*HEADER    STRUCTURAL PROTEIN                      17-NOV-06   2NX6              
*TITLE     STRUCTURE OF NOWA CYSTEINE RICH DOMAIN 6                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEMATOCYST OUTER WALL ANTIGEN;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: DOMAIN 6 OF THE NOWA OCTAREPEAT DOMAIN;                    
*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    DISULFIDE RICH, TURNS, STRUCTURAL 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 2NX6    0                                                


assign (resid   2   and name  HN)  (resid      2   and name  HB# )    2.59248  0.316992  0.475488
assign (resid   3   and name  HN)  (resid      2   and name  HA )    2.33808  0.215232  0.322848
assign (resid   3   and name  HN)  (resid      3   and name  HB2 )    2.91776  0.447104  0.670656
assign (resid   3   and name  HN)  (resid      4   and name  HN )    2.73815  0.37526  0.56289
assign (resid   3   and name  HN)  (resid      3   and name  HB1 )    2.65027  0.340108  0.510162
assign (resid   3   and name  HN)  (resid      3   and name  HA )    2.59248  0.316992  0.475488
assign (resid   4   and name  HN)  (resid      3   and name  HA )    2.34559  0.218236  0.327354
assign (resid   4   and name  HN)  (resid      16   and name  HB# )    3.34706  0.618824  0.928236
assign (resid   4   and name  HN)  (resid      4   and name  HA )    2.92304  0.449216  0.673824
assign (resid   4   and name  HN)  (resid      3   and name  HB# )    2.81735  0.40694  0.91041
assign (resid   4   and name  HN)  (resid      4   and name  HB2 )    2.81735  0.40694  0.61041
assign (resid   4   and name  HN)  (resid      4   and name  HB# )    2.73038  0.372152  0.558228
assign (resid   4   and name  HN)  (resid      5   and name  HN )    2.72276  0.369104  0.553656
assign (resid   5   and name  HN)  (resid      5   and name  HB1 )    3.21614  0.166456  0.349684
assign (resid   5   and name  HN)  (resid      4   and name  HB2 )    3.12269  0.529076  0.793614
assign (resid   5   and name  HN)  (resid      6   and name  HD# )    3.08237  0.512948  0.969422
assign (resid   5   and name  HN)  (resid      4   and name  HN )    2.79733  0.198932  0.198398
assign (resid   5   and name  HN)  (resid      5   and name  HA )    2.67042  0.248168  0.522252
assign (resid   5   and name  HN)  (resid      4   and name  HB# )    2.63539  0.334156  0.501234
assign (resid   5   and name  HN)  (resid      5   and name  HB2 )    2.55472  0.101888  0.152832
assign (resid   5   and name  HN)  (resid      6   and name  HA )    3.73878  0.775512  1.16327
assign (resid   5   and name  HN)  (resid      4   and name  HA )    2.51243  0.284972  0.627458
assign (resid   5   and name  HN)  (resid      16   and name  HB# )    3.65966  0.743864  1.1158
assign (resid   5   and name  HN)  (resid      6   and name  HD2 )    3.64037  0.736148  1.10422
assign (resid   7   and name  HN)  (resid      8   and name  HB# )    3.45411  0.661644  1.192466
assign (resid   7   and name  HN)  (resid      6   and name  HB# )    3.31608  0.606432  0.909648
assign (resid   7   and name  HN)  (resid      7   and name  HG2 )    3.22311  0.569244  0.853866
assign (resid   7   and name  HN)  (resid      6   and name  HA )    3.13408  0.533632  0.800448
assign (resid   7   and name  HN)  (resid      7   and name  HG# )    2.97382  0.469528  0.704292
assign (resid   7   and name  HN)  (resid      6   and name  HD# )    2.94673  0.458692  0.688038
assign (resid   7   and name  HN)  (resid      7   and name  HA )    2.74267  0.377068  0.565602
assign (resid   7   and name  HN)  (resid      7   and name  HB1 )    2.72601  0.570404  0.655606
assign (resid   7   and name  HN)  (resid      8   and name  HN )    2.61211  0.124844  0.187266
assign (resid   7   and name  HN)  (resid      7   and name  HB2 )    2.54518  0.298072  0.447108
assign (resid   7   and name  HN)  (resid      8   and name  HD# )    3.61155  0.72462  1.08693
assign (resid   7   and name  HN)  (resid      5   and name  HA )    3.58425  0.7137  1.07055
assign (resid   8   and name  HN)  (resid      6   and name  HA )    3.42641  0.650564  0.975846
assign (resid   8   and name  HN)  (resid      7   and name  HB# )    3.34706  0.618824  0.928236
assign (resid   8   and name  HN)  (resid      9   and name  HD# )    3.34706  0.618824  0.928236
assign (resid   8   and name  HN)  (resid      7   and name  HA )    3.20928  0.563712  0.845568
assign (resid   8   and name  HN)  (resid      8   and name  HB2 )    3.12269  0.529076  0.793614
assign (resid   8   and name  HN)  (resid      8   and name  HD# )    3.00276  0.481104  0.721656
assign (resid   8   and name  HN)  (resid      8   and name  HA )    2.8327  0.21308  0.21962
assign (resid   8   and name  HN)  (resid      5   and name  HA )    4.12732  0.330928  0.89639
assign (resid   8   and name  HN)  (resid      8   and name  HB# )    2.65116  0.340464  0.510696
assign (resid   8   and name  HN)  (resid      7   and name  HN )    2.5294  0.19176  0.23764
assign (resid   8   and name  HN)  (resid      7   and name  HB1 )    3.4639  0.66556  0.99834
assign (resid   10   and name  HN)  (resid      9   and name  HB1 )    3.44844  0.359376  0.889064
assign (resid   10   and name  HN)  (resid      9   and name  HB2 )    3.25584  0.382336  0.773504
assign (resid   10   and name  HN)  (resid      9   and name  HD# )    3.17326  0.549304  0.423956
assign (resid   10   and name  HN)  (resid      11   and name  HN )    2.79215  0.19686  0.19529
assign (resid   10   and name  HN)  (resid      10   and name  HA )    2.71004  0.264016  0.246024
assign (resid   10   and name  HN)  (resid      10   and name  HB# )    2.67899  0.351596  0.527394
assign (resid   10   and name  HN)  (resid      9   and name  HA )    2.66761  0.247044  0.620566
assign (resid   10   and name  HN)  (resid      8   and name  HB# )    3.49447  0.377788  0.71668
assign (resid   11   and name  HN)  (resid      8   and name  HB# )    3.40019  0.340076  0.760114
assign (resid   11   and name  HN)  (resid      10   and name  HB# )    3.01359  0.485436  0.728154
assign (resid   11   and name  HN)  (resid      11   and name  HA )    2.71741  0.266964  0.350446
assign (resid   11   and name  HN)  (resid      10   and name  HN )    2.71635  0.26654  0.14981
assign (resid   11   and name  HN)  (resid      10   and name  HA )    2.66297  0.245188  0.617782
assign (resid   11   and name  HN)  (resid      11   and name  HB1 )    2.61373  0.125492  0.188238
assign (resid   11   and name  HN)  (resid      8   and name  HB# )    3.7368  0.57472  0.96208
assign (resid   11   and name  HN)  (resid      11   and name  HB2 )    2.50273  0.181092  0.121638
assign (resid   11   and name  HN)  (resid      24   and name  HB# )    3.62019  0.728076  1.09211
assign (resid   12   and name  HN)  (resid      11   and name  HA )    2.23941  0.175764  0.163646
assign (resid   12   and name  HN)  (resid      12   and name  HA )    2.65027  0.340108  0.510162
assign (resid   12   and name  HN)  (resid      12   and name  HB1 )    2.47515  0.27006  0.40509
assign (resid   12   and name  HN)  (resid      12   and name  HB# )    2.46695  0.26678  0.40017
assign (resid   14   and name  HN)  (resid      13   and name  HG# )    3.4373  0.65492  0.98238
assign (resid   14   and name  HN)  (resid      12   and name  HB1 )    3.42641  0.250564  0.175846
assign (resid   14   and name  HN)  (resid      12   and name  HA )    3.41051  0.244204  0.266306
assign (resid   14   and name  HN)  (resid      14   and name  HB# )    2.21057  0.164228  0.246342
assign (resid   14   and name  HN)  (resid      13   and name  HB# )    2.94673  0.458692  0.688038
assign (resid   14   and name  HN)  (resid      14   and name  HA )    2.58868  0.315472  0.473208
assign (resid   15   and name  HN)  (resid      14   and name  HB# )    3.11988  0.527952  0.791928
assign (resid   15   and name  HN)  (resid      14   and name  HA )    3.04544  0.298176  0.747264
assign (resid   15   and name  HN)  (resid      15   and name  HA )    3.00276  0.281104  0.221656
assign (resid   15   and name  HN)  (resid      14   and name  HN )    2.76125  0.1845  0.17675
assign (resid   15   and name  HN)  (resid      15   and name  HB# )    2.5902  0.31608  0.47412
assign (resid   15   and name  HN)  (resid      16   and name  HN )    2.58944  0.215776  0.273664
assign (resid   16   and name  HN)  (resid      15   and name  HA )    3.21531  0.330124  0.105186
assign (resid   16   and name  HN)  (resid      16   and name  HA )    3.20251  0.461004  0.341506
assign (resid   16   and name  HN)  (resid      15   and name  HN )    2.79994  0.199976  0.199964
assign (resid   16   and name  HN)  (resid      16   and name  HB1 )    2.45058  0.160232  0.190348
assign (resid   16   and name  HN)  (resid      15   and name  HB# )    3.46216  0.664864  0.997296
assign (resid   18   and name  HN)  (resid      17   and name  HA )    3.28701  0.594804  0.892206
assign (resid   18   and name  HN)  (resid      18   and name  HG# )    3.23376  0.573504  0.860256
assign (resid   18   and name  HN)  (resid      16   and name  HA )    3.10612  0.522448  0.783672
assign (resid   18   and name  HN)  (resid      17   and name  HB# )    2.97784  0.471136  0.906704
assign (resid   18   and name  HN)  (resid      17   and name  HD# )    2.89397  0.437588  0.656382
assign (resid   18   and name  HN)  (resid      18   and name  HA )    2.82705  0.41082  0.61623
assign (resid   18   and name  HN)  (resid      18   and name  HG# )    2.81057  0.404228  0.606342
assign (resid   18   and name  HN)  (resid      19   and name  HN )    2.71109  0.104436  0.106654
assign (resid   18   and name  HN)  (resid      17   and name  HD# )    3.7241  0.76964  1.15446
assign (resid   18   and name  HN)  (resid      18   and name  HB# )    2.48581  0.274324  0.411486
assign (resid   19   and name  HN)  (resid      19   and name  HA )    2.29958  0.109832  0.109748
assign (resid   19   and name  HN)  (resid      17   and name  HA )    3.30759  0.603036  0.904554
assign (resid   19   and name  HN)  (resid      18   and name  HA )    3.19255  0.55702  0.83553
assign (resid   19   and name  HN)  (resid      18   and name  HG# )    2.9922  0.47688  0.71532
assign (resid   19   and name  HN)  (resid      20   and name  HN )    2.94861  0.159444  0.189166
assign (resid   19   and name  HN)  (resid      18   and name  HB# )    2.93746  0.454984  0.682476
assign (resid   19   and name  HN)  (resid      18   and name  HN )    2.8668  0.22672  0.24008
assign (resid   19   and name  HN)  (resid      16   and name  HA )    2.55749  0.302996  0.454494
assign (resid   19   and name  HN)  (resid      16   and name  HB# )    3.62978  0.731912  1.09787
assign (resid   20   and name  HN)  (resid      20   and name  HB2 )    3.2373  0.65492  0.48238
assign (resid   20   and name  HN)  (resid      19   and name  HN )    2.99585  0.55834  0.53751
assign (resid   20   and name  HN)  (resid      20   and name  HA )    2.98928  0.655712  0.233568
assign (resid   20   and name  HN)  (resid      19   and name  HA )    2.96084  0.544336  0.216504
assign (resid   20   and name  HN)  (resid      20   and name  HB# )    2.82987  0.411948  0.617922
assign (resid   20   and name  HN)  (resid      23   and name  HB1 )    3.56755  0.70702  0.76053
assign (resid   21   and name  HN)  (resid      20   and name  HB# )    3.3034  0.60136  0.90204
assign (resid   21   and name  HN)  (resid      20   and name  HA )    2.14522  0.138088  0.207132
assign (resid   21   and name  HN)  (resid      21   and name  HG# )    3.07981  0.511924  0.767886
assign (resid   21   and name  HN)  (resid      22   and name  HN )    2.7795  0.1918  0.2877
assign (resid   21   and name  HN)  (resid      21   and name  HA )    2.76966  0.387864  0.581796
assign (resid   21   and name  HN)  (resid      20   and name  HB# )    2.73592  0.374368  0.561552
assign (resid   21   and name  HN)  (resid      21   and name  HB# )    2.51675  0.2867  0.43005
assign (resid   21   and name  HN)  (resid      8   and name  HE# )    3.60382  0.721528  1.08229
assign (resid   21   and name  HN)  (resid      21   and name  HB2 )    2.45058  0.260232  0.390348
assign (resid   22   and name  HN)  (resid      21   and name  HG# )    3.45411  0.661644  0.992466
assign (resid   22   and name  HN)  (resid      21   and name  HA )    3.30759  0.603036  0.904554
assign (resid   22   and name  HN)  (resid      21   and name  HB# )    3.16391  0.545564  0.818346
assign (resid   22   and name  HN)  (resid      22   and name  HG# )    3.08754  0.515016  0.772524
assign (resid   22   and name  HN)  (resid      20   and name  HB# )    2.77455  0.38982  0.58473
