CYS  25           H        CYS  25   0.459   3.321  -0.495
  153    HA   CYS  25           HA       CYS  25   1.054   1.513  -2.519
  154    HB2  CYS  25           1HB      CYS  25  -1.468   2.199  -1.078
  155    HB3  CYS  25           2HB      CYS  25  -1.483   1.032  -2.385
  156    H    SER  26           H        SER  26  -1.519   3.946  -2.665
  157    HA   SER  26           HA       SER  26  -1.677   3.684  -5.497
  158    HG   SER  26           HG       SER  26  -4.112   6.536  -4.851
  159    HB2  SER  26           1HB      SER  26  -3.745   4.198  -4.845
  160    HB3  SER  26           2HB      SER  26  -3.195   5.075  -3.419
  161    H    LEU  27           H        LEU  27  -1.062   6.552  -3.562
  162    HA   LEU  27           HA       LEU  27  -0.036   8.053  -5.710
  163    HG   LEU  27           HG       LEU  27   0.408  10.924  -3.404
  164    HB2  LEU  27           1HB      LEU  27  -1.004   9.158  -3.817
  165    HB3  LEU  27           2HB      LEU  27   0.157   8.440  -2.724
  166   HD11  LEU  27          1HD1      LEU  27   2.692  10.853  -2.944
  167   HD12  LEU  27          2HD1      LEU  27   2.892   9.272  -3.697
  168   HD13  LEU  27          3HD1      LEU  27   2.039   9.415  -2.162
  169   HD21  LEU  27          3HD2      LEU  27   0.994  11.480  -5.477
  170   HD22  LEU  27          1HD2      LEU  27   0.504   9.854  -5.947
  171   HD23  LEU  27          2HD2      LEU  27   2.193  10.193  -5.573
  172    H    GLY  28           H        GLY  28   1.450   5.676  -3.713
  173    HA2  GLY  28           1HA      GLY  28   4.122   6.630  -4.513
  174    HA3  GLY  28           2HA      GLY  28   3.801   5.526  -3.184
  Start of MODEL    4
    1    HA   ALA   1           HA       ALA   1   7.894 -12.334  -0.371
    2    H1   ALA   1           1H       ALA   1   6.009 -13.873   0.199
    3    H2   ALA   1           2H       ALA   1   7.585 -14.257   0.763
    4    H3   ALA   1           3H       ALA   1   6.930 -15.084  -0.591
    5    HB1  ALA   1           3HB      ALA   1   9.323 -12.924  -2.135
    6    HB2  ALA   1           1HB      ALA   1   8.374 -14.354  -2.541
    7    HB3  ALA   1           2HB      ALA   1   9.332 -14.322  -1.062
    8    H    GLN   2           H        GLN   2   5.394 -11.927  -0.435
    9    HA   GLN   2           HA       GLN   2   4.769 -11.281  -3.214
   10    HB2  GLN   2           1HB      GLN   2   2.981 -12.853  -1.365
   11    HB3  GLN   2           2HB      GLN   2   2.364 -11.994  -2.769
   12    HG2  GLN   2           1HG      GLN   2   3.244 -13.471  -4.239
   13    HG3  GLN   2           2HG      GLN   2   4.635 -13.832  -3.216
   14   HE21  GLN   2          1HE2      GLN   2   4.423 -16.038  -3.426
   15   HE22  GLN   2          2HE2      GLN   2   3.137 -16.929  -2.693
   16    H    ASN   3           H        ASN   3   3.306  -9.540  -3.470
   17    HA   ASN   3           HA       ASN   3   3.204  -7.779  -1.139
   18    HB2  ASN   3           1HB      ASN   3   4.267  -6.716  -2.941
   19    HB3  ASN   3           2HB      ASN   3   3.098  -7.322  -4.103
   20   HD21  ASN   3          1HD2      ASN   3   2.631  -5.403  -4.919
   21   HD22  ASN   3          2HD2      ASN   3   1.749  -4.172  -4.079
   22    HA   PRO   4           HA       PRO   4  -1.209  -9.220  -1.538
   23    HB2  PRO   4           1HB      PRO   4  -1.845  -8.944   1.094
   24    HB3  PRO   4           2HB      PRO   4  -1.111 -10.404   0.419
   25    HG2  PRO   4           1HG      PRO   4   0.197  -8.116   1.852
   26    HG3  PRO   4           2HG      PRO   4   0.453  -9.860   2.062
   27    HD2  PRO   4           1HD      PRO   4   2.138  -8.348   0.655
   28    HD3  PRO   4           2HD      PRO   4   1.776 -10.017   0.172
   29    H    CYS   5           H        CYS   5   0.262  -6.369  -0.361
   30    HA   CYS   5           HA       CYS   5  -1.995  -4.868   0.303
   31    HB2  CYS   5           1HB      CYS   5   0.614  -3.832  -0.821
   32    HB3  CYS   5           2HB      CYS   5  -0.540  -2.969   0.182
   33    H    SER   6           H        SER   6  -0.534  -5.644  -2.753
   34    HA   SER   6           HA       SER   6  -1.764  -3.692  -4.364
   35    HG   SER   6           HG       SER   6  -0.859  -7.375  -5.657
   36    HB2  SER   6           1HB      SER   6  -1.483  -5.445  -6.201
   37    HB3  SER   6           2HB      SER   6  -0.016  -4.941  -5.366
   38    H    LEU   7           H        LEU   7  -2.768  -6.824  -3.228
   39    HA   LEU   7           HA       LEU   7  -5.213  -7.034  -4.660
   40    HG   LEU   7           HG       LEU   7  -6.055  -9.050  -4.614
   41    HB2  LEU   7           1HB      LEU   7  -3.747  -8.740  -3.180
   42    HB3  LEU   7           2HB      LEU   7  -4.945  -8.301  -1.998
   43   HD11  LEU   7          1HD1      LEU   7  -5.764 -11.525  -3.913
   44   HD12  LEU   7          2HD1      LEU   7  -4.358 -10.932  -3.028
   45   HD13  LEU   7          3HD1      LEU   7  -4.457 -10.712  -4.775
   46   HD21  LEU   7          3HD2      LEU   7  -7.318 -10.574  -2.846
   47   HD22  LEU   7          1HD2      LEU   7  -7.702  -8.865  -3.055
   48   HD23  LEU   7          2HD2      LEU   7  -6.660  -9.378  -1.729
   49    H    GLN   8           H        GLN   8  -4.203  -5.646  -1.678
   50    HA   GLN   8           HA       GLN   8  -6.877  -5.098  -0.718
   51    HB2  GLN   8           1HB      GLN   8  -4.354  -3.896   0.397
   52    HB3  GLN   8           2HB      GLN   8  -5.862  -4.239   1.230
   53    HG2  GLN   8           1HG      GLN   8  -5.118  -6.729   0.434
   54    HG3  GLN   8           2HG      GLN   8  -3.550  -5.965   0.716
   55   HE21  GLN   8          1HE2      GLN   8  -3.088  -5.148   2.799
   56   HE22  GLN   8          2HE2      GLN   8  -3.915  -5.744   4.193
   57    H    GLN   9           H        GLN   9  -4.328  -3.406  -2.400
   58    HA   GLN   9           HA       GLN   9  -6.139  -1.207  -2.920
   59    HB2  GLN   9           1HB      GLN   9  -3.419  -0.910  -1.659
   60    HB3  GLN   9           2HB      GLN   9  -4.205   0.411  -2.512
   61    HG2  GLN   9           1HG      GLN   9  -6.173   0.015  -0.930
   62    HG3  GLN   9           2HG      GLN   9  -5.044  -0.936   0.030
   63   HE21  GLN   9          1HE2      GLN   9  -3.199   0.157   0.958
   64   HE22  GLN   9          2HE2      GLN   9  -3.244   1.862   1.220
   65    HA   PRO  10           HA       PRO  10  -4.326  -1.972  -6.916
   66    HB2  PRO  10           1HB      PRO  10  -5.344   0.146  -8.261
   67    HB3  PRO  10           2HB      PRO  10  -6.315  -1.260  -7.810
   68    HG2  PRO  10           1HG      PRO  10  -6.118   1.413  -6.480
   69    HG3  PRO  10           2HG      PRO  10  -7.554   0.422  -6.797
   70    HD2  PRO  10           1HD      PRO  10  -6.336   0.528  -4.373
   71    HD3  PRO  10           2HD      PRO  10  -7.191  -0.914  -4.959
   72    H    GLY  11           H        GLY  11  -2.552  -1.415  -8.037
   73    HA2  GLY  11           1HA      GLY  11  -0.701  -0.201  -8.746
   74    HA3  GLY  11           2HA      GLY  11  -1.463   1.226  -8.086
   75    H    CYS  12           H        CYS  12  -1.490  -0.506  -5.410
   76    HA   CYS  12           HA       CYS  12   0.563   0.803  -4.144
   77    HB2  CYS  12           1HB      CYS  12  -1.229  -0.405  -3.008
   78    HB3  CYS  12           2HB      CYS  12  -0.490  -1.914  -3.490
   79    H    SER  13           H        SER  13   2.554   0.753  -4.392
   80    HA   SER  13           HA       SER  13   4.129  -1.105  -5.754
   81    HG   SER  13           HG       SER  13   6.538  -0.553  -5.412
   82    HB2  SER  13           1HB      SER  13   4.932   1.133  -5.505
   83    HB3  SER  13           2HB      SER  13   4.867   1.026  -3.750
   84    H    SER  14           H        SER  14   5.110  -2.958  -5.125
   85    HA   SER  14           HA       SER  14   4.402  -4.248  -2.721
   86    HG   SER  14           HG       SER  14   5.443  -5.093  -5.895
   87    HB2  SER  14           1HB      SER  14   6.874  -4.783  -4.359
   88    HB3  SER  14           2HB      SER  14   6.019  -5.919  -3.319
   89    H    ALA  15           H        ALA  15   7.016  -2.181  -3.627
   90    HA   ALA  15           HA       ALA  15   8.751  -2.592  -1.467
   91    HB1  ALA  15           3HB      ALA  15   9.876  -1.484  -3.090
   92    HB2  ALA  15           1HB      ALA  15   9.350  -0.075  -2.168
   93    HB3  ALA  15           2HB      ALA  15   8.455  -0.574  -3.603
   94    H    CYS  16           H        CYS  16   5.703  -1.161  -1.591
   95    HA   CYS  16           HA       CYS  16   6.163   0.743   0.543
   96    HB2  CYS  16           1HB      CYS  16   3.649  -0.263  -0.806
   97    HB3  CYS  16           2HB      CYS  16   3.605   0.815   0.579
   98    H    ALA  17           H        ALA  17   5.471  -2.600   0.186
   99    HA   ALA  17           HA       ALA  17   4.211  -2.988   2.728
  100    HB1  ALA  17           3HB      ALA  17   3.786  -4.983   1.832
  101    HB2  ALA  17           1HB      ALA  17   5.504  -5.380   1.906
  102    HB3  ALA  17           2HB      ALA  17   4.842  -4.595   0.474
  103    HA   PRO  18           HA       PRO  18   4.272  -4.995   4.103
  104    HB2  PRO  18           1HB      PRO  18   4.326  -5.131   6.770
  105    HB3  PRO  18           2HB      PRO  18   5.322  -6.187   5.763
  106    HG2  PRO  18           1HG      PRO  18   6.084  -3.684   7.223
  107    HG3  PRO  18           2HG      PRO  18   6.956  -5.224   7.120
  108    HD2  PRO  18           1HD      PRO  18   7.583  -3.057   5.594
  109    HD3  PRO  18           2HD      PRO  18   7.847  -4.730   5.069
  110    H    ALA  19           H        ALA  19   5.103  -1.808   4.937
  111    HA   ALA  19           HA       ALA  19   2.949  -1.099   6.608
  112    HB1  ALA  19           3HB      ALA  19   5.093   0.289   5.194
  113    HB2  ALA  19           1HB      ALA  19   4.392   0.599   6.781
  114    HB3  ALA  19           2HB      ALA  19   3.607   1.230   5.334
  115    H    CYS  20           H        CYS  20   3.510  -0.424   3.204
  116    HA   CYS  20           HA       CYS  20   2.204   0.033   1.495
  117    HB2  CYS  20           1HB      CYS  20   0.223  -1.790   2.828
  118    HB3  CYS  20           2HB      CYS  20   0.393  -1.439   1.123
  119    H    ARG  21           H        ARG  21   2.077   2.044   3.300
  120    HA   ARG  21           HA       ARG  21  -0.537   2.710   4.174
  121    HE   ARG  21           HE       ARG  21   1.496   6.842   5.918
  122    HB2  ARG  21           1HB      ARG  21   1.875   4.464   3.680
  123    HB3  ARG  21           2HB      ARG  21   0.376   5.038   4.389
  124    HG2  ARG  21           1HG      ARG  21   0.918   2.910   5.979
  125    HG3  ARG  21           2HG      ARG  21   2.544   3.467   5.578
  126    HD2  ARG  21           1HD      ARG  21   0.318   5.098   6.793
  127    HD3  ARG  21           2HD      ARG  21   1.791   4.555   7.597
  128   HH11  ARG  21          1HH1      ARG  21   3.757   4.383   6.928
  129   HH12  ARG  21          2HH1      ARG  21   5.152   5.357   6.606
  130   HH21  ARG  21          1HH2      ARG  21   3.330   8.124   5.492
  131   HH22  ARG  21          2HH2      ARG  21   4.910   7.480   5.791
  132    H    LEU  22           H        LEU  22  -1.994   4.190   3.376