assign (resid   22   and name  HN)  (resid      22   and name  HB# )    2.67516  0.350064  0.525096
assign (resid   22   and name  HN)  (resid      21   and name  HN )    2.6073  0.32292  0.48438
assign (resid   22   and name  HN)  (resid      23   and name  HN )    2.58717  0.314868  0.472302
assign (resid   22   and name  HN)  (resid      22   and name  HA )    2.53458  0.293832  0.440748
assign (resid   22   and name  HN)  (resid      20   and name  HA )    3.6322  0.73288  1.09932
assign (resid   22   and name  HN)  (resid      22   and name  HB# )    2.38203  0.232812  0.349218
assign (resid   23   and name  HN)  (resid      22   and name  HB2 )    3.08495  0.51398  0.77097
assign (resid   23   and name  HN)  (resid      22   and name  HB# )    3.05499  0.501996  0.752994
assign (resid   23   and name  HN)  (resid      22   and name  HA )    2.92127  0.448508  0.672762
assign (resid   23   and name  HN)  (resid      23   and name  HA )    2.80389  0.401556  0.602334
assign (resid   23   and name  HN)  (resid      22   and name  HN )    2.75301  0.381204  0.571806
assign (resid   23   and name  HN)  (resid      24   and name  HN )    2.6178  0.22712  0.39068
assign (resid   23   and name  HN)  (resid      23   and name  HB1 )    2.59633  0.118532  0.277798
assign (resid   23   and name  HN)  (resid      23   and name  HB2 )    2.5753  0.11012  0.16518
assign (resid   24   and name  HN)  (resid      23   and name  HB2 )    3.39511  0.638044  0.957066
assign (resid   24   and name  HN)  (resid      24   and name  HA )    3.37531  0.530124  0.445186
assign (resid   24   and name  HN)  (resid      21   and name  HA )    3.23376  0.473504  0.760256
assign (resid   24   and name  HN)  (resid      24   and name  HB1 )    3.10073  0.520292  0.780438
assign (resid   24   and name  HN)  (resid      23   and name  HB# )    2.81057  0.304228  0.606342
assign (resid   24   and name  HN)  (resid      25   and name  HN )    2.73149  0.372596  0.558894
assign (resid   24   and name  HN)  (resid      23   and name  HN )    2.56239  0.304956  0.457434
assign (resid   24   and name  HN)  (resid      24   and name  HB2 )    2.54051  0.296204  0.444306
assign (resid   25   and name  HN)  (resid      22   and name  HA )    3.36571  0.626284  0.939426
assign (resid   25   and name  HN)  (resid      24   and name  HB2 )    3.06229  0.304916  0.257374
assign (resid   25   and name  HN)  (resid      25   and name  HG# )    2.91255  0.44502  0.66753
assign (resid   25   and name  HN)  (resid      25   and name  HB1 )    2.85612  0.522448  0.233672
assign (resid   25   and name  HN)  (resid      26   and name  HN )    2.73038  0.372152  0.558228
assign (resid   25   and name  HN)  (resid      24   and name  HN )    2.66575  0.3463  0.51945
assign (resid   25   and name  HN)  (resid      25   and name  HA )    2.62944  0.331776  0.497664
assign (resid   25   and name  HN)  (resid      25   and name  HB# )    2.49622  0.278488  0.417732
assign (resid   26   and name  HN)  (resid      26   and name  HG# )    3.14283  0.537132  0.805698
assign (resid   26   and name  HN)  (resid      26   and name  HB2 )    2.98599  0.474396  0.711594
assign (resid   26   and name  HN)  (resid      25   and name  HN )    2.9091  0.44364  0.66546
assign (resid   26   and name  HN)  (resid      26   and name  HA )    2.89232  0.436928  0.655392
assign (resid   26   and name  HN)  (resid      26   and name  HB# )    2.80389  0.401556  0.602334
assign (resid   26   and name  HN)  (resid      25   and name  HA )    2.76006  0.384024  0.576036
assign (resid   3   and name  HN)  (resid      3   and name  HB# )    3.00995  0.362985  0.48398
assign (resid   3   and name  HN)  (resid      4   and name  HN )    2.95049  0.345147  0.460196
assign (resid   3   and name  HN)  (resid      3   and name  HB# )    2.73853  0.281559  0.375412
assign (resid   3   and name  HN)  (resid      3   and name  HA )    2.59839  0.239517  0.319356
assign (resid   4   and name  HN)  (resid      16   and name  HB# )    3.50826  0.512478  0.683304
assign (resid   4   and name  HN)  (resid      3   and name  HA )    2.39015  0.177045  0.23606
assign (resid   4   and name  HN)  (resid      4   and name  HB2 )    2.99151  0.357453  0.476604
assign (resid   4   and name  HA)  (resid      4   and name  HB# )    2.81964  0.305892  0.407856
assign (resid   4   and name  HN)  (resid      4   and name  HA )    2.81417  0.304251  0.405668
assign (resid   4   and name  HN)  (resid      4   and name  HB# )    2.80967  0.302901  0.403868
assign (resid   4   and name  HA)  (resid      4   and name  HB# )    2.77373  0.292119  0.389492
assign (resid   5   and name  HB#)  (resid      11   and name  HB2 )    3.5255  0.51765  0.6902
assign (resid   5   and name  HN)  (resid      5   and name  HB1 )    3.43365  0.490095  0.65346
assign (resid   5   and name  HN)  (resid      4   and name  HB1 )    3.27639  0.442917  0.590556
assign (resid   5   and name  HA)  (resid      5   and name  HB2 )    3.25084  0.235252  0.380336
assign (resid   5   and name  HB#)  (resid      11   and name  HB# )    2.97919  0.353757  0.471676
assign (resid   5   and name  HN)  (resid      4   and name  HB# )    2.85014  0.315042  0.420056
assign (resid   5   and name  HN)  (resid      4   and name  HN )    2.83843  0.311529  0.415372
assign (resid   5   and name  HN)  (resid      5   and name  HA )    2.82705  0.308115  0.41082
assign (resid   5   and name  HN)  (resid      5   and name  HB2 )    2.78367  0.295101  0.193468
assign (resid   5   and name  HA)  (resid      5   and name  HB1 )    2.74003  0.282009  0.376012
assign (resid   5   and name  HA)  (resid      6   and name  HD2 )    2.70486  0.371458  0.461944
assign (resid   5   and name  HA)  (resid      6   and name  HD1 )    2.62247  0.246741  0.328988
assign (resid   5   and name  HN)  (resid      4   and name  HA )    2.60466  0.341398  0.621864
assign (resid   5   and name  HN)  (resid      11   and name  HB# )    3.77859  0.593577  0.791436
assign (resid   5   and name  HN)  (resid      3   and name  HA )    3.75015  0.585045  0.78006
assign (resid   5   and name  HN)  (resid      16   and name  HB# )    3.73548  0.580644  0.774192
assign (resid   7   and name  HN)  (resid      5   and name  HB# )    3.67175  0.561525  0.7487
assign (resid   7   and name  HN)  (resid      5   and name  HA )    3.6379  0.55137  0.73516
assign (resid   7   and name  HN)  (resid      7   and name  HG# )    3.57137  0.531411  0.708548
assign (resid   7   and name  HN)  (resid      7   and name  HG2 )    3.27116  0.441348  0.588464
assign (resid   7   and name  HN)  (resid      6   and name  HA )    3.23137  0.429411  0.572548
assign (resid   7   and name  HN)  (resid      6   and name  HD# )    3.17326  0.411978  0.549304
assign (resid   7   and name  HN)  (resid      7   and name  HA )    2.91543  0.334629  0.446172
assign (resid   7   and name  HN)  (resid      7   and name  HB1 )    2.91312  0.333936  0.445248
assign (resid   7   and name  HN)  (resid      8   and name  HN )    2.7577  0.28731  0.38308
assign (resid   7   and name  HN)  (resid      7   and name  HB2 )    2.74304  0.282912  0.377216
assign (resid   7   and name  HE21)  (resid      19   and name  HB2 )    3.7836  0.59508  0.79344
assign (resid   7   and name  HN)  (resid      6   and name  HD2 )    3.72185  0.576555  0.76874
assign (resid   8   and name  HE#)  (resid      7   and name  HG# )    3.68954  0.566862  0.755816
assign (resid   8   and name  HD#)  (resid      17   and name  HA )    3.66596  0.559788  2.846384
assign (resid   8   and name  HN)  (resid      7   and name  HA )    3.65456  0.556368  0.741824
assign (resid   8   and name  HD#)  (resid      9   and name  HD# )    3.6434  0.55302  0.73736
assign (resid   8   and name  HD#)  (resid      8   and name  HB2 )    2.47478  0.202434  0.269912
assign (resid   8   and name  HB2)  (resid      24   and name  HB1 )    3.62177  0.546531  0.728708
assign (resid   8   and name  HE#)  (resid      24   and name  HB# )    3.60613  0.541839  0.722452
assign (resid   8   and name  HE#)  (resid      8   and name  HB2 )    3.59595  0.538785  0.71838
assign (resid   8   and name  HD#)  (resid      8   and name  HB1 )    2.42031  0.186093  0.248124
assign (resid   8   and name  HD#)  (resid      7   and name  HG# )    3.5255  0.51765  0.6902
assign (resid   8   and name  HD#)  (resid      11   and name  HB2 )    3.51252  0.513756  0.685008
assign (resid   8   and name  HD#)  (resid      9   and name  HD# )    3.50404  0.511212  0.681616
assign (resid   8   and name  HE#)  (resid      8   and name  HB1 )    3.50404  0.611212  0.881616
assign (resid   8   and name  HD#)  (resid      5   and name  HB# )    3.45602  0.496806  0.662408
assign (resid   8   and name  HE#)  (resid      21   and name  HG2 )    3.41928  0.485784  0.647712
assign (resid   8   and name  HD#)  (resid      24   and name  HB2 )    3.41575  0.484725  0.6463
assign (resid   8   and name  HD#)  (resid      7   and name  HB1 )    3.40532  0.481596  0.642128
assign (resid   8   and name  HD#)  (resid      24   and name  HB1 )    3.39175  0.477525  0.6367
assign (resid   8   and name  HN)  (resid      8   and name  HB1 )    3.37855  0.473565  0.63142
assign (resid   8   and name  HE#)  (resid      25   and name  HB# )    3.3532  0.46596  0.62128
assign (resid   8   and name  HD#)  (resid      7   and name  HG# )    3.34706  0.464118  0.618824
assign (resid   8   and name  HB1)  (resid      24   and name  HB1 )    3.22663  0.427989  0.570652
assign (resid   8   and name  HB#)  (resid      9   and name  HD# )    3.21961  0.425883  0.567844
assign (resid   8   and name  HN)  (resid      8   and name  HD# )    3.19695  0.419085  0.55878
assign (resid   8   and name  HE#)  (resid      21   and name  HG1 )    3.15074  0.405222  0.540296
assign (resid   8   and name  HE#)  (resid      21   and name  HA )    3.10522  0.391566  0.522088
assign (resid   8   and name  HB1)  (resid      11   and name  HB2 )    3.08754  0.386262  0.515016
assign (resid   8   and name  HD#)  (resid      21   and name  HG1 )    3.06723  0.380169  0.506892
assign (resid   8   and name  HD#)  (resid      21   and name  HA )    3.01432  0.364296  0.485728
assign (resid   8   and name  HD#)  (resid      21   and name  HG2 )    2.95941  0.347823  0.463764
assign (resid   8   and name  HN)  (resid      8   and name  HB2 )    2.94176  0.342528  0.456704
assign (resid   8   and name  HB2)  (resid      11   and name  HB2 )    2.8462  0.51386  0.61848
assign (resid   8   and name  HA)  (resid      9   and name  HD1 )    2.8346  0.31038  0.41384
assign (resid   8   and name  HN)  (resid      8   and name  HA )    2.79215  0.297645  0.39686
assign (resid   8   and name  HA)  (resid      9   and name  HD2 )    2.69403  0.268209  0.357612
assign (resid   8   and name  HD#)  (resid      8   and name  HA )    2.62136  0.246408  0.328544
assign (resid   8   and name  HN)  (resid      7   and name  HG# )    3.83405  0.610215  0.81362
assign (resid   8   and name  HD#)  (resid      11   and name  HB1 )    3.82157  0.606471  0.808628
assign (resid   8   and name  HN)  (resid      9   and name  HD# )    3.70607  0.571821  0.762428
assign (resid   10   and name  HN)  (resid      9   and name  HG# )    3.65456  0.556368  0.741824
assign (resid   10   and name  HN)  (resid      9   and name  HD# )    3.32619  0.757857  0.610476
assign (resid   10   and name  HN)  (resid      9   and name  HB# )    3.29787  0.449361  0.599148
assign (resid   10   and name  HN)  (resid      11   and name  HN )    2.97382  0.352146  0.469528
assign (resid   10   and name  HN)  (resid      9   and name  HA )    2.80082  0.300246  0.400328
assign (resid   10   and name  HN)  (resid      10   and name  HB# )    2.75301  0.285903  0.381204
assign (resid   10   and name  HN)  (resid      10   and name  HA )    2.66328  0.258984  0.345312
assign (resid   10   and name  HN)  (resid      8   and name  HB# )    3.80262  0.600786  0.801048
assign (resid   11   and name  HN)  (resid      10   and name  HB# )    3.04781  0.374343  0.699124
assign (resid   11   and name  HB2)  (resid      24   and name  HB1 )    2.87356  0.322068  0.429424
assign (resid   11   and name  HN)  (resid      16   and name  HB# )    4.1468  0.70404  0.93872
assign (resid   11   and name  HN)  (resid      11   and name  HA )    2.7913  0.29739  0.39652
assign (resid   11   and name  HN)  (resid      10   and name  HA )    2.78535  0.295605  0.39414
assign (resid   11   and name  HN)  (resid      11   and name  HB1 )    2.67263  0.261789  0.349052
assign (resid   11   and name  HN)  (resid      11   and name  HB2 )    2.54586  0.223758  0.298344
assign (resid   12   and name  HA)  (resid      13   and name  HD1 )    2.45335  0.196005  0.26134
assign (resid   12   and name  HN)  (resid      12   and name  HB2 )    2.43315  0.189945  0.25326
assign (resid   12   and name  HN)  (resid      12   and name  HB# )    2.41406  0.184218  0.245624
assign (resid   12   and name  HN)  (resid      11   and name  HA )    2.2681  0.14043  0.18724
assign (resid   12   and name  HN)  (resid      12   and name  HA )    2.62859  0.248577  0.331436
assign (resid   12   and name  HA)  (resid      13   and name  HD2 )    2.62524  0.247572  0.330096
assign (resid   12   and name  HN)  (resid      11   and name  HB# )    3.70545  0.571635  0.76218
assign (resid   13   and name  HA)  (resid      13   and name  HG# )    3.51681  0.515043  0.686724
assign (resid   13   and name  HA)  (resid      13   and name  HB# )    2.66575  0.259725  0.3463
assign (resid   14   and name  HN)  (resid      12   and name  HB1 )    3.47152  0.501456  0.668608
assign (resid   14   and name  HN)  (resid      12   and name  HA )    3.39849  0.179547  0.439396
assign (resid   14   and name  HN)  (resid      13   and name  HG# )    3.35941  0.467823  0.623764
assign (resid   14   and name  HA)  (resid      14   and name  HB# )    2.2681  0.14043  0.18724
assign (resid   14   and name  HN)  (resid      14   and name  HB# )    2.24682  0.134046  0.178728
assign (resid   13   and name  HA)  (resid      16   and name  HB# )    3.25334  0.336002  0.481336
assign (resid   14   and name  HN)  (resid      12   and name  HB2 )    3.23137  0.429411  0.672548
assign (resid   14   and name  HN)  (resid      15   and name  HN )    3.06229  0.378687  0.104916
assign (resid   14   and name  HN)  (resid      13   and name  HG# )    3.03533  0.370599  0.494132
assign (resid   14   and name  HN)  (resid      13   and name  HA )    3.36328  0.258984  0.245312
assign (resid   14   and name  HN)  (resid      14   and name  HA )    2.66328  0.158984  0.245312
assign (resid   14   and name  HN)  (resid      13   and name  HB# )    3.78073  0.594219  0.792292
assign (resid   14   and name  HN)  (resid      13   and name  HD# )    3.70421  0.571263  0.761684
assign (resid   15   and name  HN)  (resid      14   and name  HB# )    3.36255  0.468765  0.62502
assign (resid   15   and name  HN)  (resid      12   and name  HB# )    3.25836  0.437508  0.583344
assign (resid   15   and name  HN)  (resid      14   and name  HA )    3.20814  0.222442  0.263256
assign (resid   15   and name  HN)  (resid      15   and name  HA )    3.0085  0.26255  0.2834
assign (resid   15   and name  HN)  (resid      16   and name  HN )    2.79387  0.198161  0.397548
assign (resid   15   and name  HN)  (resid      15   and name  HB# )    2.73112  0.279336  0.372448
assign (resid   15   and name  HN)  (resid      16   and name  HB# )    3.74611  0.583833  0.408444
assign (resid   16   and name  HB#)  (resid      17   and name  HD# )    3.6165  0.54495  0.7266
assign (resid   16   and name  HN)  (resid      15   and name  HA )    3.28598  0.235794  0.114392
assign (resid   16   and name  HN)  (resid      16   and name  HB# )    2.41098  0.183294  0.244392
assign (resid   16   and name  HN)  (resid      14   and name  HA )    3.42641  0.287923  0.150564
assign (resid   16   and name  HN)  (resid      16   and name  HA )    3.12362  0.297086  0.229448
assign (resid   16   and name  HN)  (resid      15   and name  HB2 )    3.83169  0.109507  0.112676
assign (resid   17   and name  HA)  (resid      16   and name  HB# )    2.26611  0.139833  0.186444
assign (resid   18   and name  HN)  (resid      18   and name  HB1 )    2.47478  0.202434  0.269912
assign (resid   18   and name  HN)  (resid      17   and name  HD# )    3.55252  0.525756  0.701008
assign (resid   18   and name  HN)  (resid      18   and name  HG2 )    3.51252  0.513756  0.685008
assign (resid   18   and name  HN)  (resid      17   and name  HB# )    3.4916  0.50748  0.67664
assign (resid   18   and name  HN)  (resid      18   and name  HG1 )    3.16908  0.410724  0.547632
assign (resid   18   and name  HN)  (resid      17   and name  HA )    3.11988  0.395964  0.527952
assign (resid   18   and name  HN)  (resid      16   and name  HA )    3.02922  0.368766  0.491688
assign (resid   18   and name  HN)  (resid      17   and name  HG# )    3.01726  0.365178  0.486904
assign (resid   18   and name  HN)  (resid      19   and name  HN )    2.82799  0.308397  0.211196
assign (resid   18   and name  HN)  (resid      17   and name  HD# )    2.8169  0.30507  0.40676
assign (resid   18   and name  HN)  (resid      18   and name  HA )    2.79044  0.297132  0.396176
assign (resid   18   and name  HN)  (resid      18   and name  HB# )    2.72384  0.277152  0.369536
assign (resid   18   and name  HN)  (resid      16   and name  HB# )    3.77788  0.593364  0.791152
assign (resid   19   and name  HA)  (resid      16   and name  HB# )    3.6379  0.55137  0.73516
assign (resid   19   and name  HN)  (resid      17   and name  HA )    3.6165  0.54495  0.7266
assign (resid   19   and name  HN)  (resid      19   and name  HB2 )    3.60613  0.241839  0.322452
assign (resid   19   and name  HN)  (resid      19   and name  HA )    2.44648  0.193944  0.258592
assign (resid   19   and name  HN)  (resid      19   and name  HB1 )    3.4637  0.39911  0.41548
assign (resid   19   and name  HN)  (resid      18   and name  HA )    3.36571  0.469713  0.626284
assign (resid   19   and name  HN)  (resid      20   and name  HN )    3.23858  0.431574  0.275432
assign (resid   19   and name  HN)  (resid      18   and name  HB2 )    3.17326  0.511978  0.749304
assign (resid   19   and name  HN)  (resid      18   and name  HB1 )    3.14283  0.402849  0.537132
assign (resid   19   and name  HA)  (resid      19   and name  HB2 )    2.81599  0.404797  0.206396
assign (resid   19   and name  HN)  (resid      16   and name  HA )    2.72384  0.277152  0.369536
assign (resid   20   and name  HN)  (resid      20   and name  HB# )    3.6165  0.54495  0.7266
assign (resid   20   and name  HN)  (resid      20   and name  HA )    3.34706  0.464118  0.618824
assign (resid   20   and name  HN)  (resid      19   and name  HA )    3.16908  0.410724  0.227632
assign (resid   20   and name  HN)  (resid      20   and name  HB# )    3.0558  0.37674  0.50232
assign (resid   20   and name  HA)  (resid      20   and name  HB# )    2.68808  0.466424  0.455232
assign (resid   20   and name  HN)  (resid      23   and name  HB1 )    3.70856  0.572568  0.763424
assign (resid   21   and name  HN)  (resid      21   and name  HB2 )    2.51779  0.215337  0.287116
assign (resid   21   and name  HN)  (resid      8   and name  HE# )    3.65456  0.556368  0.741824
assign (resid   21   and name  HN)  (resid      21   and name  HB1 )    2.46749  0.200247  0.266996
assign (resid   21   and name  HN)  (resid      8   and name  HD# )    3.60101  0.540303  0.920404
assign (resid   21   and name  HN)  (resid      20   and name  HB# )    3.27377  0.442131  0.589508
assign (resid   21   and name  HA)  (resid      24   and name  HB# )    3.17116  0.411348  0.548464
assign (resid   21   and name  HN)  (resid      20   and name  HA )    2.10234  0.090702  0.120936
assign (resid   21   and name  HN)  (resid      21   and name  HG# )    3.07389  0.482167  0.709556
assign (resid   21   and name  HN)  (resid      21   and name  HA )    2.7862  0.29586  0.39448
assign (resid   21   and name  HN)  (resid      20   and name  HB# )    2.70349  0.271047  0.361396
assign (resid   22   and name  HN)  (resid      22   and name  HB# )    2.50553  0.211659  0.282212
assign (resid   22   and name  HN)  (resid      21   and name  HA )    3.52991  0.518973  0.691964
assign (resid   22   and name  HN)  (resid      21   and name  HG# )    3.45602  0.496806  0.662408
assign (resid   22   and name  HN)  (resid      21   and name  HB# )    3.29241  0.447723  0.596964
assign (resid   22   and name  HN)  (resid      22   and name  HG# )    3.1293  0.39879  0.53172
assign (resid   22   and name  HN)  (resid      20   and name  HB# )    2.84327  0.312981  0.417308
assign (resid   22   and name  HN)  (resid      22   and name  HB2 )    2.75146  0.285438  0.380584
assign (resid   22   and name  HN)  (resid      20   and name  HA )    3.92473  0.637419  0.849892
assign (resid   22   and name  HN)  (resid      23   and name  HN )    2.6596  0.25788  0.34384
assign (resid   22   and name  HN)  (resid      22   and name  HA )    2.64349  0.253047  0.337396
assign (resid   22   and name  HN)  (resid      21   and name  HN )    2.62413  0.247239  0.329652
assign (resid   22   and name  HN)  (resid      23   and name  HN )    3.75558  0.586674  0.782232
assign (resid   23   and name  HN)  (resid      22   and name  HG# )    3.65456  0.556368  0.741824
assign (resid   23   and name  HN)  (resid      22   and name  HB1 )    3.21729  0.425187  0.566916
assign (resid   23   and name  HN)  (resid      22   and name  HB2 )    3.0558  0.37674  0.50232
assign (resid   23   and name  HN)  (resid      22   and name  HA )    3.04153  0.372459  0.496612
assign (resid   23   and name  HN)  (resid      23   and name  HA )    2.94053  0.342159  0.456212
assign (resid   23   and name  HN)  (resid      21   and name  HA )    4.0055  0.66165  0.8822
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assign (resid   23   and name  HN)  (resid      23   and name  HB1 )    2.65116  0.255348  0.340464
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assign (resid   24   and name  HN)  (resid      21   and name  HA )    3.44099  0.492297  0.656396
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assign (resid   24   and name  HN)  (resid      24   and name  HB1 )    3.2897  0.44691  0.59588
assign (resid   24   and name  HN)  (resid      24   and name  HA )    3.22663  0.427989  0.570652
assign (resid   24   and name  HN)  (resid      23   and name  HB1 )    2.80878  0.302634  0.403512
assign (resid   24   and name  HN)  (resid      25   and name  HN )    2.74992  0.284976  0.379968
assign (resid   24   and name  HN)  (resid      24   and name  HB2 )    2.60151  0.240453  0.320604
assign (resid   24   and name  HN)  (resid      23   and name  HN )    2.60151  0.240453  0.320604
assign (resid   25   and name  HN)  (resid      23   and name  HA )    3.61129  0.543387  0.724516
assign (resid   25   and name  HN)  (resid      22   and name  HA )    3.54792  0.524376  0.699168
assign (resid   25   and name  HN)  (resid      26   and name  HN )    3.5255  0.51765  0.7902
assign (resid   25   and name  HN)  (resid      24   and name  HB2 )    3.31182  0.453546  0.604728
assign (resid   25   and name  HN)  (resid      25   and name  HG# )    3.20363  0.421089  0.561452
assign (resid   25   and name  HN)  (resid      25   and name  HB1 )    3.14677  0.404031  0.538708
assign (resid   25   and name  HN)  (resid      25   and name  HB2 )    2.70281  0.270843  0.361124
assign (resid   25   and name  HN)  (resid      25   and name  HA )    2.68092  0.264276  0.352368
assign (resid   25   and name  HN)  (resid      24   and name  HB1 )    3.70545  0.571635  0.76218
assign (resid   26   and name  HN)  (resid      26   and name  HB2 )    3.19695  0.419085  0.55878
assign (resid   26   and name  HN)  (resid      26   and name  HG# )    3.1293  0.39879  0.53172
assign (resid   26   and name  HN)  (resid      25   and name  HA )    2.90739  0.332217  0.442956
assign (resid   26   and name  HN)  (resid      26   and name  HA )    2.89951  0.329853  0.439804
assign (resid   26   and name  HN)  (resid      26   and name  HB# )    2.86219  0.318657  0.424876
assign (resid   26   and name  HA)  (resid      27   and name  HD# )    2.76804  0.290412  0.387216
assign (resid   5   and name  HA)  (resid      19   and name  HB# )    3.65966  0.243864  1.2158
assign (resid   4   and name  HB1)  (resid      16   and name  HB# )    3.35966  0.243864  0.6158
assign (resid   4   and name  HB2)  (resid      16   and name  HB# )    3.65966  0.243864  1.0158
assign (resid   15   and name  HN)  (resid      12   and name  O  )   2.1 0.2 0.2
assign (resid   16   and name  HN)  (resid      13   and name  O  )   2.1 0.3 0.2
assign (resid   15   and name   N)  (resid      12   and name  O  )   2.8 0.3 0.3
assign (resid   16   and name   N)  (resid      13   and name  O  )   2.8 0.3 0.2
assign (resid   15   and name  HA)  (resid      18   and name  HG# )    3.65966  0.343864  1.0158
assign (resid   6  and name C ) (resid   7 and name N)
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assign (resid   7  and name C ) (resid   8 and name N)
       (resid   8  and name CA) (resid   8 and name C)  9.4415  0.4000
                                  