  133    HA   LEU  22           HA       LEU  22  -2.777   4.005   0.788
  134    HG   LEU  22           HG       LEU  22  -4.387   5.764  -0.028
  135    HB2  LEU  22           1HB      LEU  22  -4.229   4.928   2.496
  136    HB3  LEU  22           2HB      LEU  22  -3.204   6.345   2.638
  137   HD11  LEU  22          1HD1      LEU  22  -6.411   5.525   0.977
  138   HD12  LEU  22          2HD1      LEU  22  -6.336   7.286   0.927
  139   HD13  LEU  22          3HD1      LEU  22  -5.932   6.428   2.415
  140   HD21  LEU  22          3HD2      LEU  22  -3.018   7.645  -0.018
  141   HD22  LEU  22          1HD2      LEU  22  -3.583   8.168   1.569
  142   HD23  LEU  22          2HD2      LEU  22  -4.638   8.321   0.164
  143    H    SER  23           H        SER  23  -1.011   6.716   2.167
  144    HA   SER  23           HA       SER  23  -0.629   8.175  -0.170
  145    HG   SER  23           HG       SER  23   1.502  10.295   1.410
  146    HB2  SER  23           1HB      SER  23  -0.016   8.617   2.401
  147    HB3  SER  23           2HB      SER  23   1.587   8.178   1.811
  148    H    CYS  24           H        CYS  24   1.014   5.315   0.932
  149    HA   CYS  24           HA       CYS  24   3.124   5.656  -1.035
  150    HB2  CYS  24           1HB      CYS  24   3.615   4.813   1.322
  151    HB3  CYS  24           2HB      CYS  24   2.763   3.339   0.881
  152    H    CYS  25           H        CYS  25   0.448   3.379  -0.374
  153    HA   CYS  25           HA       CYS  25   1.055   1.637  -2.452
  154    HB2  CYS  25           1HB      CYS  25  -1.482   2.302  -1.028
  155    HB3  CYS  25           2HB      CYS  25  -1.490   1.184  -2.377
  156    H    SER  26           H        SER  26  -1.493   4.096  -2.556
  157    HA   SER  26           HA       SER  26  -1.588   3.950  -5.401
  158    HG   SER  26           HG       SER  26  -3.141   7.103  -4.684
  159    HB2  SER  26           1HB      SER  26  -3.663   4.385  -4.578
  160    HB3  SER  26           2HB      SER  26  -3.062   5.473  -3.324
  161    H    LEU  27           H        LEU  27  -0.434   6.315  -3.109
  162    HA   LEU  27           HA       LEU  27   0.740   7.868  -5.304
  163    HG   LEU  27           HG       LEU  27   0.746  10.093  -5.151
  164    HB2  LEU  27           1HB      LEU  27  -0.788   8.797  -3.371
  165    HB3  LEU  27           2HB      LEU  27   0.716   8.812  -2.474
  166   HD11  LEU  27          1HD1      LEU  27  -0.578  11.855  -4.691
  167   HD12  LEU  27          2HD1      LEU  27  -0.196  11.831  -2.970
  168   HD13  LEU  27          3HD1      LEU  27  -1.385  10.705  -3.625
  169   HD21  LEU  27          3HD2      LEU  27   2.022  10.510  -2.473
  170   HD22  LEU  27          1HD2      LEU  27   2.053  11.773  -3.703
  171   HD23  LEU  27          2HD2      LEU  27   2.783  10.203  -4.034
  172    H    GLY  28           H        GLY  28   2.053   5.486  -4.700
  173    HA2  GLY  28           1HA      GLY  28   4.675   6.489  -4.119
  174    HA3  GLY  28           2HA      GLY  28   4.048   5.488  -2.816
  Start of MODEL    5
    1    HA   ALA   1           HA       ALA   1   6.228 -13.177  -0.012
    2    H1   ALA   1           1H       ALA   1   7.906 -14.341  -1.336
    3    H2   ALA   1           2H       ALA   1   7.393 -13.427  -2.695
    4    H3   ALA   1           3H       ALA   1   6.296 -14.486  -1.907
    5    HB1  ALA   1           3HB      ALA   1   8.674 -12.622  -0.096
    6    HB2  ALA   1           1HB      ALA   1   7.619 -11.289   0.375
    7    HB3  ALA   1           2HB      ALA   1   8.276 -11.358  -1.260
    8    H    GLN   2           H        GLN   2   4.624 -13.420  -2.171
    9    HA   GLN   2           HA       GLN   2   4.013 -11.419  -3.861
   10    HB2  GLN   2           1HB      GLN   2   1.553 -11.950  -3.408
   11    HB3  GLN   2           2HB      GLN   2   2.588 -13.274  -3.900
   12    HG2  GLN   2           1HG      GLN   2   2.199 -12.788  -0.994
   13    HG3  GLN   2           2HG      GLN   2   0.879 -13.502  -1.915
   14   HE21  GLN   2          1HE2      GLN   2   2.915 -14.464   0.167
   15   HE22  GLN   2          2HE2      GLN   2   3.482 -15.957  -0.491
   16    H    ASN   3           H        ASN   3   2.819  -9.519  -3.884
   17    HA   ASN   3           HA       ASN   3   2.943  -7.997  -1.412
   18    HB2  ASN   3           1HB      ASN   3   3.935  -6.953  -3.312
   19    HB3  ASN   3           2HB      ASN   3   2.512  -7.256  -4.296
   20   HD21  ASN   3          1HD2      ASN   3   2.239  -5.213  -4.850
   21   HD22  ASN   3          2HD2      ASN   3   1.716  -3.965  -3.770
   22    HA   PRO   4           HA       PRO   4  -1.567  -9.056  -1.393
   23    HB2  PRO   4           1HB      PRO   4  -1.991  -8.622   1.255
   24    HB3  PRO   4           2HB      PRO   4  -1.374 -10.146   0.609
   25    HG2  PRO   4           1HG      PRO   4   0.137  -7.856   1.819
   26    HG3  PRO   4           2HG      PRO   4   0.327  -9.596   2.107
   27    HD2  PRO   4           1HD      PRO   4   1.979  -8.248   0.502
   28    HD3  PRO   4           2HD      PRO   4   1.498  -9.921   0.144
   29    H    CYS   5           H        CYS   5   0.082  -6.254  -0.247
   30    HA   CYS   5           HA       CYS   5  -2.080  -4.623   0.370
   31    HB2  CYS   5           1HB      CYS   5   0.578  -3.741  -0.772
   32    HB3  CYS   5           2HB      CYS   5  -0.526  -2.807   0.221
   33    H    SER   6           H        SER   6  -0.677  -5.533  -2.670
   34    HA   SER   6           HA       SER   6  -1.780  -3.533  -4.318
   35    HG   SER   6           HG       SER   6  -0.151  -3.796  -5.880
   36    HB2  SER   6           1HB      SER   6  -0.825  -6.332  -4.794
   37    HB3  SER   6           2HB      SER   6  -1.713  -5.498  -6.066
   38    H    LEU   7           H        LEU   7  -2.986  -6.598  -3.177
   39    HA   LEU   7           HA       LEU   7  -5.441  -6.640  -4.601
   40    HG   LEU   7           HG       LEU   7  -7.079  -8.599  -3.439
   41    HB2  LEU   7           1HB      LEU   7  -4.081  -8.447  -3.140
   42    HB3  LEU   7           2HB      LEU   7  -5.253  -7.949  -1.956
   43   HD11  LEU   7          1HD1      LEU   7  -6.239  -8.179  -5.596
   44   HD12  LEU   7          2HD1      LEU   7  -6.453  -9.926  -5.504
   45   HD13  LEU   7          3HD1      LEU   7  -4.842  -9.225  -5.344
   46   HD21  LEU   7          3HD2      LEU   7  -5.315 -10.977  -3.549
   47   HD22  LEU   7          1HD2      LEU   7  -6.963 -10.812  -2.941
   48   HD23  LEU   7          2HD2      LEU   7  -5.602 -10.251  -1.968
   49    H    GLN   8           H        GLN   8  -4.353  -5.346  -1.605
   50    HA   GLN   8           HA       GLN   8  -6.993  -4.657  -0.640
   51    HB2  GLN   8           1HB      GLN   8  -4.415  -3.600   0.495
   52    HB3  GLN   8           2HB      GLN   8  -5.939  -3.886   1.321
   53    HG2  GLN   8           1HG      GLN   8  -5.311  -6.396   0.497
   54    HG3  GLN   8           2HG      GLN   8  -3.708  -5.709   0.782
   55   HE21  GLN   8          1HE2      GLN   8  -5.720  -7.642   2.182
   56   HE22  GLN   8          2HE2      GLN   8  -5.596  -7.169   3.840
   57    H    GLN   9           H        GLN   9  -4.346  -3.108  -2.289
   58    HA   GLN   9           HA       GLN   9  -6.013  -0.778  -2.801
   59    HB2  GLN   9           1HB      GLN   9  -3.259  -0.673  -1.573
   60    HB3  GLN   9           2HB      GLN   9  -4.006   0.708  -2.364
   61    HG2  GLN   9           1HG      GLN   9  -4.926   1.234  -0.421
   62    HG3  GLN   9           2HG      GLN   9  -5.923  -0.209  -0.568
   63   HE21  GLN   9          1HE2      GLN   9  -2.897   1.043   0.759
   64   HE22  GLN   9          2HE2      GLN   9  -2.741  -0.158   1.990
   65    HA   PRO  10           HA       PRO  10  -4.403  -2.300  -6.802
   66    HB2  PRO  10           1HB      PRO  10  -5.797   0.253  -7.509
   67    HB3  PRO  10           2HB      PRO  10  -5.812  -1.304  -8.348
   68    HG2  PRO  10           1HG      PRO  10  -7.867  -0.590  -6.830
   69    HG3  PRO  10           2HG      PRO  10  -7.276  -2.263  -6.816
   70    HD2  PRO  10           1HD      PRO  10  -6.954  -0.121  -4.779
   71    HD3  PRO  10           2HD      PRO  10  -7.083  -1.879  -4.561
   72    H    GLY  11           H        GLY  11  -2.656  -1.773  -7.989
   73    HA2  GLY  11           1HA      GLY  11  -0.847  -0.562  -8.797
   74    HA3  GLY  11           2HA      GLY  11  -1.605   0.881  -8.168
   75    H    CYS  12           H        CYS  12  -1.563  -0.723  -5.426
   76    HA   CYS  12           HA       CYS  12   0.532   0.627  -4.275
   77    HB2  CYS  12           1HB      CYS  12  -1.232  -0.504  -3.028
   78    HB3  CYS  12           2HB      CYS  12  -0.532  -2.044  -3.467
   79    H    SER  13           H        SER  13   2.517   0.547  -4.565
   80    HA   SER  13           HA       SER  13   4.041  -1.381  -5.885
   81    HG   SER  13           HG       SER  13   6.941   0.479  -4.719
   82    HB2  SER  13           1HB      SER  13   4.875   0.849  -5.765
   83    HB3  SER  13           2HB      SER  13   4.835   0.839  -4.008
   84    H    SER  14           H        SER  14   5.070  -3.190  -5.204
   85    HA   SER  14           HA       SER  14   4.406  -4.406  -2.739
   86    HG   SER  14           HG       SER  14   7.058  -5.942  -2.546
   87    HB2  SER  14           1HB      SER  14   5.195  -5.721  -4.668
   88    HB3  SER  14           2HB      SER  14   6.773  -4.942  -4.533
   89    H    ALA  15           H        ALA  15   7.006  -2.379  -3.780
   90    HA   ALA  15           HA       ALA  15   8.763  -2.680  -1.620
   91    HB1  ALA  15           3HB      ALA  15   9.771  -1.705  -3.449
   92    HB2  ALA  15           1HB      ALA  15   9.497  -0.303  -2.415
   93    HB3  ALA  15           2HB      ALA  15   8.407  -0.633  -3.762
   94    H    CYS  16           H        CYS  16   5.716  -1.265  -1.795
   95    HA   CYS  16           HA       CYS  16   6.196   0.749   0.238
   96    HB2  CYS  16           1HB      CYS  16   3.672  -0.318  -1.039
   97    HB3  CYS  16           2HB      CYS  16   3.632   0.807   0.307
   98    H    ALA  17           H        ALA  17   5.481  -2.603   0.051
   99    HA   ALA  17           HA       ALA  17   4.275  -2.866   2.635
  100    HB1  ALA  17           3HB      ALA  17   4.874  -4.586   0.440
  101    HB2  ALA  17           1HB      ALA  17   3.798  -4.878   1.806
  102    HB3  ALA  17           2HB      ALA  17   5.504  -5.311   1.918
  103    HA   PRO  18           HA       PRO  18   4.356  -4.804   4.098
  104    HB2  PRO  18           1HB      PRO  18   4.496  -4.854   6.761
  105    HB3  PRO  18           2HB      PRO  18   5.457  -5.949   5.762
  106    HG2  PRO  18           1HG      PRO  18   6.275  -3.402   7.112
  107    HG3  PRO  18           2HG      PRO  18   7.134  -4.951   7.038
  108    HD2  PRO  18           1HD      PRO  18   7.727  -2.844   5.416
  109    HD3  PRO  18           2HD      PRO  18   7.969  -4.535   4.948
  110    H    ALA  19           H        ALA  19   5.254  -1.603   4.779
  111    HA   ALA  19           HA       ALA  19   3.180  -0.794   6.506
  112    HB1  ALA  19           3HB      ALA  19   3.816   1.468   5.103
  113    HB2  ALA  19           1HB      ALA  19   5.283   0.500   4.946