assign (resid   9  and name C ) (resid  10 and name N)
       (resid  10  and name CA) (resid  10 and name C)  8.2609  0.4000
                                  
assign (resid  10  and name C ) (resid  11 and name N)
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assign (resid  11  and name C ) (resid  12 and name N)
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assign (resid  13  and name C ) (resid  14 and name N)
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assign (resid  14  and name C ) (resid  15 and name N)
       (resid  15  and name CA) (resid  15 and name C)  6.4586  0.4000
                                  
assign (resid  15  and name C ) (resid  16 and name N)
       (resid  16  and name CA) (resid  16 and name C)  7.2735  0.4000
                                  
assign (resid  17  and name C ) (resid  18 and name N)
       (resid  18  and name CA) (resid  18 and name C)  4.0603  0.4000
                                  
assign (resid  18  and name C ) (resid  19 and name N)
       (resid  19  and name CA) (resid  19 and name C)  6.3726  0.4000
                                  
assign (resid  20  and name C ) (resid  21 and name N)
       (resid  21  and name CA) (resid  21 and name C)  2.7067  0.4000
                                  
assign (resid  21  and name C ) (resid  22 and name N)
       (resid  22  and name CA) (resid  22 and name C)  3.8504  0.4000
                                  
assign (resid  22  and name C ) (resid  23 and name N)
       (resid  23  and name CA) (resid  23 and name C)  5.8846  0.4000
                                  
assign (resid  23  and name C ) (resid  24 and name N)
       (resid  24  and name CA) (resid  24 and name C)  4.7294  0.4000

assign ( resid  22  and name C   )
       ( resid  23  and name N   )
       ( resid  23  and name CA  )  
       ( resid  23  and name C   )   1.0  -80.55   30.52     2
assign ( resid  23  and name N   )
       ( resid  23  and name CA  )
       ( resid  23  and name C   )
       ( resid  24  and name N   )   1.0  -50.0   15.91     2

assign ( resid  24  and name C   )
       ( resid  25  and name N   )
       ( resid  25  and name CA  )  
       ( resid  25  and name C   )   1.0  -80.55   30.52     2
assign ( resid  25  and name N   )
       ( resid  25  and name CA  )
       ( resid  25  and name C   )
       ( resid  26  and name N   )   2.0  -50.0   20.91     2


assign ( resid  18  and name C   )
       ( resid  19  and name N   )
       ( resid  19  and name CA  )
       ( resid  19  and name C   )   3.0  50.5    5.52     2
assign ( resid  19  and name N   )
       ( resid  19  and name CA  )
       ( resid  19  and name C   )
       ( resid  20  and name N   )   3.0  40.85    5.91     2
 
assign ( resid  11  and name N   )
       ( resid  11  and name CA  )
       ( resid  11  and name C   )
       ( resid  12  and name N   )   3.0  130.85   15.91     2
assign ( resid  10  and name N   )
       ( resid  10  and name CA  )
       ( resid  10  and name C   )
       ( resid  11  and name N   )   3.0   -5.85   15.91     2
 
assign ( resid  14  and name N   )
       ( resid  14  and name CA  )
       ( resid  14  and name C   )
       ( resid  15  and name N   )   1.0  -20.85   15.91     2


assign ( resid   8  and name N   )
       ( resid   8  and name CA  )
       ( resid   8  and name C   )
       ( resid   9  and name N   )   2.0  150.85   25.91     2


assign ( resid   4  and name C   )
       ( resid   5  and name N   )
       ( resid   5  and name CA  )
       ( resid   5  and name C   )   1.0  -80.55   30.52     2

assign ( resid   5  and name N   )
       ( resid   5  and name CA  )
       ( resid   5  and name C   )
       ( resid   6  and name N   )   2.0  150.85   25.91     2

assign ( resid  14  and name N   )
       ( resid  14  and name CA  )
       ( resid  14  and name C   )
       ( resid  15  and name N   )   1.0  -40.00   15.91     2