  114    HB3  ALA  19           2HB      ALA  19   4.649   0.891   6.545
  115    H    CYS  20           H        CYS  20   3.613  -0.305   3.052
  116    HA   CYS  20           HA       CYS  20   2.247   0.082   1.371
  117    HB2  CYS  20           1HB      CYS  20   0.282  -1.602   2.896
  118    HB3  CYS  20           2HB      CYS  20   0.390  -1.363   1.167
  119    H    ARG  21           H        ARG  21   2.236   2.201   3.072
  120    HA   ARG  21           HA       ARG  21  -0.333   2.969   3.998
  121    HE   ARG  21           HE       ARG  21   3.181   4.317   7.463
  122    HB2  ARG  21           1HB      ARG  21   2.095   4.640   3.328
  123    HB3  ARG  21           2HB      ARG  21   0.631   5.288   4.047
  124    HG2  ARG  21           1HG      ARG  21   1.166   3.256   5.749
  125    HG3  ARG  21           2HG      ARG  21   2.796   3.723   5.258
  126    HD2  ARG  21           1HD      ARG  21   2.075   6.117   5.762
  127    HD3  ARG  21           2HD      ARG  21   0.683   5.406   6.575
  128   HH11  ARG  21          1HH1      ARG  21   0.927   6.951   7.868
  129   HH12  ARG  21          2HH1      ARG  21   1.431   7.299   9.488
  130   HH21  ARG  21          1HH2      ARG  21   3.845   4.773   9.593
  131   HH22  ARG  21          2HH2      ARG  21   3.088   6.062  10.467
  132    H    LEU  22           H        LEU  22  -1.803   4.407   3.163
  133    HA   LEU  22           HA       LEU  22  -2.661   4.097   0.609
  134    HG   LEU  22           HG       LEU  22  -4.234   5.866  -0.268
  135    HB2  LEU  22           1HB      LEU  22  -4.063   5.113   2.302
  136    HB3  LEU  22           2HB      LEU  22  -3.021   6.525   2.357
  137   HD11  LEU  22          1HD1      LEU  22  -5.817   6.993   2.036
  138   HD12  LEU  22          2HD1      LEU  22  -6.121   5.478   1.189
  139   HD13  LEU  22          3HD1      LEU  22  -6.326   7.014   0.348
  140   HD21  LEU  22          3HD2      LEU  22  -3.310   8.242   1.251
  141   HD22  LEU  22          1HD2      LEU  22  -4.593   8.473   0.063
  142   HD23  LEU  22          2HD2      LEU  22  -3.042   7.799  -0.435
  143    H    SER  23           H        SER  23  -0.832   6.857   1.797
  144    HA   SER  23           HA       SER  23  -0.514   8.193  -0.621
  145    HG   SER  23           HG       SER  23   0.066   9.983   2.244
  146    HB2  SER  23           1HB      SER  23   1.650   8.175   1.466
  147    HB3  SER  23           2HB      SER  23   1.104   9.509   0.450
  148    H    CYS  24           H        CYS  24   1.141   5.374   0.583
  149    HA   CYS  24           HA       CYS  24   3.183   5.594  -1.476
  150    HB2  CYS  24           1HB      CYS  24   3.749   4.863   0.900
  151    HB3  CYS  24           2HB      CYS  24   2.864   3.380   0.564
  152    H    CYS  25           H        CYS  25   0.527   3.362  -0.606
  153    HA   CYS  25           HA       CYS  25   1.048   1.534  -2.634
  154    HB2  CYS  25           1HB      CYS  25  -1.424   2.256  -1.125
  155    HB3  CYS  25           2HB      CYS  25  -1.491   1.084  -2.427
  156    H    SER  26           H        SER  26  -1.509   3.985  -2.726
  157    HA   SER  26           HA       SER  26  -1.739   3.711  -5.554
  158    HG   SER  26           HG       SER  26  -3.219   6.926  -4.544
  159    HB2  SER  26           1HB      SER  26  -3.789   4.236  -4.859
  160    HB3  SER  26           2HB      SER  26  -3.203   5.108  -3.444
  161    H    LEU  27           H        LEU  27  -1.074   6.583  -3.647
  162    HA   LEU  27           HA       LEU  27  -0.090   8.081  -5.820
  163    HG   LEU  27           HG       LEU  27   1.971   9.746  -3.958
  164    HB2  LEU  27           1HB      LEU  27  -1.000   9.199  -3.910
  165    HB3  LEU  27           2HB      LEU  27   0.178   8.459  -2.844
  166   HD11  LEU  27          1HD1      LEU  27  -0.300  10.556  -5.681
  167   HD12  LEU  27          2HD1      LEU  27   1.393  10.280  -6.089
  168   HD13  LEU  27          3HD1      LEU  27   0.911  11.779  -5.296
  169   HD21  LEU  27          3HD2      LEU  27   0.357  10.565  -2.011
  170   HD22  LEU  27          1HD2      LEU  27  -0.026  11.803  -3.207
  171   HD23  LEU  27          2HD2      LEU  27   1.638  11.585  -2.665
  172    H    GLY  28           H        GLY  28   1.409   5.647  -3.956
  173    HA2  GLY  28           1HA      GLY  28   4.075   6.617  -4.773
  174    HA3  GLY  28           2HA      GLY  28   3.780   5.534  -3.420
  Start of MODEL    6
    1    HA   ALA   1           HA       ALA   1   2.886 -15.614  -0.870
    2    H1   ALA   1           1H       ALA   1   4.223 -16.954  -2.111
    3    H2   ALA   1           2H       ALA   1   4.873 -17.072  -0.527
    4    H3   ALA   1           3H       ALA   1   5.648 -16.093  -1.705
    5    HB1  ALA   1           3HB      ALA   1   3.796 -15.364   1.203
    6    HB2  ALA   1           1HB      ALA   1   4.148 -13.766   0.545
    7    HB3  ALA   1           2HB      ALA   1   5.404 -15.004   0.577
    8    H    GLN   2           H        GLN   2   2.134 -13.608  -1.556
    9    HA   GLN   2           HA       GLN   2   3.910 -12.114  -3.368
   10    HB2  GLN   2           1HB      GLN   2   1.011 -12.828  -3.849
   11    HB3  GLN   2           2HB      GLN   2   1.957 -11.741  -4.856
   12    HG2  GLN   2           1HG      GLN   2   3.423 -13.522  -5.506
   13    HG3  GLN   2           2HG      GLN   2   2.650 -14.628  -4.371
   14   HE21  GLN   2          1HE2      GLN   2   2.134 -16.079  -6.008
   15   HE22  GLN   2          2HE2      GLN   2   0.874 -15.770  -7.148
   16    H    ASN   3           H        ASN   3   3.592  -9.891  -3.480
   17    HA   ASN   3           HA       ASN   3   3.035  -8.483  -1.242
   18    HB2  ASN   3           1HB      ASN   3   4.178  -7.439  -3.011
   19    HB3  ASN   3           2HB      ASN   3   2.875  -7.754  -4.147
   20   HD21  ASN   3          1HD2      ASN   3   2.835  -5.668  -4.756
   21   HD22  ASN   3          2HD2      ASN   3   2.157  -4.404  -3.786
   22    HA   PRO   4           HA       PRO   4  -1.499  -9.214  -1.338
   23    HB2  PRO   4           1HB      PRO   4  -1.997  -8.620   1.259
   24    HB3  PRO   4           2HB      PRO   4  -1.394 -10.194   0.730
   25    HG2  PRO   4           1HG      PRO   4   0.116  -7.877   1.882
   26    HG3  PRO   4           2HG      PRO   4   0.265  -9.605   2.253
   27    HD2  PRO   4           1HD      PRO   4   1.981  -8.314   0.636
   28    HD3  PRO   4           2HD      PRO   4   1.558 -10.021   0.395
   29    H    CYS   5           H        CYS   5   0.300  -6.411  -0.655
   30    HA   CYS   5           HA       CYS   5  -1.672  -4.591   0.018
   31    HB2  CYS   5           1HB      CYS   5   0.782  -4.009  -1.651
   32    HB3  CYS   5           2HB      CYS   5  -0.112  -2.907  -0.622
   33    H    SER   6           H        SER   6  -0.737  -5.947  -3.060
   34    HA   SER   6           HA       SER   6  -2.058  -4.145  -4.758
   35    HG   SER   6           HG       SER   6   0.297  -5.372  -5.025
   36    HB2  SER   6           1HB      SER   6  -1.955  -7.029  -5.462
   37    HB3  SER   6           2HB      SER   6  -1.599  -5.617  -6.452
   38    H    LEU   7           H        LEU   7  -3.141  -7.063  -3.151
   39    HA   LEU   7           HA       LEU   7  -5.699  -7.235  -4.349
   40    HG   LEU   7           HG       LEU   7  -6.516  -9.334  -4.097
   41    HB2  LEU   7           1HB      LEU   7  -4.249  -8.906  -2.857
   42    HB3  LEU   7           2HB      LEU   7  -5.266  -8.258  -1.601
   43   HD11  LEU   7          1HD1      LEU   7  -4.782 -10.920  -2.844
   44   HD12  LEU   7          2HD1      LEU   7  -6.297 -11.515  -3.524
   45   HD13  LEU   7          3HD1      LEU   7  -6.180 -11.167  -1.799
   46   HD21  LEU   7          3HD2      LEU   7  -7.457  -9.403  -1.240
   47   HD22  LEU   7          1HD2      LEU   7  -8.402  -9.680  -2.703
   48   HD23  LEU   7          2HD2      LEU   7  -7.793  -8.065  -2.339
   49    H    GLN   8           H        GLN   8  -4.499  -5.784  -1.433
   50    HA   GLN   8           HA       GLN   8  -7.132  -4.933  -0.575
   51    HB2  GLN   8           1HB      GLN   8  -5.965  -3.874   1.302
   52    HB3  GLN   8           2HB      GLN   8  -5.517  -5.561   1.123
   53    HG2  GLN   8           1HG      GLN   8  -3.370  -5.077   0.714
   54    HG3  GLN   8           2HG      GLN   8  -3.766  -3.657  -0.255
   55   HE21  GLN   8          1HE2      GLN   8  -2.082  -2.530   0.789
   56   HE22  GLN   8          2HE2      GLN   8  -2.282  -1.906   2.388
   57    H    GLN   9           H        GLN   9  -4.373  -3.587  -2.166
   58    HA   GLN   9           HA       GLN   9  -5.900  -1.196  -2.808
   59    HB2  GLN   9           1HB      GLN   9  -3.324  -1.271  -1.305
   60    HB3  GLN   9           2HB      GLN   9  -3.615   0.059  -2.420
   61    HG2  GLN   9           1HG      GLN   9  -4.875   1.087  -0.922
   62    HG3  GLN   9           2HG      GLN   9  -5.933  -0.318  -0.818
   63   HE21  GLN   9          1HE2      GLN   9  -2.922   1.055   0.467
   64   HE22  GLN   9          2HE2      GLN   9  -3.022   0.261   1.997
   65    HA   PRO  10           HA       PRO  10  -3.959  -2.327  -6.700
   66    HB2  PRO  10           1HB      PRO  10  -5.143  -0.503  -8.280
   67    HB3  PRO  10           2HB      PRO  10  -6.023  -1.895  -7.638
   68    HG2  PRO  10           1HG      PRO  10  -5.998   0.938  -6.674
   69    HG3  PRO  10           2HG      PRO  10  -7.370  -0.170  -6.858
   70    HD2  PRO  10           1HD      PRO  10  -6.138   0.330  -4.474
   71    HD3  PRO  10           2HD      PRO  10  -6.969  -1.195  -4.849
   72    H    GLY  11           H        GLY  11  -2.358  -1.553  -8.079
   73    HA2  GLY  11           1HA      GLY  11  -0.636  -0.176  -8.824
   74    HA3  GLY  11           2HA      GLY  11  -1.494   1.170  -8.104
   75    H    CYS  12           H        CYS  12  -1.366  -0.474  -5.468
   76    HA   CYS  12           HA       CYS  12   0.645   0.891  -4.218
   77    HB2  CYS  12           1HB      CYS  12  -1.141  -0.352  -3.110
   78    HB3  CYS  12           2HB      CYS  12  -0.344  -1.844  -3.553
   79    H    SER  13           H        SER  13   2.646   0.875  -4.430
   80    HA   SER  13           HA       SER  13   4.275  -0.961  -5.759
   81    HG   SER  13           HG       SER  13   6.644  -0.414  -5.370
   82    HB2  SER  13           1HB      SER  13   5.036   1.299  -5.468
   83    HB3  SER  13           2HB      SER  13   4.958   1.153  -3.715
   84    H    SER  14           H        SER  14   5.258  -2.807  -5.113
   85    HA   SER  14           HA       SER  14   4.505  -4.122  -2.740
   86    HG   SER  14           HG       SER  14   4.843  -6.163  -4.890
   87    HB2  SER  14           1HB      SER  14   7.028  -4.609  -4.317
   88    HB3  SER  14           2HB      SER  14   6.169  -5.764  -3.301
   89    H    ALA  15           H        ALA  15   7.126  -2.012  -3.548
   90    HA   ALA  15           HA       ALA  15   8.806  -2.448  -1.347
   91    HB1  ALA  15           3HB      ALA  15  10.031  -0.612  -2.075
   92    HB2  ALA  15           1HB      ALA  15   8.607   0.206  -2.719
   93    HB3  ALA  15           2HB      ALA  15   9.274  -1.195  -3.556
   94    H    CYS  16           H        CYS  16   5.751  -1.030  -1.527
   95    HA   CYS  16           HA       CYS  16   6.142   0.820   0.669
   96    HB2  CYS  16           1HB      CYS  16   3.670  -0.150  -0.782
   97    HB3  CYS  16           2HB      CYS  16   3.590   0.907   0.618
   98    H    ALA  17           H        ALA  17   5.485  -2.508   0.204
   99    HA   ALA  17           HA       ALA  17   4.118  -3.003   2.674
  100    HB1  ALA  17           3HB      ALA  17   3.761  -4.946   1.652
  101    HB2  ALA  17           1HB      ALA  17   5.468  -5.350   1.847
  102    HB3  ALA  17           2HB      ALA  17   4.919  -4.517   0.394
  103    HA   PRO  18           HA       PRO  18   4.205  -5.132   3.922
  104    HB2  PRO  18           1HB      PRO  18   4.119  -5.400   6.587
  105    HB3  PRO  18           2HB      PRO  18   5.176  -6.388   5.574
  106    HG2  PRO  18           1HG      PRO  18   5.835  -3.978   7.219
  107    HG3  PRO  18           2HG      PRO  18   6.744  -5.486   7.029
  108    HD2  PRO  18           1HD      PRO  18   7.362  -3.187   5.694
  109    HD3  PRO  18           2HD      PRO  18   7.708  -4.809   5.071
  110    H    ALA  19           H        ALA  19   4.881  -1.977   5.058
  111    HA   ALA  19           HA       ALA  19   2.545  -1.469   6.552
  112    HB1  ALA  19           3HB      ALA  19   4.787   0.082   5.508
  113    HB2  ALA  19           1HB      ALA  19   3.904   0.241   7.026
  114    HB3  ALA  19           2HB      ALA  19   3.266   0.978   5.558
  115    H    CYS  20           H        CYS  20   3.436  -0.453   3.306
  116    HA   CYS  20           HA       CYS  20   2.314   0.151   1.535
  117    HB2  CYS  20           1HB      CYS  20   0.619  -2.110   2.526
  118    HB3  CYS  20           2HB      CYS  20   0.346  -1.299   1.004
  119    H    ARG  21           H        ARG  21   1.940   2.021   3.294
  120    HA   ARG  21           HA       ARG  21  -0.729   2.551   4.086
  121    HE   ARG  21           HE       ARG  21   3.693   5.474   4.777
  122    HB2  ARG  21           1HB      ARG  21   1.569   4.469   3.671
  123    HB3  ARG  21           2HB      ARG  21   0.065   4.850   4.494
  124    HG2  ARG  21           1HG      ARG  21   0.933   4.142   6.397
  125    HG3  ARG  21           2HG      ARG  21   1.114   2.527   5.710
  126    HD2  ARG  21           1HD      ARG  21   3.252   3.269   6.515
  127    HD3  ARG  21           2HD      ARG  21   3.291   3.233   4.753
  128   HH11  ARG  21          1HH1      ARG  21   2.249   4.593   7.830
  129   HH12  ARG  21          2HH1      ARG  21   2.426   6.175   8.512
  130   HH21  ARG  21          1HH2      ARG  21   3.925   7.555   5.672
  131   HH22  ARG  21          2HH2      ARG  21   3.377   7.856   7.287
  132    H    LEU  22           H        LEU  22  -2.179   4.058   3.292
  133    HA   LEU  22           HA       LEU  22  -2.894   3.914   0.681
  134    HG   LEU  22           HG       LEU  22  -4.436   5.727  -0.160
  135    HB2  LEU  22           1HB      LEU  22  -4.408   4.774   2.362
  136    HB3  LEU  22           2HB      LEU  22  -3.406   6.200   2.575
  137   HD11  LEU  22          1HD1      LEU  22  -6.486   5.246   0.738
  138   HD12  LEU  22          2HD1      LEU  22  -6.560   7.007   0.700
  139   HD13  LEU  22          3HD1      LEU  22  -6.185   6.173   2.207
  140   HD21  LEU  22          3HD2      LEU  22  -3.107   7.742   1.055
  141   HD22  LEU  22          1HD2      LEU  22  -4.772   8.296   1.233
  142   HD23  LEU  22          2HD2      LEU  22  -4.126   7.946  -0.370
  143    H    SER  23           H        SER  23  -1.226   6.635   2.156
  144    HA   SER  23           HA       SER  23  -0.802   8.141  -0.140
  145    HG   SER  23           HG       SER  23  -0.397  10.112   0.751
  146    HB2  SER  23           1HB      SER  23  -0.271   8.525   2.472
  147    HB3  SER  23           2HB      SER  23   1.359   8.194   1.885
  148    H    CYS  24           H        CYS  24   0.882   5.303   0.956
  149    HA   CYS  24           HA       CYS  24   3.057   5.752  -0.920
  150    HB2  CYS  24           1HB      CYS  24   3.473   4.850   1.434
  151    HB3  CYS  24           2HB      CYS  24   2.678   3.371   0.912
  152    H    CYS  25           H        CYS  25   0.387   3.451  -0.429
  153    HA   CYS  25           HA       CYS  25   1.101   1.731  -2.492
  154    HB2  CYS  25           1HB      CYS  25  -1.501   2.382  -1.180
  155    HB3  CYS  25           2HB      CYS  25  -1.440   1.263  -2.529
  156    H    SER  26           H        SER  26  -1.461   4.165  -2.691
  157    HA   SER  26           HA       SER  26  -1.400   4.079  -5.540
  158    HG   SER  26           HG       SER  26  -3.811   6.358  -3.235
  159    HB2  SER  26           1HB      SER  26  -3.205   5.643  -5.481
  160    HB3  SER  26           2HB      SER  26  -3.461   4.433  -4.221
  161    H    LEU  27           H        LEU  27  -0.637   6.547  -3.181
  162    HA   LEU  27           HA       LEU  27   0.686   8.162  -5.213
  163    HG   LEU  27           HG       LEU  27   1.868  10.136  -3.998
  164    HB2  LEU  27           1HB      LEU  27  -0.857   9.226  -3.623
  165    HB3  LEU  27           2HB      LEU  27   0.162   8.712  -2.292
  166   HD11  LEU  27          1HD1      LEU  27   0.327  11.282  -5.242
  167   HD12  LEU  27          2HD1      LEU  27   0.488  12.367  -3.862
  168   HD13  LEU  27          3HD1      LEU  27  -0.885  11.265  -3.960
  169   HD21  LEU  27          3HD2      LEU  27   0.486  10.898  -1.431
  170   HD22  LEU  27          1HD2      LEU  27   1.823  11.800  -2.145
  171   HD23  LEU  27          2HD2      LEU  27   2.066  10.137  -1.612
  172    H    GLY  28           H        GLY  28   2.005   5.746  -4.677
  173    HA2  GLY  28           1HA      GLY  28   4.604   6.742  -4.005
  174    HA3  GLY  28           2HA      GLY  28   3.955   5.704  -2.743
  Start of MODEL    7
    1    HA   ALA   1           HA       ALA   1   8.325 -10.121   0.219
    2    H1   ALA   1           1H       ALA   1   9.311 -12.571  -1.039
    3    H2   ALA   1           2H       ALA   1   8.122 -12.602   0.197
    4    H3   ALA   1           3H       ALA   1   9.667 -11.921   0.506
    5    HB1  ALA   1           3HB      ALA   1  10.112  -9.485  -1.018
    6    HB2  ALA   1           1HB      ALA   1   8.910  -9.490  -2.309
    7    HB3  ALA   1           2HB      ALA   1   9.992 -10.867  -2.106
    8    H    GLN   2           H        GLN   2   6.130 -10.532   0.396
    9    HA   GLN   2           HA       GLN   2   4.706 -11.320  -2.044
   10    HB2  GLN   2           1HB      GLN   2   3.816 -11.191   0.842
   11    HB3  GLN   2           2HB      GLN   2   2.742 -11.574  -0.497
   12    HG2  GLN   2           1HG      GLN   2   5.236 -13.158  -0.025
   13    HG3  GLN   2           2HG      GLN   2   3.754 -13.496   0.870
   14   HE21  GLN   2          1HE2      GLN   2   1.781 -13.749  -0.537
   15   HE22  GLN   2          2HE2      GLN   2   1.975 -14.657  -1.994
   16    H    ASN   3           H        ASN   3   2.908 -10.108  -2.792
   17    HA   ASN   3           HA       ASN   3   2.961  -7.289  -1.970
   18    HB2  ASN   3           1HB      ASN   3   3.768  -7.968  -4.324
   19    HB3  ASN   3           2HB      ASN   3   2.068  -8.264  -4.675
   20   HD21  ASN   3          1HD2      ASN   3   3.396  -5.749  -2.622
   21   HD22  ASN   3          2HD2      ASN   3   2.861  -4.421  -3.585
   22    HA   PRO   4           HA       PRO   4  -1.357  -9.200  -1.374
   23    HB2  PRO   4           1HB      PRO   4  -1.565  -8.692   1.297
   24    HB3  PRO   4           2HB      PRO   4  -0.954 -10.215   0.641
   25    HG2  PRO   4           1HG      PRO   4   0.570  -7.843   1.656
   26    HG3  PRO   4           2HG      PRO   4   0.861  -9.567   1.952
   27    HD2  PRO   4           1HD      PRO   4   2.309  -8.186   0.158
   28    HD3  PRO   4           2HD      PRO   4   1.856  -9.883  -0.114
   29    H    CYS   5           H        CYS   5   0.262  -6.327  -0.373
   30    HA   CYS   5           HA       CYS   5  -1.917  -4.743   0.312
   31    HB2  CYS   5           1HB      CYS   5   0.707  -3.843  -0.894
   32    HB3  CYS   5           2HB      CYS   5  -0.392  -2.898   0.097
   33    H    SER   6           H        SER   6  -0.590  -5.658  -2.762
   34    HA   SER   6           HA       SER   6  -1.779  -3.684  -4.385
   35    HG   SER   6           HG       SER   6  -0.845  -5.469  -7.209
   36    HB2  SER   6           1HB      SER   6  -0.036  -5.424  -5.073
   37    HB3  SER   6           2HB      SER   6  -1.384  -6.547  -5.241
   38    H    LEU   7           H        LEU   7  -2.904  -6.738  -3.139
   39    HA   LEU   7           HA       LEU   7  -5.407  -6.842  -4.482
   40    HG   LEU   7           HG       LEU   7  -5.827 -10.134  -2.977
   41    HB2  LEU   7           1HB      LEU   7  -3.984  -8.600  -3.019
   42    HB3  LEU   7           2HB      LEU   7  -5.113  -8.071  -1.805
   43   HD11  LEU   7          1HD1      LEU   7  -8.117  -9.475  -3.300
   44   HD12  LEU   7          2HD1      LEU   7  -7.642  -7.787  -3.498
   45   HD13  LEU   7          3HD1      LEU   7  -7.448  -8.580  -1.935
   46   HD21  LEU   7          3HD2      LEU   7  -6.283 -10.232  -5.233
   47   HD22  LEU   7          1HD2      LEU   7  -4.853  -9.199  -5.206
   48   HD23  LEU   7          2HD2      LEU   7  -6.455  -8.483  -5.383
   49    H    GLN   8           H        GLN   8  -4.205  -5.460  -1.575
   50    HA   GLN   8           HA       GLN   8  -6.795  -4.729  -0.519
   51    HB2  GLN   8           1HB      GLN   8  -4.148  -3.680   0.460
   52    HB3  GLN   8           2HB      GLN   8  -5.640  -3.892   1.364
   53    HG2  GLN   8           1HG      GLN   8  -5.114  -6.446   0.597
   54    HG3  GLN   8           2HG      GLN   8  -3.485  -5.795   0.800
   55   HE21  GLN   8          1HE2      GLN   8  -6.457  -6.639   2.367
   56   HE22  GLN   8          2HE2      GLN   8  -5.884  -6.499   3.990
   57    H    GLN   9           H        GLN   9  -4.235  -3.245  -2.364
   58    HA   GLN   9           HA       GLN   9  -5.913  -0.931  -2.837
   59    HB2  GLN   9           1HB      GLN   9  -3.007  -0.612  -2.072
   60    HB3  GLN   9           2HB      GLN   9  -4.167   0.670  -2.385
   61    HG2  GLN   9           1HG      GLN   9  -5.464  -0.342  -0.392
   62    HG3  GLN   9           2HG      GLN   9  -3.925  -1.119  -0.012
   63   HE21  GLN   9          1HE2      GLN   9  -3.713   0.104   1.935
   64   HE22  GLN   9          2HE2      GLN   9  -3.303   1.778   1.895
   65    HA   PRO  10           HA       PRO  10  -4.424  -1.880  -6.915
   66    HB2  PRO  10           1HB      PRO  10  -5.222   0.372  -8.207
   67    HB3  PRO  10           2HB      PRO  10  -6.334  -0.914  -7.724
   68    HG2  PRO  10           1HG      PRO  10  -5.760   1.700  -6.388
   69    HG3  PRO  10           2HG      PRO  10  -7.317   0.887  -6.639
   70    HD2  PRO  10           1HD      PRO  10  -5.988   0.826  -4.276
   71    HD3  PRO  10           2HD      PRO  10  -7.021  -0.508  -4.830
   72    H    GLY  11           H        GLY  11  -2.543  -1.710  -7.904
   73    HA2  GLY  11           1HA      GLY  11  -0.539  -0.839  -8.691
   74    HA3  GLY  11           2HA      GLY  11  -1.163   0.750  -8.309
   75    H    CYS  12           H        CYS  12  -1.358  -0.858  -5.434