assign (resid 24 and name n ) (resid 24 and name ca)
        (resid 24 and name cb) (resid 24 and name sg)   1.0   -60.0    10.0 2
assign (resid 23 and name n ) (resid 23 and name ca)
        (resid 23 and name cb) (resid 23 and name sg)   1.0  -180.0    10.0 2
assign (resid 19 and name n ) (resid 19 and name ca)
        (resid 19 and name cb) (resid 19 and name sg)   1.0   -60.0    10.0 2
assign (resid 15 and name n ) (resid 15 and name ca)
        (resid 15 and name cb) (resid 15 and name sg)   1.0   -60.0    10.0 2
assign (resid 11 and name n ) (resid 11 and name ca)
        (resid 11 and name cb) (resid 11 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)   2.0   -60.0    20.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1H       GLY   1  -4.405 -13.611  -2.042
    2    H2   GLY   1           2H       GLY   1  -3.602 -12.215  -1.528
    3    H3   GLY   1           3H       GLY   1  -3.171 -13.721  -0.891
    4    HA2  GLY   1           1HA      GLY   1  -1.714 -14.074  -2.498
    5    HA3  GLY   1           2HA      GLY   1  -2.977 -13.837  -3.696
    6    H    SER   2           H        SER   2  -3.637 -11.224  -3.422
    7    HA   SER   2           HA       SER   2  -1.163  -9.896  -4.269
    8    HG   SER   2           HG       SER   2  -2.285  -8.804  -6.827
    9    HB2  SER   2           1HB      SER   2  -3.459 -10.041  -5.622
   10    HB3  SER   2           2HB      SER   2  -3.824  -8.611  -4.656
   11    H    SER   3           H        SER   3  -1.089  -7.490  -3.787
   12    HA   SER   3           HA       SER   3  -0.980  -5.765  -2.303
   13    HG   SER   3           HG       SER   3  -3.892  -6.035   0.222
   14    HB2  SER   3           1HB      SER   3  -3.054  -5.235  -1.745
   15    HB3  SER   3           2HB      SER   3  -3.582  -6.906  -1.898
   16    H    SER   4           H        SER   4   0.947  -6.189  -1.441
   17    HA   SER   4           HA       SER   4   1.362  -8.210   0.562
   18    HG   SER   4           HG       SER   4   3.719  -7.610   1.726
   19    HB2  SER   4           1HB      SER   4   3.187  -7.231  -1.030
   20    HB3  SER   4           2HB      SER   4   3.308  -5.953   0.176
   21    H    CYS   5           H        CYS   5   0.130  -5.169   0.700
   22    HA   CYS   5           HA       CYS   5   0.676  -4.917   3.540
   23    HB2  CYS   5           1HB      CYS   5   0.140  -2.848   1.419
   24    HB3  CYS   5           2HB      CYS   5  -0.192  -2.499   3.098
   25    HA   PRO   6           HA       PRO   6  -3.636  -6.105   3.793
   26    HB2  PRO   6           1HB      PRO   6  -3.901  -6.056   6.485
   27    HB3  PRO   6           2HB      PRO   6  -3.035  -7.332   5.622
   28    HG2  PRO   6           1HG      PRO   6  -1.942  -4.915   7.015
   29    HG3  PRO   6           2HG      PRO   6  -1.373  -6.593   7.083
   30    HD2  PRO   6           1HD      PRO   6  -0.180  -4.737   5.527
   31    HD3  PRO   6           2HD      PRO   6  -0.288  -6.439   5.052
   32    H    GLN   7           H        GLN   7  -2.534  -2.995   4.903
   33    HA   GLN   7           HA       GLN   7  -4.988  -2.038   5.902
   34    HB2  GLN   7           1HB      GLN   7  -2.508  -0.626   4.907
   35    HB3  GLN   7           2HB      GLN   7  -3.857   0.160   5.657
   36    HG2  GLN   7           1HG      GLN   7  -1.593  -0.768   6.882
   37    HG3  GLN   7           2HG      GLN   7  -3.062  -0.210   7.669
   38   HE21  GLN   7          1HE2      GLN   7  -0.927  -2.393   8.101
   39   HE22  GLN   7          2HE2      GLN   7  -1.866  -3.777   8.532
   40    H    PHE   8           H        PHE   8  -3.415  -2.141   2.784
   41    HA   PHE   8           HA       PHE   8  -5.811  -0.979   1.557
   42    HD1  PHE   8           HD1      PHE   8  -5.489   1.965   2.256
   43    HD2  PHE   8           HD2      PHE   8  -1.694   0.039   2.542
   44    HE1  PHE   8           HE1      PHE   8  -4.927   3.318   4.189
   45    HE2  PHE   8           HE2      PHE   8  -1.147   1.419   4.474
   46    HZ   PHE   8           HZ       PHE   8  -2.760   3.074   5.313
   47    HB2  PHE   8           1HB      PHE   8  -3.043  -0.294   0.656
   48    HB3  PHE   8           2HB      PHE   8  -4.529   0.607   0.375
   49    HA   PRO   9           HA       PRO   9  -4.773  -4.625  -0.945
   50    HB2  PRO   9           1HB      PRO   9  -7.036  -4.878  -2.356
   51    HB3  PRO   9           2HB      PRO   9  -6.952  -5.288  -0.640
   52    HG2  PRO   9           1HG      PRO   9  -8.067  -2.846  -1.949
   53    HG3  PRO   9           2HG      PRO   9  -8.675  -3.754  -0.558
   54    HD2  PRO   9           1HD      PRO   9  -7.220  -1.410  -0.365
   55    HD3  PRO   9           2HD      PRO   9  -7.374  -2.637   0.910
   56    H    SER  10           H        SER  10  -5.309  -1.534  -2.120
   57    HA   SER  10           HA       SER  10  -4.608  -2.288  -4.863
   58    HG   SER  10           HG       SER  10  -7.675  -0.441  -4.754
   59    HB2  SER  10           1HB      SER  10  -5.616   0.414  -4.001
   60    HB3  SER  10           2HB      SER  10  -5.611  -0.285  -5.620
   61    H    CYS  11           H        CYS  11  -2.797  -1.586  -2.321
   62    HA   CYS  11           HA       CYS  11  -1.397   0.734  -2.969
   63    HB2  CYS  11           1HB      CYS  11  -1.289  -0.547  -0.780
   64    HB3  CYS  11           2HB      CYS  11  -0.235  -1.684  -1.595
   65    H    SER  12           H        SER  12  -0.269   1.142  -4.779
   66    HA   SER  12           HA       SER  12   0.586  -0.716  -6.648
   67    HG   SER  12           HG       SER  12   2.464   0.716  -8.236
   68    HB2  SER  12           1HB      SER  12   0.598   1.478  -7.416
   69    HB3  SER  12           2HB      SER  12   1.436   2.085  -6.002
   70    HA   PRO  13           HA       PRO  13   3.955  -2.828  -4.771
   71    HB2  PRO  13           1HB      PRO  13   5.774  -2.625  -6.963
   72    HB3  PRO  13           2HB      PRO  13   4.736  -4.005  -6.593
   73    HG2  PRO  13           1HG      PRO  13   4.356  -1.829  -8.557
   74    HG3  PRO  13           2HG      PRO  13   3.739  -3.489  -8.572
   75    HD2  PRO  13           1HD      PRO  13   2.165  -1.363  -8.082
   76    HD3  PRO  13           2HD      PRO  13   1.879  -2.943  -7.324
   77    H    SER  14           H        SER  14   4.326   0.224  -6.476
   78    HA   SER  14           HA       SER  14   6.884   0.880  -5.399
   79    HG   SER  14           HG       SER  14   4.713   4.007  -6.589
   80    HB2  SER  14           1HB      SER  14   6.609   2.996  -6.388
   81    HB3  SER  14           2HB      SER  14   5.696   1.909  -7.435
   82    H    CYS  15           H        CYS  15   3.608   1.508  -4.312
   83    HA   CYS  15           HA       CYS  15   4.561   3.090  -2.089
   84    HB2  CYS  15           1HB      CYS  15   1.768   2.225  -2.853
   85    HB3  CYS  15           2HB      CYS  15   2.157   3.273  -1.492
   86    H    ALA  16           H        ALA  16   4.800  -0.057  -2.583
   87    HA   ALA  16           HA       ALA  16   4.072  -0.688   0.205
   88    HB1  ALA  16           3HB      ALA  16   4.221  -2.994  -1.568
   89    HB2  ALA  16           1HB      ALA  16   2.946  -1.844  -1.987
   90    HB3  ALA  16           2HB      ALA  16   3.001  -2.547  -0.374
   91    HA   PRO  17           HA       PRO  17   4.326  -2.632   1.341
   92    HB2  PRO  17           1HB      PRO  17   5.587  -3.851   3.286
   93    HB3  PRO  17           2HB      PRO  17   5.660  -4.537   1.655
   94    HG2  PRO  17           1HG      PRO  17   7.690  -2.848   3.084
   95    HG3  PRO  17           2HG      PRO  17   7.943  -4.348   2.169
   96    HD2  PRO  17           1HD      PRO  17   8.300  -1.797   1.153
   97    HD3  PRO  17           2HD      PRO  17   7.996  -3.242   0.171
   98    H    GLN  18           H        GLN  18   5.983   0.067   1.675
   99    HA   GLN  18           HA       GLN  18   6.332   0.725   4.314
  100    HB2  GLN  18           1HB      GLN  18   6.114   2.967   3.755
  101    HB3  GLN  18           2HB      GLN  18   6.591   2.241   2.244
  102    HG2  GLN  18           1HG      GLN  18   4.418   2.472   1.343
  103    HG3  GLN  18           2HG      GLN  18   3.734   2.825   2.925
  104   HE21  GLN  18          1HE2      GLN  18   5.241   4.725   3.958
  105   HE22  GLN  18          2HE2      GLN  18   5.279   6.132   2.956
  106    H    CYS  19           H        CYS  19   3.423   0.119   2.643
  107    HA   CYS  19           HA       CYS  19   1.254  -0.117   3.216
  108    HB2  CYS  19           1HB      CYS  19   2.447  -0.477   5.961
  109    HB3  CYS  19           2HB      CYS  19   0.798  -0.856   5.517
  110    H    SER  20           H        SER  20   1.815   2.582   2.939
  111    HA   SER  20           HA       SER  20   0.252   3.737   5.161
  112    HG   SER  20           HG       SER  20   1.969   5.295   2.486
  113    HB2  SER  20           1HB      SER  20   1.342   5.908   4.671
  114    HB3  SER  20           2HB      SER  20   2.495   4.688   5.208
  115    H    GLN  21           H        GLN  21  -1.631   4.656   4.648
  116    HA   GLN  21           HA       GLN  21  -2.864   4.387   2.213
  117    HB2  GLN  21           1HB      GLN  21  -3.971   4.892   4.419
  118    HB3  GLN  21           2HB      GLN  21  -3.501   6.571   4.205
  119    HG2  GLN  21           1HG      GLN  21  -4.851   5.357   1.938
  120    HG3  GLN  21           2HG      GLN  21  -5.841   5.532   3.370
  121   HE21  GLN  21          1HE2      GLN  21  -6.754   7.436   3.742
  122   HE22  GLN  21          2HE2      GLN  21  -6.360   8.914   2.939
  123    H    GLN  22           H        GLN  22  -0.861   6.998   3.353
  124    HA   GLN  22           HA       GLN  22  -1.559   9.015   1.622
  125    HB2  GLN  22           1HB      GLN  22   1.039   8.367   2.966
  126    HB3  GLN  22           2HB      GLN  22   0.981   9.649   1.768
  127    HG2  GLN  22           1HG      GLN  22  -1.173   9.840   3.702