   76    HA   CYS  12           HA       CYS  12   0.607   0.589  -4.175
   77    HB2  CYS  12           1HB      CYS  12  -1.179  -0.643  -3.045
   78    HB3  CYS  12           2HB      CYS  12  -0.348  -2.137  -3.413
   79    H    SER  13           H        SER  13   2.605   0.605  -4.363
   80    HA   SER  13           HA       SER  13   4.292  -1.238  -5.600
   81    HG   SER  13           HG       SER  13   6.725  -0.410  -5.296
   82    HB2  SER  13           1HB      SER  13   4.996   1.036  -5.433
   83    HB3  SER  13           2HB      SER  13   4.879   1.008  -3.678
   84    H    SER  14           H        SER  14   5.385  -2.999  -4.868
   85    HA   SER  14           HA       SER  14   4.669  -4.247  -2.444
   86    HG   SER  14           HG       SER  14   5.655  -4.955  -5.487
   87    HB2  SER  14           1HB      SER  14   7.226  -4.681  -3.982
   88    HB3  SER  14           2HB      SER  14   6.417  -5.828  -2.917
   89    H    ALA  15           H        ALA  15   7.201  -2.063  -3.341
   90    HA   ALA  15           HA       ALA  15   8.864  -2.300  -1.099
   91    HB1  ALA  15           3HB      ALA  15   9.992  -1.199  -2.726
   92    HB2  ALA  15           1HB      ALA  15   9.370   0.213  -1.870
   93    HB3  ALA  15           2HB      ALA  15   8.550  -0.374  -3.317
   94    H    CYS  16           H        CYS  16   5.757  -1.030  -1.396
   95    HA   CYS  16           HA       CYS  16   6.037   0.959   0.691
   96    HB2  CYS  16           1HB      CYS  16   3.630  -0.205  -0.725
   97    HB3  CYS  16           2HB      CYS  16   3.484   0.924   0.613
   98    H    ALA  17           H        ALA  17   5.508  -2.416   0.400
   99    HA   ALA  17           HA       ALA  17   4.163  -2.810   2.891
  100    HB1  ALA  17           3HB      ALA  17   3.856  -4.820   1.981
  101    HB2  ALA  17           1HB      ALA  17   5.572  -5.164   2.207
  102    HB3  ALA  17           2HB      ALA  17   5.008  -4.436   0.704
  103    HA   PRO  18           HA       PRO  18   4.250  -4.781   4.306
  104    HB2  PRO  18           1HB      PRO  18   4.188  -4.862   6.975
  105    HB3  PRO  18           2HB      PRO  18   5.271  -5.895   6.037
  106    HG2  PRO  18           1HG      PRO  18   5.864  -3.336   7.477
  107    HG3  PRO  18           2HG      PRO  18   6.802  -4.840   7.442
  108    HD2  PRO  18           1HD      PRO  18   7.405  -2.676   5.901
  109    HD3  PRO  18           2HD      PRO  18   7.763  -4.344   5.423
  110    H    ALA  19           H        ALA  19   4.912  -1.547   5.113
  111    HA   ALA  19           HA       ALA  19   2.656  -0.895   6.668
  112    HB1  ALA  19           3HB      ALA  19   3.287   1.436   5.384
  113    HB2  ALA  19           1HB      ALA  19   4.812   0.550   5.332
  114    HB3  ALA  19           2HB      ALA  19   4.023   0.859   6.878
  115    H    CYS  20           H        CYS  20   3.349  -0.252   3.281
  116    HA   CYS  20           HA       CYS  20   2.110   0.134   1.510
  117    HB2  CYS  20           1HB      CYS  20   0.140  -1.748   2.773
  118    HB3  CYS  20           2HB      CYS  20   0.369  -1.403   1.074
  119    H    ARG  21           H        ARG  21   1.836   2.184   3.213
  120    HA   ARG  21           HA       ARG  21  -0.829   2.779   3.984
  121    HE   ARG  21           HE       ARG  21   3.354   3.484   4.467
  122    HB2  ARG  21           1HB      ARG  21   1.552   4.582   3.528
  123    HB3  ARG  21           2HB      ARG  21  -0.002   5.165   4.098
  124    HG2  ARG  21           1HG      ARG  21   0.275   4.313   6.169
  125    HG3  ARG  21           2HG      ARG  21   1.180   2.911   5.596
  126    HD2  ARG  21           1HD      ARG  21   2.216   5.733   5.849
  127    HD3  ARG  21           2HD      ARG  21   2.611   4.377   6.905
  128   HH11  ARG  21          1HH1      ARG  21   4.053   6.407   6.240
  129   HH12  ARG  21          2HH1      ARG  21   5.616   6.617   5.524
  130   HH21  ARG  21          1HH2      ARG  21   5.410   3.756   3.525
  131   HH22  ARG  21          2HH2      ARG  21   6.386   5.112   3.982
  132    H    LEU  22           H        LEU  22  -2.300   4.206   3.092
  133    HA   LEU  22           HA       LEU  22  -3.019   3.882   0.506
  134    HG   LEU  22           HG       LEU  22  -4.742   3.795   2.557
  135    HB2  LEU  22           1HB      LEU  22  -3.565   6.077   2.455
  136    HB3  LEU  22           2HB      LEU  22  -4.187   6.185   0.819
  137   HD11  LEU  22          1HD1      LEU  22  -6.700   6.026   2.271
  138   HD12  LEU  22          2HD1      LEU  22  -5.450   6.118   3.511
  139   HD13  LEU  22          3HD1      LEU  22  -6.591   4.774   3.508
  140   HD21  LEU  22          3HD2      LEU  22  -5.095   3.808   0.031
  141   HD22  LEU  22          1HD2      LEU  22  -6.402   4.952   0.338
  142   HD23  LEU  22          2HD2      LEU  22  -6.465   3.333   1.034
  143    H    SER  23           H        SER  23  -1.393   6.726   1.785
  144    HA   SER  23           HA       SER  23  -0.993   8.066  -0.619
  145    HG   SER  23           HG       SER  23   0.373   7.597   2.765
  146    HB2  SER  23           1HB      SER  23   0.795   9.297   0.553
  147    HB3  SER  23           2HB      SER  23  -0.644   9.125   1.557
  148    H    CYS  24           H        CYS  24   0.717   5.335   0.689
  149    HA   CYS  24           HA       CYS  24   2.887   5.675  -1.217
  150    HB2  CYS  24           1HB      CYS  24   3.322   4.954   1.191
  151    HB3  CYS  24           2HB      CYS  24   2.541   3.430   0.785
  152    H    CYS  25           H        CYS  25   0.263   3.351  -0.560
  153    HA   CYS  25           HA       CYS  25   1.007   1.529  -2.520
  154    HB2  CYS  25           1HB      CYS  25  -1.605   2.184  -1.230
  155    HB3  CYS  25           2HB      CYS  25  -1.524   0.997  -2.519
  156    H    SER  26           H        SER  26  -1.616   3.887  -2.846
  157    HA   SER  26           HA       SER  26  -1.602   3.607  -5.682
  158    HG   SER  26           HG       SER  26  -4.035   6.222  -3.780
  159    HB2  SER  26           1HB      SER  26  -3.437   5.137  -5.696
  160    HB3  SER  26           2HB      SER  26  -3.642   4.004  -4.358
  161    H    LEU  27           H        LEU  27  -1.212   6.492  -3.728
  162    HA   LEU  27           HA       LEU  27  -0.101   8.040  -5.804
  163    HG   LEU  27           HG       LEU  27   1.362   9.989  -4.700
  164    HB2  LEU  27           1HB      LEU  27  -1.263   8.981  -3.852
  165    HB3  LEU  27           2HB      LEU  27   0.057   8.472  -2.821
  166   HD11  LEU  27          1HD1      LEU  27  -0.304  11.036  -5.826
  167   HD12  LEU  27          2HD1      LEU  27  -0.185  12.135  -4.451
  168   HD13  LEU  27          3HD1      LEU  27  -1.446  10.902  -4.489
  169   HD21  LEU  27          3HD2      LEU  27   2.034  10.430  -2.582
  170   HD22  LEU  27          1HD2      LEU  27   0.394  10.381  -1.933
  171   HD23  LEU  27          2HD2      LEU  27   0.961  11.814  -2.791
  172    H    GLY  28           H        GLY  28   1.324   5.643  -3.844
  173    HA2  GLY  28           1HA      GLY  28   4.011   6.725  -4.420
  174    HA3  GLY  28           2HA      GLY  28   3.646   5.631  -3.095
  Start of MODEL    8
    1    HA   ALA   1           HA       ALA   1   6.946 -11.864   1.647
    2    H1   ALA   1           1H       ALA   1   8.853 -13.150   1.074
    3    H2   ALA   1           2H       ALA   1   8.796 -12.554  -0.534
    4    H3   ALA   1           3H       ALA   1   7.518 -13.529   0.069
    5    HB1  ALA   1           3HB      ALA   1   9.468 -11.015   1.485
    6    HB2  ALA   1           1HB      ALA   1   8.150  -9.983   2.039
    7    HB3  ALA   1           2HB      ALA   1   8.721  -9.866   0.375
    8    H    GLN   2           H        GLN   2   5.141 -12.272   0.302
    9    HA   GLN   2           HA       GLN   2   4.903 -11.008  -2.267
   10    HB2  GLN   2           1HB      GLN   2   3.002 -12.524  -0.496
   11    HB3  GLN   2           2HB      GLN   2   2.449 -11.738  -1.965
   12    HG2  GLN   2           1HG      GLN   2   3.525 -13.208  -3.331
   13    HG3  GLN   2           2HG      GLN   2   4.791 -13.548  -2.152
   14   HE21  GLN   2          1HE2      GLN   2   4.238 -14.899  -0.334
   15   HE22  GLN   2          2HE2      GLN   2   3.016 -16.107  -0.508
   16    H    ASN   3           H        ASN   3   3.389  -9.352  -2.819
   17    HA   ASN   3           HA       ASN   3   3.044  -7.400  -0.670
   18    HB2  ASN   3           1HB      ASN   3   4.230  -6.481  -2.487
   19    HB3  ASN   3           2HB      ASN   3   3.140  -7.195  -3.665
   20   HD21  ASN   3          1HD2      ASN   3   2.655  -5.379  -4.656
   21   HD22  ASN   3          2HD2      ASN   3   1.721  -4.097  -3.962
   22    HA   PRO   4           HA       PRO   4  -1.293  -9.010  -1.364
   23    HB2  PRO   4           1HB      PRO   4  -2.122  -8.702   1.210
   24    HB3  PRO   4           2HB      PRO   4  -1.313 -10.160   0.621
   25    HG2  PRO   4           1HG      PRO   4  -0.150  -7.813   2.089
   26    HG3  PRO   4           2HG      PRO   4   0.112  -9.547   2.369
   27    HD2  PRO   4           1HD      PRO   4   1.882  -8.062   1.048
   28    HD3  PRO   4           2HD      PRO   4   1.560  -9.743   0.574
   29    H    CYS   5           H        CYS   5   0.086  -6.127  -0.183
   30    HA   CYS   5           HA       CYS   5  -2.213  -4.623   0.328
   31    HB2  CYS   5           1HB      CYS   5   0.463  -3.608  -0.644
   32    HB3  CYS   5           2HB      CYS   5  -0.752  -2.727   0.267
   33    H    SER   6           H        SER   6  -0.581  -5.459  -2.620
   34    HA   SER   6           HA       SER   6  -1.693  -3.517  -4.329
   35    HG   SER   6           HG       SER   6   0.274  -4.340  -6.425
   36    HB2  SER   6           1HB      SER   6  -0.550  -6.252  -4.746
   37    HB3  SER   6           2HB      SER   6  -1.432  -5.487  -6.065
   38    H    LEU   7           H        LEU   7  -2.796  -6.634  -3.234
   39    HA   LEU   7           HA       LEU   7  -5.163  -6.815  -4.791
   40    HG   LEU   7           HG       LEU   7  -5.892  -8.908  -4.854
   41    HB2  LEU   7           1HB      LEU   7  -3.794  -8.538  -3.242
   42    HB3  LEU   7           2HB      LEU   7  -5.050  -8.092  -2.124
   43   HD11  LEU   7          1HD1      LEU   7  -5.243 -10.986  -2.788
   44   HD12  LEU   7          2HD1      LEU   7  -4.091 -10.520  -4.039
   45   HD13  LEU   7          3HD1      LEU   7  -5.652 -11.208  -4.489
   46   HD21  LEU   7          3HD2      LEU   7  -7.267  -8.192  -2.688
   47   HD22  LEU   7          1HD2      LEU   7  -7.114  -9.917  -2.352
   48   HD23  LEU   7          2HD2      LEU   7  -7.874  -9.373  -3.849
   49    H    GLN   8           H        GLN   8  -4.309  -5.449  -1.748
   50    HA   GLN   8           HA       GLN   8  -7.035  -4.888  -0.945
   51    HB2  GLN   8           1HB      GLN   8  -4.586  -3.697   0.333
   52    HB3  GLN   8           2HB      GLN   8  -6.140  -4.056   1.068
   53    HG2  GLN   8           1HG      GLN   8  -5.333  -6.534   0.299
   54    HG3  GLN   8           2HG      GLN   8  -3.791  -5.762   0.683
   55   HE21  GLN   8          1HE2      GLN   8  -6.680  -7.116   1.907
   56   HE22  GLN   8          2HE2      GLN   8  -6.343  -6.896   3.587
   57    H    GLN   9           H        GLN   9  -4.375  -3.208  -2.441
   58    HA   GLN   9           HA       GLN   9  -6.122  -0.963  -3.061
   59    HB2  GLN   9           1HB      GLN   9  -3.466  -0.730  -1.652
   60    HB3  GLN   9           2HB      GLN   9  -4.207   0.614  -2.510
   61    HG2  GLN   9           1HG      GLN   9  -5.244   1.118  -0.617
   62    HG3  GLN   9           2HG      GLN   9  -6.222  -0.325  -0.863
   63   HE21  GLN   9          1HE2      GLN   9  -3.319   0.916   0.725
   64   HE22  GLN   9          2HE2      GLN   9  -3.261  -0.302   1.947
   65    HA   PRO  10           HA       PRO  10  -4.162  -2.375  -6.948
   66    HB2  PRO  10           1HB      PRO  10  -5.661   0.084  -7.764
   67    HB3  PRO  10           2HB      PRO  10  -5.533  -1.477  -8.583
   68    HG2  PRO  10           1HG      PRO  10  -7.719  -0.864  -7.206
   69    HG3  PRO  10           2HG      PRO  10  -7.044  -2.503  -7.146
   70    HD2  PRO  10           1HD      PRO  10  -6.966  -0.344  -5.102
   71    HD3  PRO  10           2HD      PRO  10  -7.019  -2.106  -4.885
   72    H    GLY  11           H        GLY  11  -2.421  -1.684  -8.094
   73    HA2  GLY  11           1HA      GLY  11  -0.678  -0.317  -8.795
   74    HA3  GLY  11           2HA      GLY  11  -1.528   1.040  -8.099
   75    H    CYS  12           H        CYS  12  -1.496  -0.549  -5.420
   76    HA   CYS  12           HA       CYS  12   0.585   0.780  -4.221
   77    HB2  CYS  12           1HB      CYS  12  -1.219  -0.337  -3.018
   78    HB3  CYS  12           2HB      CYS  12  -0.519  -1.882  -3.436
   79    H    SER  13           H        SER  13   2.573   0.685  -4.465
   80    HA   SER  13           HA       SER  13   4.122  -1.252  -5.743
   81    HG   SER  13           HG       SER  13   6.620  -0.344  -3.770
   82    HB2  SER  13           1HB      SER  13   4.953   0.986  -5.594
   83    HB3  SER  13           2HB      SER  13   4.886   0.957  -3.837
   84    H    SER  14           H        SER  14   5.144  -3.062  -5.027
   85    HA   SER  14           HA       SER  14   4.397  -4.274  -2.599
   86    HG   SER  14           HG       SER  14   5.407  -5.104  -5.693
   87    HB2  SER  14           1HB      SER  14   6.905  -4.848  -4.165
   88    HB3  SER  14           2HB      SER  14   6.038  -5.951  -3.101
   89    H    ALA  15           H        ALA  15   7.049  -2.245  -3.508
   90    HA   ALA  15           HA       ALA  15   8.702  -2.594  -1.275
   91    HB1  ALA  15           3HB      ALA  15   9.616  -1.626  -3.261
   92    HB2  ALA  15           1HB      ALA  15   9.715  -0.421  -1.977
   93    HB3  ALA  15           2HB      ALA  15   8.459  -0.297  -3.209
   94    H    CYS  16           H        CYS  16   5.684  -1.129  -1.550
   95    HA   CYS  16           HA       CYS  16   6.107   0.847   0.525
   96    HB2  CYS  16           1HB      CYS  16   3.612  -0.195  -0.837
   97    HB3  CYS  16           2HB      CYS  16   3.558   0.963   0.484
   98    H    ALA  17           H        ALA  17   5.340  -2.496   0.254
   99    HA   ALA  17           HA       ALA  17   4.045  -2.770   2.797
  100    HB1  ALA  17           3HB      ALA  17   4.613  -4.457   0.591
  101    HB2  ALA  17           1HB      ALA  17   3.562  -4.783   1.970
  102    HB3  ALA  17           2HB      ALA  17   5.269  -5.226   2.035
  103    HA   PRO  18           HA       PRO  18   4.035  -4.732   4.239
  104    HB2  PRO  18           1HB      PRO  18   4.087  -4.803   6.906
  105    HB3  PRO  18           2HB      PRO  18   5.049  -5.917   5.929
  106    HG2  PRO  18           1HG      PRO  18   5.892  -3.401   7.323
  107    HG3  PRO  18           2HG      PRO  18   6.713  -4.972   7.263
  108    HD2  PRO  18           1HD      PRO  18   7.411  -2.870   5.678
  109    HD3  PRO  18           2HD      PRO  18   7.619  -4.564   5.200
  110    H    ALA  19           H        ALA  19   4.985  -1.561   4.977
  111    HA   ALA  19           HA       ALA  19   2.870  -0.716   6.636
  112    HB1  ALA  19           3HB      ALA  19   4.418   0.906   6.733
  113    HB2  ALA  19           1HB      ALA  19   3.586   1.551   5.319
  114    HB3  ALA  19           2HB      ALA  19   5.031   0.559   5.118
  115    H    CYS  20           H        CYS  20   3.435  -0.227   3.202
  116    HA   CYS  20           HA       CYS  20   2.137   0.197   1.475
  117    HB2  CYS  20           1HB      CYS  20   0.077  -1.434   2.930
  118    HB3  CYS  20           2HB      CYS  20   0.253  -1.204   1.206
  119    H    ARG  21           H        ARG  21   2.128   2.318   3.155
  120    HA   ARG  21           HA       ARG  21  -0.443   3.151   4.018
  121    HE   ARG  21           HE       ARG  21   3.431   6.687   5.502
  122    HB2  ARG  21           1HB      ARG  21   2.059   4.738   3.426
  123    HB3  ARG  21           2HB      ARG  21   0.584   5.464   4.038
  124    HG2  ARG  21           1HG      ARG  21   0.804   3.671   5.914
  125    HG3  ARG  21           2HG      ARG  21   2.492   3.626   5.403
  126    HD2  ARG  21           1HD      ARG  21   1.215   6.271   5.891
  127    HD3  ARG  21           2HD      ARG  21   1.669   5.283   7.280
  128   HH11  ARG  21          1HH1      ARG  21   3.159   3.988   7.697
  129   HH12  ARG  21          2HH1      ARG  21   4.857   3.924   8.028
  130   HH21  ARG  21          1HH2      ARG  21   5.665   6.605   5.936
  131   HH22  ARG  21          2HH2      ARG  21   6.281   5.411   7.029
  132    H    LEU  22           H        LEU  22  -1.870   4.606   3.141
  133    HA   LEU  22           HA       LEU  22  -2.674   4.305   0.577
  134    HG   LEU  22           HG       LEU  22  -4.349   4.197   2.440
  135    HB2  LEU  22           1HB      LEU  22  -3.055   6.538   2.523
  136    HB3  LEU  22           2HB      LEU  22  -3.722   6.661   0.906
  137   HD11  LEU  22          1HD1      LEU  22  -6.022   6.606   2.950
  138   HD12  LEU  22          2HD1      LEU  22  -4.571   6.350   3.918
  139   HD13  LEU  22          3HD1      LEU  22  -5.846   5.132   3.901
  140   HD21  LEU  22          3HD2      LEU  22  -6.113   4.067   1.032
  141   HD22  LEU  22          1HD2      LEU  22  -5.104   5.116   0.036
  142   HD23  LEU  22          2HD2      LEU  22  -6.383   5.809   1.033
  143    H    SER  23           H        SER  23  -0.837   7.045   1.800
  144    HA   SER  23           HA       SER  23  -0.451   8.371  -0.614
  145    HG   SER  23           HG       SER  23   1.163   7.980   2.788
  146    HB2  SER  23           1HB      SER  23   1.418   9.508   0.482
  147    HB3  SER  23           2HB      SER  23   0.056   9.353   1.590
  148    H    CYS  24           H        CYS  24   1.136   5.536   0.624
  149    HA   CYS  24           HA       CYS  24   3.233   5.722  -1.377
  150    HB2  CYS  24           1HB      CYS  24   3.731   4.998   1.015
  151    HB3  CYS  24           2HB      CYS  24   2.835   3.524   0.668
  152    H    CYS  25           H        CYS  25   0.529   3.523  -0.566
  153    HA   CYS  25           HA       CYS  25   1.081   1.679  -2.570
  154    HB2  CYS  25           1HB      CYS  25  -1.423   2.440  -1.134
  155    HB3  CYS  25           2HB      CYS  25  -1.469   1.263  -2.433
  156    H    SER  26           H        SER  26  -1.442   4.158  -2.747
  157    HA   SER  26           HA       SER  26  -1.592   3.889  -5.579
  158    HG   SER  26           HG       SER  26  -3.794   6.505  -3.411
  159    HB2  SER  26           1HB      SER  26  -3.344   5.510  -5.497
  160    HB3  SER  26           2HB      SER  26  -3.538   4.391  -4.147
  161    H    LEU  27           H        LEU  27  -0.629   6.518  -3.475
  162    HA   LEU  27           HA       LEU  27   0.585   7.933  -5.712
  163    HG   LEU  27           HG       LEU  27   1.907  10.068  -4.568
  164    HB2  LEU  27           1HB      LEU  27  -0.851   9.058  -3.972
  165    HB3  LEU  27           2HB      LEU  27   0.444   8.780  -2.822
  166   HD11  LEU  27          1HD1      LEU  27   0.212  11.927  -5.457
  167   HD12  LEU  27          2HD1      LEU  27  -0.860  10.527  -5.506
  168   HD13  LEU  27          3HD1      LEU  27   0.657  10.508  -6.405
  169   HD21  LEU  27          3HD2      LEU  27   1.649  10.984  -2.430
  170   HD22  LEU  27          1HD2      LEU  27  -0.082  11.242  -2.651
  171   HD23  LEU  27          2HD2      LEU  27   1.078  12.247  -3.519
  172    H    GLY  28           H        GLY  28   1.881   5.518  -5.046
  173    HA2  GLY  28           1HA      GLY  28   4.546   6.506  -4.651
  174    HA3  GLY  28           2HA      GLY  28   3.969   5.573  -3.276
  Start of MODEL    9
    1    HA   ALA   1           HA       ALA   1   6.350 -12.279   1.492
    2    H1   ALA   1           1H       ALA   1   5.342 -13.818   3.170
    3    H2   ALA   1           2H       ALA   1   3.834 -13.415   2.456
    4    H3   ALA   1           3H       ALA   1   4.814 -12.187   3.148
    5    HB1  ALA   1           3HB      ALA   1   5.300 -15.020   1.137
    6    HB2  ALA   1           1HB      ALA   1   6.959 -14.422   1.087
    7    HB3  ALA   1           2HB      ALA   1   5.900 -14.204  -0.306
    8    H    GLN   2           H        GLN   2   5.930 -12.364  -1.090
    9    HA   GLN   2           HA       GLN   2   4.852 -11.236  -2.816
   10    HB2  GLN   2           1HB      GLN   2   3.188 -13.229  -1.806
   11    HB3  GLN   2           2HB      GLN   2   2.141 -11.827  -1.973
   12    HG2  GLN   2           1HG      GLN   2   3.932 -12.542  -4.235
   13    HG3  GLN   2           2HG      GLN   2   2.501 -13.528  -3.945
   14   HE21  GLN   2          1HE2      GLN   2   0.633 -12.855  -4.748
   15   HE22  GLN   2          2HE2      GLN   2   0.321 -11.283  -5.391
   16    H    ASN   3           H        ASN   3   3.136  -9.595  -3.345
   17    HA   ASN   3           HA       ASN   3   3.084  -7.591  -1.216
   18    HB2  ASN   3           1HB      ASN   3   4.141  -6.827  -3.216
   19    HB3  ASN   3           2HB      ASN   3   2.820  -7.419  -4.207
   20   HD21  ASN   3          1HD2      ASN   3   2.254  -5.621  -5.117
   21   HD22  ASN   3          2HD2      ASN   3   1.607  -4.237  -4.300
   22    HA   PRO   4           HA       PRO   4  -1.353  -9.081  -1.505
   23    HB2  PRO   4           1HB      PRO   4  -1.922  -8.759   1.142
   24    HB3  PRO   4           2HB      PRO   4  -1.241 -10.245   0.466
   25    HG2  PRO   4           1HG      PRO   4   0.159  -7.974   1.841
   26    HG3  PRO   4           2HG      PRO   4   0.377  -9.722   2.064
   27    HD2  PRO   4           1HD      PRO   4   2.067  -8.274   0.598
   28    HD3  PRO   4           2HD      PRO   4   1.641  -9.933   0.136
   29    H    CYS   5           H        CYS   5   0.214  -6.255  -0.416
   30    HA   CYS   5           HA       CYS   5  -1.993  -4.691   0.292
   31    HB2  CYS   5           1HB      CYS   5   0.629  -3.739  -0.872
   32    HB3  CYS   5           2HB      CYS   5  -0.485  -2.838   0.143
   33    H    SER   6           H        SER   6  -0.614  -5.526  -2.784
   34    HA   SER   6           HA       SER   6  -1.807  -3.533  -4.378
   35    HG   SER   6           HG       SER   6   0.593  -5.104  -6.276
   36    HB2  SER   6           1HB      SER   6  -0.731  -6.269  -4.912
   37    HB3  SER   6           2HB      SER   6  -1.739  -5.513  -6.142
   38    H    LEU   7           H        LEU   7  -2.897  -6.633  -3.228