  128    HG3  GLN  22           2HG      GLN  22   0.425   9.891   4.446
  129   HE21  GLN  22          1HE2      GLN  22  -1.954  11.744   3.210
  130   HE22  GLN  22          2HE2      GLN  22  -1.044  13.139   2.748
  131    H    CYS  23           H        CYS  23   1.050   6.634   0.981
  132    HA   CYS  23           HA       CYS  23   1.269   7.574  -1.721
  133    HB2  CYS  23           1HB      CYS  23   3.209   6.704  -0.389
  134    HB3  CYS  23           2HB      CYS  23   2.517   5.094  -0.525
  135    H    CYS  24           H        CYS  24   0.088   4.589  -0.183
  136    HA   CYS  24           HA       CYS  24  -0.571   3.288  -2.590
  137    HB2  CYS  24           1HB      CYS  24  -1.960   2.857   0.061
  138    HB3  CYS  24           2HB      CYS  24  -1.802   1.734  -1.272
  139    H    GLN  25           H        GLN  25  -2.417   5.515  -0.569
  140    HA   GLN  25           HA       GLN  25  -4.712   5.175  -2.327
  141    HB2  GLN  25           1HB      GLN  25  -4.508   5.420   0.430
  142    HB3  GLN  25           2HB      GLN  25  -5.180   6.952  -0.118
  143    HG2  GLN  25           1HG      GLN  25  -6.332   4.520  -1.280
  144    HG3  GLN  25           2HG      GLN  25  -6.623   4.778   0.437
  145   HE21  GLN  25          1HE2      GLN  25  -8.264   4.965  -2.151
  146   HE22  GLN  25          2HE2      GLN  25  -9.101   6.468  -1.988
  147    H    GLN  26           H        GLN  26  -3.574   8.039  -0.649
  148    HA   GLN  26           HA       GLN  26  -3.148   9.497  -3.061
  149    HB2  GLN  26           1HB      GLN  26  -5.703   9.758  -1.551
  150    HB3  GLN  26           2HB      GLN  26  -4.988  11.226  -2.196
  151    HG2  GLN  26           1HG      GLN  26  -4.879   9.954  -4.420
  152    HG3  GLN  26           2HG      GLN  26  -6.008   8.830  -3.664
  153   HE21  GLN  26          1HE2      GLN  26  -5.655  12.365  -3.695
  154   HE22  GLN  26          2HE2      GLN  26  -7.281  12.692  -4.178
  155    HA   PRO  27           HA       PRO  27  -0.729  12.121  -0.443
  156    HB2  PRO  27           1HB      PRO  27  -1.392  14.677  -1.143
  157    HB3  PRO  27           2HB      PRO  27  -0.363  13.630  -2.129
  158    HG2  PRO  27           1HG      PRO  27  -3.287  14.215  -2.407
  159    HG3  PRO  27           2HG      PRO  27  -2.038  14.129  -3.664
  160    HD2  PRO  27           1HD      PRO  27  -3.735  12.101  -3.228
  161    HD3  PRO  27           2HD      PRO  27  -2.043  11.816  -3.688
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1   2.903 -12.595  -5.455
    2    H2   GLY   1           2H       GLY   1   1.553 -12.063  -6.325
    3    H3   GLY   1           3H       GLY   1   1.347 -12.833  -4.834
    4    HA2  GLY   1           1HA      GLY   1   2.249 -11.028  -3.639
    5    HA3  GLY   1           2HA      GLY   1   2.823 -10.283  -5.122
    6    H    SER   2           H        SER   2  -0.165 -11.316  -3.501
    7    HA   SER   2           HA       SER   2  -1.645  -9.269  -4.983
    8    HG   SER   2           HG       SER   2  -1.737 -12.584  -4.045
    9    HB2  SER   2           1HB      SER   2  -3.561 -10.488  -3.538
   10    HB3  SER   2           2HB      SER   2  -3.000 -11.104  -5.092
   11    H    SER   3           H        SER   3  -0.709  -7.489  -3.830
   12    HA   SER   3           HA       SER   3  -0.798  -5.813  -2.288
   13    HG   SER   3           HG       SER   3  -3.078  -7.517   0.058
   14    HB2  SER   3           1HB      SER   3  -2.933  -5.449  -1.834
   15    HB3  SER   3           2HB      SER   3  -3.330  -7.146  -2.071
   16    H    SER   4           H        SER   4   1.115  -6.158  -1.352
   17    HA   SER   4           HA       SER   4   1.504  -8.180   0.667
   18    HG   SER   4           HG       SER   4   4.690  -8.142   0.422
   19    HB2  SER   4           1HB      SER   4   3.357  -7.177  -0.885
   20    HB3  SER   4           2HB      SER   4   3.436  -5.909   0.334
   21    H    CYS   5           H        CYS   5   0.233  -5.146   0.750
   22    HA   CYS   5           HA       CYS   5   0.701  -4.880   3.602
   23    HB2  CYS   5           1HB      CYS   5   0.217  -2.823   1.459
   24    HB3  CYS   5           2HB      CYS   5  -0.160  -2.467   3.126
   25    HA   PRO   6           HA       PRO   6  -3.622  -6.067   3.735
   26    HB2  PRO   6           1HB      PRO   6  -3.945  -6.084   6.413
   27    HB3  PRO   6           2HB      PRO   6  -3.037  -7.330   5.549
   28    HG2  PRO   6           1HG      PRO   6  -2.015  -4.918   7.006
   29    HG3  PRO   6           2HG      PRO   6  -1.432  -6.590   7.079
   30    HD2  PRO   6           1HD      PRO   6  -0.209  -4.714   5.572
   31    HD3  PRO   6           2HD      PRO   6  -0.293  -6.413   5.079
   32    H    GLN   7           H        GLN   7  -2.534  -2.978   4.882
   33    HA   GLN   7           HA       GLN   7  -4.986  -2.026   5.896
   34    HB2  GLN   7           1HB      GLN   7  -2.507  -0.609   4.904
   35    HB3  GLN   7           2HB      GLN   7  -3.852   0.172   5.668
   36    HG2  GLN   7           1HG      GLN   7  -1.585  -0.769   6.876
   37    HG3  GLN   7           2HG      GLN   7  -3.052  -0.222   7.676
   38   HE21  GLN   7          1HE2      GLN   7  -0.917  -2.392   8.099
   39   HE22  GLN   7          2HE2      GLN   7  -1.848  -3.787   8.511
   40    H    PHE   8           H        PHE   8  -3.430  -2.124   2.773
   41    HA   PHE   8           HA       PHE   8  -5.820  -0.933   1.561
   42    HD1  PHE   8           HD2      PHE   8  -5.455   2.040   2.209
   43    HD2  PHE   8           HD1      PHE   8  -1.707   0.031   2.545
   44    HE1  PHE   8           HE2      PHE   8  -4.880   3.388   4.138
   45    HE2  PHE   8           HE1      PHE   8  -1.150   1.413   4.473
   46    HZ   PHE   8           HZ       PHE   8  -2.731   3.108   5.284
   47    HB2  PHE   8           1HB      PHE   8  -3.048  -0.282   0.646
   48    HB3  PHE   8           2HB      PHE   8  -4.525   0.631   0.358
   49    HA   PRO   9           HA       PRO   9  -4.843  -4.609  -0.924
   50    HB2  PRO   9           1HB      PRO   9  -7.112  -4.839  -2.327
   51    HB3  PRO   9           2HB      PRO   9  -7.029  -5.238  -0.609
   52    HG2  PRO   9           1HG      PRO   9  -8.112  -2.787  -1.931
   53    HG3  PRO   9           2HG      PRO   9  -8.730  -3.677  -0.534
   54    HD2  PRO   9           1HD      PRO   9  -7.240  -1.354  -0.357
   55    HD3  PRO   9           2HD      PRO   9  -7.407  -2.572   0.925
   56    H    SER  10           H        SER  10  -5.332  -1.520  -2.117
   57    HA   SER  10           HA       SER  10  -4.637  -2.310  -4.856
   58    HG   SER  10           HG       SER  10  -5.469  -1.030  -6.457
   59    HB2  SER  10           1HB      SER  10  -6.725  -0.924  -4.415
   60    HB3  SER  10           2HB      SER  10  -5.637   0.410  -4.029
   61    H    CYS  11           H        CYS  11  -2.824  -1.595  -2.320
   62    HA   CYS  11           HA       CYS  11  -1.409   0.711  -2.988
   63    HB2  CYS  11           1HB      CYS  11  -1.303  -0.562  -0.790
   64    HB3  CYS  11           2HB      CYS  11  -0.255  -1.704  -1.601
   65    H    SER  12           H        SER  12  -0.286   1.100  -4.805
   66    HA   SER  12           HA       SER  12   0.558  -0.785  -6.654
   67    HG   SER  12           HG       SER  12   2.425   1.206  -8.376
   68    HB2  SER  12           1HB      SER  12   0.565   1.394  -7.456
   69    HB3  SER  12           2HB      SER  12   1.402   2.026  -6.055
   70    HA   PRO  13           HA       PRO  13   3.933  -2.865  -4.748
   71    HB2  PRO  13           1HB      PRO  13   5.751  -2.689  -6.945
   72    HB3  PRO  13           2HB      PRO  13   4.717  -4.066  -6.553
   73    HG2  PRO  13           1HG      PRO  13   4.329  -1.923  -8.550
   74    HG3  PRO  13           2HG      PRO  13   3.716  -3.584  -8.539
   75    HD2  PRO  13           1HD      PRO  13   2.136  -1.456  -8.080
   76    HD3  PRO  13           2HD      PRO  13   1.856  -3.025  -7.296
   77    H    SER  14           H        SER  14   4.297   0.162  -6.501
   78    HA   SER  14           HA       SER  14   6.844   0.835  -5.413
   79    HG   SER  14           HG       SER  14   6.465   1.827  -8.278
   80    HB2  SER  14           1HB      SER  14   4.807   2.192  -7.045
   81    HB3  SER  14           2HB      SER  14   5.798   3.256  -6.047
   82    H    CYS  15           H        CYS  15   3.559   1.462  -4.347
   83    HA   CYS  15           HA       CYS  15   4.509   3.098  -2.160
   84    HB2  CYS  15           1HB      CYS  15   1.720   2.210  -2.914
   85    HB3  CYS  15           2HB      CYS  15   2.099   3.258  -1.550
   86    H    ALA  16           H        ALA  16   4.732  -0.066  -2.610
   87    HA   ALA  16           HA       ALA  16   4.035  -0.645   0.195
   88    HB1  ALA  16           3HB      ALA  16   4.206  -2.985  -1.530
   89    HB2  ALA  16           1HB      ALA  16   2.916  -1.862  -1.970
   90    HB3  ALA  16           2HB      ALA  16   2.985  -2.529  -0.341
   91    HA   PRO  17           HA       PRO  17   4.328  -2.573   1.362
   92    HB2  PRO  17           1HB      PRO  17   5.618  -3.732   3.324
   93    HB3  PRO  17           2HB      PRO  17   5.698  -4.445   1.705
   94    HG2  PRO  17           1HG      PRO  17   7.700  -2.694   3.098
   95    HG3  PRO  17           2HG      PRO  17   7.978  -4.204   2.206
   96    HD2  PRO  17           1HD      PRO  17   8.282  -1.663   1.146
   97    HD3  PRO  17           2HD      PRO  17   8.002  -3.131   0.190
   98    H    GLN  18           H        GLN  18   5.932   0.170   1.652
   99    HA   GLN  18           HA       GLN  18   6.280   0.880   4.275
  100    HB2  GLN  18           1HB      GLN  18   5.988   3.105   3.691
  101    HB3  GLN  18           2HB      GLN  18   6.453   2.379   2.177
  102    HG2  GLN  18           1HG      GLN  18   4.314   2.600   1.284