   39    HA   LEU   7           HA       LEU   7  -5.375  -6.751  -4.606
   40    HG   LEU   7           HG       LEU   7  -5.908 -10.022  -3.029
   41    HB2  LEU   7           1HB      LEU   7  -3.937  -8.513  -3.166
   42    HB3  LEU   7           2HB      LEU   7  -5.099  -8.044  -1.959
   43   HD11  LEU   7          1HD1      LEU   7  -8.046  -9.265  -3.909
   44   HD12  LEU   7          2HD1      LEU   7  -7.404  -7.634  -4.100
   45   HD13  LEU   7          3HD1      LEU   7  -7.585  -8.327  -2.488
   46   HD21  LEU   7          3HD2      LEU   7  -5.841  -8.612  -5.683
   47   HD22  LEU   7          1HD2      LEU   7  -6.124 -10.322  -5.355
   48   HD23  LEU   7          2HD2      LEU   7  -4.518  -9.633  -5.117
   49    H    GLN   8           H        GLN   8  -4.266  -5.420  -1.629
   50    HA   GLN   8           HA       GLN   8  -6.912  -4.797  -0.630
   51    HB2  GLN   8           1HB      GLN   8  -4.353  -3.670   0.478
   52    HB3  GLN   8           2HB      GLN   8  -5.858  -4.005   1.320
   53    HG2  GLN   8           1HG      GLN   8  -5.163  -6.493   0.483
   54    HG3  GLN   8           2HG      GLN   8  -3.579  -5.757   0.751
   55   HE21  GLN   8          1HE2      GLN   8  -3.084  -4.956   2.837
   56   HE22  GLN   8          2HE2      GLN   8  -3.896  -5.564   4.236
   57    H    GLN   9           H        GLN   9  -4.319  -3.176  -2.300
   58    HA   GLN   9           HA       GLN   9  -6.050  -0.891  -2.800
   59    HB2  GLN   9           1HB      GLN   9  -3.298  -0.707  -1.579
   60    HB3  GLN   9           2HB      GLN   9  -4.095   0.654  -2.357
   61    HG2  GLN   9           1HG      GLN   9  -5.032   1.135  -0.411
   62    HG3  GLN   9           2HG      GLN   9  -5.965  -0.351  -0.553
   63   HE21  GLN   9          1HE2      GLN   9  -2.982   1.027   0.748
   64   HE22  GLN   9          2HE2      GLN   9  -2.766  -0.166   1.978
   65    HA   PRO  10           HA       PRO  10  -4.418  -2.307  -6.825
   66    HB2  PRO  10           1HB      PRO  10  -5.808   0.260  -7.492
   67    HB3  PRO  10           2HB      PRO  10  -5.823  -1.283  -8.356
   68    HG2  PRO  10           1HG      PRO  10  -7.880  -0.585  -6.830
   69    HG3  PRO  10           2HG      PRO  10  -7.300  -2.260  -6.852
   70    HD2  PRO  10           1HD      PRO  10  -6.979  -0.170  -4.764
   71    HD3  PRO  10           2HD      PRO  10  -7.107  -1.934  -4.590
   72    H    GLY  11           H        GLY  11  -2.657  -1.766  -7.980
   73    HA2  GLY  11           1HA      GLY  11  -0.846  -0.541  -8.765
   74    HA3  GLY  11           2HA      GLY  11  -1.614   0.895  -8.129
   75    H    CYS  12           H        CYS  12  -1.579  -0.719  -5.397
   76    HA   CYS  12           HA       CYS  12   0.505   0.632  -4.229
   77    HB2  CYS  12           1HB      CYS  12  -1.272  -0.522  -3.012
   78    HB3  CYS  12           2HB      CYS  12  -0.539  -2.051  -3.433
   79    H    SER  13           H        SER  13   2.490   0.563  -4.510
   80    HA   SER  13           HA       SER  13   4.037  -1.346  -5.825
   81    HG   SER  13           HG       SER  13   6.731   0.076  -3.963
   82    HB2  SER  13           1HB      SER  13   4.850   0.891  -5.692
   83    HB3  SER  13           2HB      SER  13   4.800   0.873  -3.935
   84    H    SER  14           H        SER  14   5.074  -3.149  -5.150
   85    HA   SER  14           HA       SER  14   4.420  -4.380  -2.689
   86    HG   SER  14           HG       SER  14   7.146  -5.938  -2.577
   87    HB2  SER  14           1HB      SER  14   5.214  -5.681  -4.623
   88    HB3  SER  14           2HB      SER  14   6.788  -4.892  -4.488
   89    H    ALA  15           H        ALA  15   7.009  -2.331  -3.722
   90    HA   ALA  15           HA       ALA  15   8.767  -2.637  -1.562
   91    HB1  ALA  15           3HB      ALA  15   9.943  -1.541  -3.122
   92    HB2  ALA  15           1HB      ALA  15   9.222  -0.081  -2.442
   93    HB3  ALA  15           2HB      ALA  15   8.496  -0.848  -3.855
   94    H    CYS  16           H        CYS  16   5.711  -1.233  -1.731
   95    HA   CYS  16           HA       CYS  16   6.182   0.764   0.321
   96    HB2  CYS  16           1HB      CYS  16   3.663  -0.295  -0.975
   97    HB3  CYS  16           2HB      CYS  16   3.617   0.817   0.381
   98    H    ALA  17           H        ALA  17   5.494  -2.589   0.109
   99    HA   ALA  17           HA       ALA  17   4.262  -2.878   2.677
  100    HB1  ALA  17           3HB      ALA  17   4.890  -4.578   0.479
  101    HB2  ALA  17           1HB      ALA  17   3.813  -4.894   1.840
  102    HB3  ALA  17           2HB      ALA  17   5.525  -5.308   1.952
  103    HA   PRO  18           HA       PRO  18   4.340  -4.835   4.123
  104    HB2  PRO  18           1HB      PRO  18   4.430  -4.883   6.790
  105    HB3  PRO  18           2HB      PRO  18   5.414  -5.971   5.806
  106    HG2  PRO  18           1HG      PRO  18   6.192  -3.421   7.173
  107    HG3  PRO  18           2HG      PRO  18   7.063  -4.962   7.110
  108    HD2  PRO  18           1HD      PRO  18   7.668  -2.847   5.504
  109    HD3  PRO  18           2HD      PRO  18   7.928  -4.535   5.033
  110    H    ALA  19           H        ALA  19   5.185  -1.624   4.834
  111    HA   ALA  19           HA       ALA  19   3.059  -0.852   6.513
  112    HB1  ALA  19           3HB      ALA  19   3.703   1.430   5.151
  113    HB2  ALA  19           1HB      ALA  19   5.185   0.481   5.017
  114    HB3  ALA  19           2HB      ALA  19   4.511   0.845   6.605
  115    H    CYS  20           H        CYS  20   3.569  -0.300   3.078
  116    HA   CYS  20           HA       CYS  20   2.238   0.103   1.376
  117    HB2  CYS  20           1HB      CYS  20   0.271  -1.662   2.804
  118    HB3  CYS  20           2HB      CYS  20   0.414  -1.371   1.086
  119    H    ARG  21           H        ARG  21   2.156   2.177   3.096
  120    HA   ARG  21           HA       ARG  21  -0.441   2.892   3.996
  121    HE   ARG  21           HE       ARG  21   1.737   4.288   7.989
  122    HB2  ARG  21           1HB      ARG  21   2.015   4.563   3.446
  123    HB3  ARG  21           2HB      ARG  21   0.509   5.255   4.020
  124    HG2  ARG  21           1HG      ARG  21   0.640   3.686   5.973
  125    HG3  ARG  21           2HG      ARG  21   2.271   3.276   5.437
  126    HD2  ARG  21           1HD      ARG  21   3.008   5.529   5.726
  127    HD3  ARG  21           2HD      ARG  21   1.361   6.088   6.016
  128   HH11  ARG  21          1HH1      ARG  21   3.612   7.022   6.894
  129   HH12  ARG  21          2HH1      ARG  21   4.268   7.357   8.460
  130   HH21  ARG  21          1HH2      ARG  21   2.600   4.729  10.049
  131   HH22  ARG  21          2HH2      ARG  21   3.694   6.055  10.253
  132    H    LEU  22           H        LEU  22  -1.903   4.353   3.172
  133    HA   LEU  22           HA       LEU  22  -2.742   4.065   0.612
  134    HG   LEU  22           HG       LEU  22  -4.425   5.773  -0.216
  135    HB2  LEU  22           1HB      LEU  22  -4.159   5.063   2.301
  136    HB3  LEU  22           2HB      LEU  22  -3.119   6.474   2.380
  137   HD11  LEU  22          1HD1      LEU  22  -6.208   5.674   1.474
  138   HD12  LEU  22          2HD1      LEU  22  -6.392   7.047   0.383
  139   HD13  LEU  22          3HD1      LEU  22  -5.767   7.294   2.013
  140   HD21  LEU  22          3HD2      LEU  22  -3.204   8.145   1.088
  141   HD22  LEU  22          1HD2      LEU  22  -4.517   8.414  -0.060
  142   HD23  LEU  22          2HD2      LEU  22  -3.059   7.563  -0.570
  143    H    SER  23           H        SER  23  -0.944   6.828   1.835
  144    HA   SER  23           HA       SER  23  -0.602   8.177  -0.574
  145    HG   SER  23           HG       SER  23   0.439  10.540   1.470
  146    HB2  SER  23           1HB      SER  23   0.782   8.177   2.053
  147    HB3  SER  23           2HB      SER  23   1.641   8.912   0.700
  148    H    CYS  24           H        CYS  24   1.051   5.365   0.627
  149    HA   CYS  24           HA       CYS  24   3.134   5.613  -1.384
  150    HB2  CYS  24           1HB      CYS  24   3.653   4.870   1.001
  151    HB3  CYS  24           2HB      CYS  24   2.788   3.383   0.634
  152    H    CYS  25           H        CYS  25   0.460   3.382  -0.586
  153    HA   CYS  25           HA       CYS  25   1.028   1.543  -2.590
  154    HB2  CYS  25           1HB      CYS  25  -1.486   2.289  -1.163
  155    HB3  CYS  25           2HB      CYS  25  -1.518   1.107  -2.459
  156    H    SER  26           H        SER  26  -1.512   4.005  -2.769
  157    HA   SER  26           HA       SER  26  -1.646   3.747  -5.605
  158    HG   SER  26           HG       SER  26  -2.940   5.778  -2.780
  159    HB2  SER  26           1HB      SER  26  -3.412   5.354  -5.525
  160    HB3  SER  26           2HB      SER  26  -3.603   4.231  -4.177
  161    H    LEU  27           H        LEU  27  -0.713   6.369  -3.479
  162    HA   LEU  27           HA       LEU  27   0.508   7.806  -5.698
  163    HG   LEU  27           HG       LEU  27   1.805   9.920  -4.561
  164    HB2  LEU  27           1HB      LEU  27  -0.947   8.922  -3.981
  165    HB3  LEU  27           2HB      LEU  27   0.315   8.625  -2.802
  166   HD11  LEU  27          1HD1      LEU  27   0.754  11.358  -5.987
  167   HD12  LEU  27          2HD1      LEU  27  -0.716  11.426  -5.014
  168   HD13  LEU  27          3HD1      LEU  27  -0.388  10.014  -6.018
  169   HD21  LEU  27          3HD2      LEU  27   1.782  11.624  -3.077
  170   HD22  LEU  27          1HD2      LEU  27   0.815  10.492  -2.133
  171   HD23  LEU  27          2HD2      LEU  27   0.022  11.749  -3.083
  172    H    GLY  28           H        GLY  28   1.826   5.407  -5.062
  173    HA2  GLY  28           1HA      GLY  28   4.475   6.410  -4.628
  174    HA3  GLY  28           2HA      GLY  28   3.896   5.462  -3.265
  Start of MODEL   10
    1    HA   ALA   1           HA       ALA   1   7.687 -12.758  -0.258
    2    H1   ALA   1           1H       ALA   1   9.123 -11.031  -0.523
    3    H2   ALA   1           2H       ALA   1   9.177 -11.354   1.161
    4    H3   ALA   1           3H       ALA   1   8.279 -10.017   0.570
    5    HB1  ALA   1           3HB      ALA   1   6.989 -11.383   2.296
    6    HB2  ALA   1           1HB      ALA   1   7.431 -13.066   2.008
    7    HB3  ALA   1           2HB      ALA   1   5.829 -12.485   1.553
    8    H    GLN   2           H        GLN   2   5.424 -12.912  -0.911
    9    HA   GLN   2           HA       GLN   2   4.641 -11.262  -2.881
   10    HB2  GLN   2           1HB      GLN   2   2.388 -12.092  -2.678
   11    HB3  GLN   2           2HB      GLN   2   3.508 -13.364  -2.283
   12    HG2  GLN   2           1HG      GLN   2   2.568 -13.658  -0.294
   13    HG3  GLN   2           2HG      GLN   2   2.772 -11.951   0.100
   14   HE21  GLN   2          1HE2      GLN   2   0.555 -14.223   0.073
   15   HE22  GLN   2          2HE2      GLN   2  -0.853 -13.323  -0.366
   16    H    ASN   3           H        ASN   3   3.244  -9.562  -3.196
   17    HA   ASN   3           HA       ASN   3   3.122  -7.676  -0.965
   18    HB2  ASN   3           1HB      ASN   3   4.205  -6.729  -2.823
   19    HB3  ASN   3           2HB      ASN   3   3.023  -7.376  -3.950