  103    HG3  GLN  18           2HG      GLN  18   3.577   2.795   2.871
  104   HE21  GLN  18          1HE2      GLN  18   2.600   4.629   1.639
  105   HE22  GLN  18          2HE2      GLN  18   3.440   6.138   1.675
  106    H    CYS  19           H        CYS  19   3.368   0.159   2.653
  107    HA   CYS  19           HA       CYS  19   1.212  -0.114   3.264
  108    HB2  CYS  19           1HB      CYS  19   2.479  -0.385   5.989
  109    HB3  CYS  19           2HB      CYS  19   0.815  -0.777   5.614
  110    H    SER  20           H        SER  20   1.739   2.572   2.896
  111    HA   SER  20           HA       SER  20   0.196   3.785   5.104
  112    HG   SER  20           HG       SER  20   3.132   3.922   5.231
  113    HB2  SER  20           1HB      SER  20   1.746   5.689   3.495
  114    HB3  SER  20           2HB      SER  20   1.574   5.561   5.245
  115    H    GLN  21           H        GLN  21  -1.665   4.721   4.606
  116    HA   GLN  21           HA       GLN  21  -2.947   4.426   2.197
  117    HB2  GLN  21           1HB      GLN  21  -4.016   4.955   4.412
  118    HB3  GLN  21           2HB      GLN  21  -3.521   6.624   4.197
  119    HG2  GLN  21           1HG      GLN  21  -4.911   5.519   1.915
  120    HG3  GLN  21           2HG      GLN  21  -5.887   5.556   3.369
  121   HE21  GLN  21          1HE2      GLN  21  -4.116   7.499   1.075
  122   HE22  GLN  21          2HE2      GLN  21  -4.842   9.007   1.494
  123    H    GLN  22           H        GLN  22  -0.911   7.048   3.281
  124    HA   GLN  22           HA       GLN  22  -1.633   9.031   1.516
  125    HB2  GLN  22           1HB      GLN  22   0.985   8.425   2.852
  126    HB3  GLN  22           2HB      GLN  22   0.882   9.712   1.662
  127    HG2  GLN  22           1HG      GLN  22  -1.291  10.100   3.374
  128    HG3  GLN  22           2HG      GLN  22   0.075   9.698   4.412
  129   HE21  GLN  22          1HE2      GLN  22  -1.381  12.227   4.014
  130   HE22  GLN  22          2HE2      GLN  22  -0.179  13.389   3.577
  131    H    CYS  23           H        CYS  23   0.990   6.652   0.912
  132    HA   CYS  23           HA       CYS  23   1.208   7.561  -1.799
  133    HB2  CYS  23           1HB      CYS  23   3.153   6.720  -0.457
  134    HB3  CYS  23           2HB      CYS  23   2.471   5.103  -0.569
  135    H    CYS  24           H        CYS  24   0.051   4.575  -0.239
  136    HA   CYS  24           HA       CYS  24  -0.587   3.254  -2.637
  137    HB2  CYS  24           1HB      CYS  24  -1.986   2.834   0.007
  138    HB3  CYS  24           2HB      CYS  24  -1.815   1.703  -1.317
  139    H    GLN  25           H        GLN  25  -2.477   5.481  -0.651
  140    HA   GLN  25           HA       GLN  25  -4.741   5.099  -2.443
  141    HB2  GLN  25           1HB      GLN  25  -4.577   5.385   0.325
  142    HB3  GLN  25           2HB      GLN  25  -5.296   6.877  -0.269
  143    HG2  GLN  25           1HG      GLN  25  -6.636   4.978  -1.680
  144    HG3  GLN  25           2HG      GLN  25  -6.361   4.183  -0.134
  145   HE21  GLN  25          1HE2      GLN  25  -7.722   4.610   1.465
  146   HE22  GLN  25          2HE2      GLN  25  -8.851   5.917   1.508
  147    H    GLN  26           H        GLN  26  -3.664   7.987  -0.765
  148    HA   GLN  26           HA       GLN  26  -3.307   9.409  -3.215
  149    HB2  GLN  26           1HB      GLN  26  -5.422  10.112  -3.351
  150    HB3  GLN  26           2HB      GLN  26  -5.813   9.466  -1.774
  151    HG2  GLN  26           1HG      GLN  26  -5.287  11.467  -0.689
  152    HG3  GLN  26           2HG      GLN  26  -4.403  12.093  -2.077
  153   HE21  GLN  26          1HE2      GLN  26  -5.474  13.174  -3.648
  154   HE22  GLN  26          2HE2      GLN  26  -7.166  13.520  -3.602
  155    HA   PRO  27           HA       PRO  27  -0.485  11.712  -0.662
  156    HB2  PRO  27           1HB      PRO  27  -0.609  14.235  -1.683
  157    HB3  PRO  27           2HB      PRO  27   0.232  12.904  -2.486
  158    HG2  PRO  27           1HG      PRO  27  -2.513  13.989  -2.995
  159    HG3  PRO  27           2HG      PRO  27  -1.255  13.538  -4.162
  160    HD2  PRO  27           1HD      PRO  27  -3.321  11.920  -3.622
  161    HD3  PRO  27           2HD      PRO  27  -1.695  11.281  -3.958
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1   0.878 -14.342  -4.554
    2    H2   GLY   1           2H       GLY   1   1.294 -13.813  -6.105
    3    H3   GLY   1           3H       GLY   1  -0.267 -13.543  -5.511
    4    HA2  GLY   1           1HA      GLY   1   1.198 -12.352  -3.614
    5    HA3  GLY   1           2HA      GLY   1   2.180 -12.067  -5.043
    6    H    SER   2           H        SER   2  -0.453 -11.016  -3.229
    7    HA   SER   2           HA       SER   2  -1.007  -8.931  -5.178
    8    HG   SER   2           HG       SER   2  -3.237  -8.346  -5.641
    9    HB2  SER   2           1HB      SER   2  -2.661 -11.083  -5.216
   10    HB3  SER   2           2HB      SER   2  -3.464 -10.086  -4.004
   11    H    SER   3           H        SER   3  -0.552  -7.194  -3.990
   12    HA   SER   3           HA       SER   3  -0.677  -5.604  -2.361
   13    HG   SER   3           HG       SER   3  -2.925  -7.436  -0.153
   14    HB2  SER   3           1HB      SER   3  -2.822  -5.258  -1.940
   15    HB3  SER   3           2HB      SER   3  -3.216  -6.938  -2.279
   16    H    SER   4           H        SER   4   1.213  -6.006  -1.400
   17    HA   SER   4           HA       SER   4   1.529  -8.127   0.543
   18    HG   SER   4           HG       SER   4   3.770  -7.718   1.790
   19    HB2  SER   4           1HB      SER   4   3.423  -7.088  -0.948
   20    HB3  SER   4           2HB      SER   4   3.517  -5.894   0.343
   21    H    CYS   5           H        CYS   5   0.285  -5.095   0.720
   22    HA   CYS   5           HA       CYS   5   0.755  -4.907   3.577
   23    HB2  CYS   5           1HB      CYS   5   0.271  -2.794   1.489
   24    HB3  CYS   5           2HB      CYS   5  -0.103  -2.480   3.166
   25    HA   PRO   6           HA       PRO   6  -3.562  -6.104   3.693
   26    HB2  PRO   6           1HB      PRO   6  -3.880  -6.178   6.372
   27    HB3  PRO   6           2HB      PRO   6  -2.972  -7.405   5.480
   28    HG2  PRO   6           1HG      PRO   6  -1.952  -5.021   6.984
   29    HG3  PRO   6           2HG      PRO   6  -1.364  -6.693   7.022
   30    HD2  PRO   6           1HD      PRO   6  -0.148  -4.786   5.550
   31    HD3  PRO   6           2HD      PRO   6  -0.233  -6.474   5.020
   32    H    GLN   7           H        GLN   7  -2.480  -3.036   4.893
   33    HA   GLN   7           HA       GLN   7  -4.922  -2.106   5.941
   34    HB2  GLN   7           1HB      GLN   7  -2.467  -0.664   4.925
   35    HB3  GLN   7           2HB      GLN   7  -3.803   0.100   5.722
   36    HG2  GLN   7           1HG      GLN   7  -1.511  -0.825   6.882
   37    HG3  GLN   7           2HG      GLN   7  -2.975  -0.322   7.715
   38   HE21  GLN   7          1HE2      GLN   7  -0.788  -2.462   8.048
   39   HE22  GLN   7          2HE2      GLN   7  -1.684  -3.881   8.453
   40    H    PHE   8           H        PHE   8  -3.407  -2.176   2.801
   41    HA   PHE   8           HA       PHE   8  -5.817  -0.996   1.619
   42    HD1  PHE   8           HD2      PHE   8  -5.474   1.972   2.275
   43    HD2  PHE   8           HD1      PHE   8  -1.704   0.002   2.571
   44    HE1  PHE   8           HE2      PHE   8  -4.891   3.334   4.195
   45    HE2  PHE   8           HE1      PHE   8  -1.138   1.390   4.494
   46    HZ   PHE   8           HZ       PHE   8  -2.727   3.072   5.319
   47    HB2  PHE   8           1HB      PHE   8  -3.061  -0.315   0.679
   48    HB3  PHE   8           2HB      PHE   8  -4.550   0.585   0.412
   49    HA   PRO   9           HA       PRO   9  -4.831  -4.651  -0.889
   50    HB2  PRO   9           1HB      PRO   9  -7.109  -4.895  -2.275
   51    HB3  PRO   9           2HB      PRO   9  -7.008  -5.301  -0.560
   52    HG2  PRO   9           1HG      PRO   9  -8.123  -2.854  -1.862
   53    HG3  PRO   9           2HG      PRO   9  -8.722  -3.755  -0.462
   54    HD2  PRO   9           1HD      PRO   9  -7.251  -1.420  -0.290
   55    HD3  PRO   9           2HD      PRO   9  -7.396  -2.645   0.989
   56    H    SER  10           H        SER  10  -5.358  -1.563  -2.070
   57    HA   SER  10           HA       SER  10  -4.681  -2.341  -4.817
   58    HG   SER  10           HG       SER  10  -5.389   0.649  -6.033
   59    HB2  SER  10           1HB      SER  10  -6.775  -0.969  -4.350
   60    HB3  SER  10           2HB      SER  10  -5.690   0.372  -3.979
   61    H    CYS  11           H        CYS  11  -2.850  -1.619  -2.298
   62    HA   CYS  11           HA       CYS  11  -1.456   0.698  -2.976
   63    HB2  CYS  11           1HB      CYS  11  -1.331  -0.569  -0.778
   64    HB3  CYS  11           2HB      CYS  11  -0.280  -1.708  -1.592
   65    H    SER  12           H        SER  12  -0.344   1.089  -4.799
   66    HA   SER  12           HA       SER  12   0.504  -0.793  -6.651
   67    HG   SER  12           HG       SER  12   2.520   1.706  -8.172
   68    HB2  SER  12           1HB      SER  12   0.500   1.391  -7.451
   69    HB3  SER  12           2HB      SER  12   1.342   2.022  -6.052
   70    HA   PRO  13           HA       PRO  13   3.894  -2.856  -4.750
   71    HB2  PRO  13           1HB      PRO  13   5.704  -2.679  -6.954
   72    HB3  PRO  13           2HB      PRO  13   4.676  -4.058  -6.556
   73    HG2  PRO  13           1HG      PRO  13   4.275  -1.920  -8.555
   74    HG3  PRO  13           2HG      PRO  13   3.669  -3.582  -8.540
   75    HD2  PRO  13           1HD      PRO  13   2.081  -1.460  -8.079
   76    HD3  PRO  13           2HD      PRO  13   1.810  -3.029  -7.291
   77    H    SER  14           H        SER  14   4.237   0.170  -6.508
   78    HA   SER  14           HA       SER  14   6.788   0.857  -5.438