   20   HD21  ASN   3          1HD2      ASN   3   2.573  -5.497  -4.855
   21   HD22  ASN   3          2HD2      ASN   3   1.710  -4.216  -4.072
   22    HA   PRO   4           HA       PRO   4  -1.298  -9.133  -1.344
   23    HB2  PRO   4           1HB      PRO   4  -1.939  -8.768   1.278
   24    HB3  PRO   4           2HB      PRO   4  -1.221 -10.257   0.651
   25    HG2  PRO   4           1HG      PRO   4   0.114  -7.940   2.013
   26    HG3  PRO   4           2HG      PRO   4   0.345  -9.680   2.282
   27    HD2  PRO   4           1HD      PRO   4   2.057  -8.247   0.831
   28    HD3  PRO   4           2HD      PRO   4   1.661  -9.922   0.393
   29    H    CYS   5           H        CYS   5   0.210  -6.268  -0.272
   30    HA   CYS   5           HA       CYS   5  -2.016  -4.709   0.361
   31    HB2  CYS   5           1HB      CYS   5   0.598  -3.760  -0.825
   32    HB3  CYS   5           2HB      CYS   5  -0.530  -2.842   0.157
   33    H    SER   6           H        SER   6  -0.615  -5.631  -2.677
   34    HA   SER   6           HA       SER   6  -1.813  -3.712  -4.352
   35    HG   SER   6           HG       SER   6   0.740  -5.457  -5.920
   36    HB2  SER   6           1HB      SER   6  -0.805  -6.506  -4.789
   37    HB3  SER   6           2HB      SER   6  -1.676  -5.671  -6.074
   38    H    LEU   7           H        LEU   7  -2.886  -6.780  -3.099
   39    HA   LEU   7           HA       LEU   7  -5.362  -6.962  -4.476
   40    HG   LEU   7           HG       LEU   7  -6.008  -9.134  -4.469
   41    HB2  LEU   7           1HB      LEU   7  -3.910  -8.666  -2.980
   42    HB3  LEU   7           2HB      LEU   7  -5.079  -8.170  -1.792
   43   HD11  LEU   7          1HD1      LEU   7  -4.806 -10.748  -2.286
   44   HD12  LEU   7          2HD1      LEU   7  -4.796 -11.011  -4.030
   45   HD13  LEU   7          3HD1      LEU   7  -6.243 -11.379  -3.091
   46   HD21  LEU   7          3HD2      LEU   7  -7.378  -9.797  -1.942
   47   HD22  LEU   7          1HD2      LEU   7  -8.039  -9.281  -3.493
   48   HD23  LEU   7          2HD2      LEU   7  -7.352  -8.091  -2.389
   49    H    GLN   8           H        GLN   8  -4.263  -5.527  -1.547
   50    HA   GLN   8           HA       GLN   8  -6.906  -4.898  -0.550
   51    HB2  GLN   8           1HB      GLN   8  -4.335  -3.727   0.488
   52    HB3  GLN   8           2HB      GLN   8  -5.834  -4.013   1.357
   53    HG2  GLN   8           1HG      GLN   8  -5.161  -6.538   0.607
   54    HG3  GLN   8           2HG      GLN   8  -3.574  -5.803   0.846
   55   HE21  GLN   8          1HE2      GLN   8  -4.924  -7.880   2.382
   56   HE22  GLN   8          2HE2      GLN   8  -5.020  -7.290   4.004
   57    H    GLN   9           H        GLN   9  -4.360  -3.303  -2.319
   58    HA   GLN   9           HA       GLN   9  -6.126  -1.072  -2.855
   59    HB2  GLN   9           1HB      GLN   9  -3.343  -0.793  -1.720
   60    HB3  GLN   9           2HB      GLN   9  -4.195   0.526  -2.511
   61    HG2  GLN   9           1HG      GLN   9  -5.078   1.047  -0.551
   62    HG3  GLN   9           2HG      GLN   9  -5.983  -0.462  -0.616
   63   HE21  GLN   9          1HE2      GLN   9  -2.988   1.017   0.542
   64   HE22  GLN   9          2HE2      GLN   9  -2.707  -0.132   1.799
   65    HA   PRO  10           HA       PRO  10  -4.430  -1.982  -6.871
   66    HB2  PRO  10           1HB      PRO  10  -5.412   0.137  -8.243
   67    HB3  PRO  10           2HB      PRO  10  -6.416  -1.226  -7.735
   68    HG2  PRO  10           1HG      PRO  10  -6.099   1.469  -6.474
   69    HG3  PRO  10           2HG      PRO  10  -7.575   0.521  -6.734
   70    HD2  PRO  10           1HD      PRO  10  -6.299   0.639  -4.342
   71    HD3  PRO  10           2HD      PRO  10  -7.212  -0.787  -4.876
   72    H    GLY  11           H        GLY  11  -2.652  -1.530  -8.020
   73    HA2  GLY  11           1HA      GLY  11  -0.775  -0.407  -8.803
   74    HA3  GLY  11           2HA      GLY  11  -1.486   1.071  -8.199
   75    H    CYS  12           H        CYS  12  -1.516  -0.578  -5.453
   76    HA   CYS  12           HA       CYS  12   0.569   0.746  -4.259
   77    HB2  CYS  12           1HB      CYS  12  -1.226  -0.408  -3.066
   78    HB3  CYS  12           2HB      CYS  12  -0.500  -1.938  -3.497
   79    H    SER  13           H        SER  13   2.555   0.665  -4.528
   80    HA   SER  13           HA       SER  13   4.093  -1.250  -5.851
   81    HG   SER  13           HG       SER  13   6.625  -0.332  -3.885
   82    HB2  SER  13           1HB      SER  13   4.925   0.983  -5.684
   83    HB3  SER  13           2HB      SER  13   4.873   0.936  -3.927
   84    H    SER  14           H        SER  14   5.077  -3.088  -5.177
   85    HA   SER  14           HA       SER  14   4.382  -4.301  -2.730
   86    HG   SER  14           HG       SER  14   5.462  -5.351  -5.898
   87    HB2  SER  14           1HB      SER  14   6.836  -4.905  -4.370
   88    HB3  SER  14           2HB      SER  14   5.976  -6.003  -3.294
   89    H    ALA  15           H        ALA  15   7.009  -2.287  -3.719
   90    HA   ALA  15           HA       ALA  15   8.752  -2.649  -1.556
   91    HB1  ALA  15           3HB      ALA  15   9.973  -1.533  -3.057
   92    HB2  ALA  15           1HB      ALA  15   9.215  -0.072  -2.421
   93    HB3  ALA  15           2HB      ALA  15   8.542  -0.867  -3.845
   94    H    CYS  16           H        CYS  16   5.720  -1.186  -1.709
   95    HA   CYS  16           HA       CYS  16   6.217   0.777   0.363
   96    HB2  CYS  16           1HB      CYS  16   3.683  -0.239  -0.940
   97    HB3  CYS  16           2HB      CYS  16   3.660   0.879   0.414
   98    H    ALA  17           H        ALA  17   5.477  -2.566   0.113
   99    HA   ALA  17           HA       ALA  17   4.234  -2.859   2.675
  100    HB1  ALA  17           3HB      ALA  17   3.769  -4.872   1.842
  101    HB2  ALA  17           1HB      ALA  17   5.481  -5.296   1.915
  102    HB3  ALA  17           2HB      ALA  17   4.820  -4.543   0.464
  103    HA   PRO  18           HA       PRO  18   4.278  -4.823   4.111
  104    HB2  PRO  18           1HB      PRO  18   4.356  -4.879   6.779
  105    HB3  PRO  18           2HB      PRO  18   5.326  -5.981   5.797
  106    HG2  PRO  18           1HG      PRO  18   6.141  -3.446   7.172
  107    HG3  PRO  18           2HG      PRO  18   6.987  -5.003   7.109
  108    HD2  PRO  18           1HD      PRO  18   7.633  -2.894   5.510
  109    HD3  PRO  18           2HD      PRO  18   7.865  -4.585   5.034
  110    H    ALA  19           H        ALA  19   5.168  -1.627   4.836
  111    HA   ALA  19           HA       ALA  19   3.043  -0.831   6.507
  112    HB1  ALA  19           3HB      ALA  19   3.726   1.446   5.151
  113    HB2  ALA  19           1HB      ALA  19   5.195   0.476   5.032
  114    HB3  ALA  19           2HB      ALA  19   4.511   0.850   6.613
  115    H    CYS  20           H        CYS  20   3.577  -0.267   3.077
  116    HA   CYS  20           HA       CYS  20   2.261   0.158   1.371
  117    HB2  CYS  20           1HB      CYS  20   0.269  -1.596   2.777
  118    HB3  CYS  20           2HB      CYS  20   0.424  -1.298   1.060
  119    H    ARG  21           H        ARG  21   2.184   2.227   3.100
  120    HA   ARG  21           HA       ARG  21  -0.413   2.959   3.984
  121    HE   ARG  21           HE       ARG  21   2.006   6.714   6.952
  122    HB2  ARG  21           1HB      ARG  21   2.061   4.611   3.461
  123    HB3  ARG  21           2HB      ARG  21   0.554   5.316   4.018
  124    HG2  ARG  21           1HG      ARG  21   0.664   4.240   6.080
  125    HG3  ARG  21           2HG      ARG  21   1.846   3.062   5.509
  126    HD2  ARG  21           1HD      ARG  21   3.495   4.363   6.228
  127    HD3  ARG  21           2HD      ARG  21   2.952   5.652   5.154
  128   HH11  ARG  21          1HH1      ARG  21   2.816   3.442   7.857
  129   HH12  ARG  21          2HH1      ARG  21   2.489   3.694   9.538
  130   HH21  ARG  21          1HH2      ARG  21   1.576   7.047   9.163
  131   HH22  ARG  21          2HH2      ARG  21   1.785   5.740  10.280
  132    H    LEU  22           H        LEU  22  -1.860   4.429   3.153
  133    HA   LEU  22           HA       LEU  22  -2.679   4.162   0.583
  134    HG   LEU  22           HG       LEU  22  -3.653   7.106   0.005
  135    HB2  LEU  22           1HB      LEU  22  -4.100   5.161   2.271
  136    HB3  LEU  22           2HB      LEU  22  -3.054   6.567   2.357
  137   HD11  LEU  22          1HD1      LEU  22  -5.128   4.563   0.297
  138   HD12  LEU  22          2HD1      LEU  22  -4.373   5.283  -1.124
  139   HD13  LEU  22          3HD1      LEU  22  -5.945   5.861  -0.573
  140   HD21  LEU  22          3HD2      LEU  22  -5.897   6.870   2.002
  141   HD22  LEU  22          1HD2      LEU  22  -5.981   7.819   0.519
  142   HD23  LEU  22          2HD2      LEU  22  -4.811   8.240   1.770
  143    H    SER  23           H        SER  23  -0.867   6.901   1.842
  144    HA   SER  23           HA       SER  23  -0.495   8.266  -0.552
  145    HG   SER  23           HG       SER  23   1.798   9.595  -0.288
  146    HB2  SER  23           1HB      SER  23   0.048   8.995   1.864
  147    HB3  SER  23           2HB      SER  23   1.609   8.220   1.597
  148    H    CYS  24           H        CYS  24   1.126   5.431   0.637
  149    HA   CYS  24           HA       CYS  24   3.224   5.676  -1.357
  150    HB2  CYS  24           1HB      CYS  24   3.720   4.911   1.027
  151    HB3  CYS  24           2HB      CYS  24   2.845   3.433   0.642
  152    H    CYS  25           H        CYS  25   0.524   3.462  -0.594
  153    HA   CYS  25           HA       CYS  25   1.092   1.635  -2.608
  154    HB2  CYS  25           1HB      CYS  25  -1.426   2.388  -1.194
  155    HB3  CYS  25           2HB      CYS  25  -1.458   1.219  -2.500
  156    H    SER  26           H        SER  26  -1.420   4.126  -2.790
  157    HA   SER  26           HA       SER  26  -1.549   3.869  -5.625
  158    HG   SER  26           HG       SER  26  -2.835   7.077  -4.181
  159    HB2  SER  26           1HB      SER  26  -3.289   5.507  -5.548
  160    HB3  SER  26           2HB      SER  26  -3.502   4.378  -4.209
  161    H    LEU  27           H        LEU  27  -0.265   6.256  -3.436
  162    HA   LEU  27           HA       LEU  27   0.911   7.693  -5.715
  163    HG   LEU  27           HG       LEU  27   2.214   9.823  -4.602
  164    HB2  LEU  27           1HB      LEU  27  -0.596   8.933  -4.156
  165    HB3  LEU  27           2HB      LEU  27   0.568   8.653  -2.875
  166   HD11  LEU  27          1HD1      LEU  27   1.225  11.423  -5.995
  167   HD12  LEU  27          2HD1      LEU  27  -0.357  11.233  -5.238
  168   HD13  LEU  27          3HD1      LEU  27   0.287   9.955  -6.268
  169   HD21  LEU  27          3HD2      LEU  27   1.599  12.005  -3.512
  170   HD22  LEU  27          1HD2      LEU  27   1.901  10.666  -2.406
  171   HD23  LEU  27          2HD2      LEU  27   0.246  11.161  -2.759
  172    H    GLY  28           H        GLY  28   2.218   5.363  -5.034
  173    HA2  GLY  28           1HA      GLY  28   4.817   6.408  -4.352
  174    HA3  GLY  28           2HA      GLY  28   4.163   5.328  -3.129