   79    HG   SER  14           HG       SER  14   6.824   1.275  -7.738
   80    HB2  SER  14           1HB      SER  14   4.732   2.200  -7.056
   81    HB3  SER  14           2HB      SER  14   5.721   3.271  -6.063
   82    H    CYS  15           H        CYS  15   3.506   1.462  -4.346
   83    HA   CYS  15           HA       CYS  15   4.467   3.102  -2.166
   84    HB2  CYS  15           1HB      CYS  15   1.676   2.218  -2.919
   85    HB3  CYS  15           2HB      CYS  15   2.052   3.238  -1.534
   86    H    ALA  16           H        ALA  16   4.713  -0.052  -2.613
   87    HA   ALA  16           HA       ALA  16   4.032  -0.637   0.194
   88    HB1  ALA  16           3HB      ALA  16   4.187  -2.979  -1.529
   89    HB2  ALA  16           1HB      ALA  16   2.898  -1.854  -1.965
   90    HB3  ALA  16           2HB      ALA  16   2.971  -2.516  -0.336
   91    HA   PRO  17           HA       PRO  17   4.334  -2.576   1.351
   92    HB2  PRO  17           1HB      PRO  17   5.640  -3.736   3.302
   93    HB3  PRO  17           2HB      PRO  17   5.706  -4.446   1.680
   94    HG2  PRO  17           1HG      PRO  17   7.720  -2.699   3.060
   95    HG3  PRO  17           2HG      PRO  17   7.991  -4.206   2.162
   96    HD2  PRO  17           1HD      PRO  17   8.286  -1.663   1.107
   97    HD3  PRO  17           2HD      PRO  17   7.996  -3.128   0.149
   98    H    GLN  18           H        GLN  18   5.941   0.168   1.639
   99    HA   GLN  18           HA       GLN  18   6.311   0.882   4.253
  100    HB2  GLN  18           1HB      GLN  18   5.990   3.108   3.675
  101    HB3  GLN  18           2HB      GLN  18   6.449   2.382   2.159
  102    HG2  GLN  18           1HG      GLN  18   4.293   2.570   1.286
  103    HG3  GLN  18           2HG      GLN  18   3.578   2.786   2.878
  104   HE21  GLN  18          1HE2      GLN  18   6.429   4.385   1.578
  105   HE22  GLN  18          2HE2      GLN  18   5.768   5.981   1.602
  106    H    CYS  19           H        CYS  19   3.379   0.144   2.674
  107    HA   CYS  19           HA       CYS  19   1.235  -0.148   3.317
  108    HB2  CYS  19           1HB      CYS  19   2.557  -0.413   6.017
  109    HB3  CYS  19           2HB      CYS  19   0.885  -0.801   5.684
  110    H    SER  20           H        SER  20   1.737   2.546   2.947
  111    HA   SER  20           HA       SER  20   0.187   3.732   5.163
  112    HG   SER  20           HG       SER  20   3.015   3.633   5.150
  113    HB2  SER  20           1HB      SER  20   1.773   5.649   3.597
  114    HB3  SER  20           2HB      SER  20   1.552   5.519   5.342
  115    H    GLN  21           H        GLN  21  -1.665   4.675   4.657
  116    HA   GLN  21           HA       GLN  21  -2.914   4.409   2.229
  117    HB2  GLN  21           1HB      GLN  21  -4.002   4.919   4.446
  118    HB3  GLN  21           2HB      GLN  21  -3.538   6.595   4.229
  119    HG2  GLN  21           1HG      GLN  21  -4.897   5.394   1.964
  120    HG3  GLN  21           2HG      GLN  21  -5.878   5.514   3.404
  121   HE21  GLN  21          1HE2      GLN  21  -3.471   7.941   3.135
  122   HE22  GLN  21          2HE2      GLN  21  -4.502   9.209   2.593
  123    H    GLN  22           H        GLN  22  -0.912   7.032   3.367
  124    HA   GLN  22           HA       GLN  22  -1.603   9.034   1.621
  125    HB2  GLN  22           1HB      GLN  22   1.003   8.387   2.954
  126    HB3  GLN  22           2HB      GLN  22   0.933   9.673   1.759
  127    HG2  GLN  22           1HG      GLN  22  -1.226   9.917   3.643
  128    HG3  GLN  22           2HG      GLN  22   0.329   9.840   4.469
  129   HE21  GLN  22          1HE2      GLN  22  -1.375  12.091   4.394
  130   HE22  GLN  22          2HE2      GLN  22  -0.544  13.359   3.566
  131    H    CYS  23           H        CYS  23   0.988   6.631   0.990
  132    HA   CYS  23           HA       CYS  23   1.205   7.557  -1.717
  133    HB2  CYS  23           1HB      CYS  23   3.152   6.697  -0.390
  134    HB3  CYS  23           2HB      CYS  23   2.460   5.084  -0.511
  135    H    CYS  24           H        CYS  24   0.045   4.554  -0.175
  136    HA   CYS  24           HA       CYS  24  -0.627   3.272  -2.587
  137    HB2  CYS  24           1HB      CYS  24  -2.015   2.822   0.062
  138    HB3  CYS  24           2HB      CYS  24  -1.854   1.708  -1.278
  139    H    GLN  25           H        GLN  25  -2.459   5.476  -0.537
  140    HA   GLN  25           HA       GLN  25  -4.779   5.168  -2.255
  141    HB2  GLN  25           1HB      GLN  25  -4.541   5.509   0.476
  142    HB3  GLN  25           2HB      GLN  25  -5.105   7.073  -0.107
  143    HG2  GLN  25           1HG      GLN  25  -6.441   4.691  -1.177
  144    HG3  GLN  25           2HG      GLN  25  -6.703   5.045   0.528
  145   HE21  GLN  25          1HE2      GLN  25  -7.745   6.971   1.108
  146   HE22  GLN  25          2HE2      GLN  25  -8.694   7.869  -0.022
  147    H    GLN  26           H        GLN  26  -3.477   8.046  -0.742
  148    HA   GLN  26           HA       GLN  26  -3.036  10.199  -1.603
  149    HB2  GLN  26           1HB      GLN  26  -2.474   8.365  -3.777
  150    HB3  GLN  26           2HB      GLN  26  -3.153   9.863  -4.394
  151    HG2  GLN  26           1HG      GLN  26  -1.429  11.087  -3.049
  152    HG3  GLN  26           2HG      GLN  26  -0.692   9.523  -2.704
  153   HE21  GLN  26          1HE2      GLN  26   0.640  11.595  -4.007
  154   HE22  GLN  26          2HE2      GLN  26   0.967  11.107  -5.632
  155    HA   PRO  27           HA       PRO  27  -6.931  11.924  -2.774
  156    HB2  PRO  27           1HB      PRO  27  -6.429  13.847  -4.609
  157    HB3  PRO  27           2HB      PRO  27  -5.961  14.008  -2.913
  158    HG2  PRO  27           1HG      PRO  27  -4.297  13.200  -5.268
  159    HG3  PRO  27           2HG      PRO  27  -3.897  14.313  -3.946
  160    HD2  PRO  27           1HD      PRO  27  -3.024  11.754  -4.016
  161    HD3  PRO  27           2HD      PRO  27  -3.373  12.606  -2.498
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1   0.512 -12.045  -1.200
    2    H2   GLY   1           2H       GLY   1   1.102 -13.622  -1.351
    3    H3   GLY   1           3H       GLY   1  -0.553 -13.320  -1.519
    4    HA2  GLY   1           1HA      GLY   1   1.642 -12.711  -3.387
    5    HA3  GLY   1           2HA      GLY   1   0.139 -13.564  -3.701
    6    H    SER   2           H        SER   2  -1.699 -11.810  -2.594
    7    HA   SER   2           HA       SER   2  -1.459  -9.537  -4.442
    8    HG   SER   2           HG       SER   2  -3.068 -12.111  -4.709
    9    HB2  SER   2           1HB      SER   2  -3.951 -10.695  -3.171
   10    HB3  SER   2           2HB      SER   2  -3.898  -9.417  -4.384
   11    H    SER   3           H        SER   3  -0.983  -7.639  -3.571
   12    HA   SER   3           HA       SER   3  -0.907  -5.860  -2.149
   13    HG   SER   3           HG       SER   3  -3.066  -7.309   0.472
   14    HB2  SER   3           1HB      SER   3  -2.988  -5.384  -1.567
   15    HB3  SER   3           2HB      SER   3  -3.456  -7.079  -1.652
   16    H    SER   4           H        SER   4   1.053  -6.189  -1.317
   17    HA   SER   4           HA       SER   4   1.598  -8.126   0.721
   18    HG   SER   4           HG       SER   4   4.960  -7.507   0.588
   19    HB2  SER   4           1HB      SER   4   3.358  -7.108  -0.895
   20    HB3  SER   4           2HB      SER   4   3.402  -5.760   0.239
   21    H    CYS   5           H        CYS   5   0.256  -5.114   0.813
   22    HA   CYS   5           HA       CYS   5   0.749  -4.847   3.662
   23    HB2  CYS   5           1HB      CYS   5   0.248  -2.789   1.525
   24    HB3  CYS   5           2HB      CYS   5  -0.126  -2.433   3.194
   25    HA   PRO   6           HA       PRO   6  -3.554  -6.088   3.831
   26    HB2  PRO   6           1HB      PRO   6  -3.865  -6.073   6.513
   27    HB3  PRO   6           2HB      PRO   6  -2.954  -7.323   5.658
   28    HG2  PRO   6           1HG      PRO   6  -1.941  -4.891   7.086
   29    HG3  PRO   6           2HG      PRO   6  -1.342  -6.557   7.164
   30    HD2  PRO   6           1HD      PRO   6  -0.150  -4.677   5.635
   31    HD3  PRO   6           2HD      PRO   6  -0.219  -6.381   5.154
   32    H    GLN   7           H        GLN   7  -2.506  -2.970   4.926
   33    HA   GLN   7           HA       GLN   7  -4.968  -2.041   5.937
   34    HB2  GLN   7           1HB      GLN   7  -2.512  -0.602   4.920
   35    HB3  GLN   7           2HB      GLN   7  -3.869   0.171   5.668
   36    HG2  GLN   7           1HG      GLN   7  -1.587  -0.726   6.892
   37    HG3  GLN   7           2HG      GLN   7  -3.057  -0.170   7.681
   38   HE21  GLN   7          1HE2      GLN   7  -0.903  -2.340   8.113
   39   HE22  GLN   7          2HE2      GLN   7  -1.833  -3.723   8.567
   40    H    PHE   8           H        PHE   8  -3.412  -2.148   2.812
   41    HA   PHE   8           HA       PHE   8  -5.832  -1.043   1.585
   42    HD1  PHE   8           HD2      PHE   8  -5.565   1.923   2.261
   43    HD2  PHE   8           HD1      PHE   8  -1.738   0.061   2.551
   44    HE1  PHE   8           HE2      PHE   8  -5.021   3.289   4.186
   45    HE2  PHE   8           HE1      PHE   8  -1.215   1.459   4.472
   46    HZ   PHE   8           HZ       PHE   8  -2.850   3.091   5.305
   47    HB2  PHE   8           1HB      PHE   8  -3.087  -0.303   0.659
   48    HB3  PHE   8           2HB      PHE   8  -4.597   0.563   0.388
   49    HA   PRO   9           HA       PRO   9  -4.727  -4.703  -0.865
   50    HB2  PRO   9           1HB      PRO   9  -6.988  -5.035  -2.255
   51    HB3  PRO   9           2HB      PRO   9  -6.891  -5.400  -0.530
   52    HG2  PRO   9           1HG      PRO   9  -8.051  -3.007  -1.894
   53    HG3  PRO   9           2HG      PRO   9  -8.646  -3.898  -0.486
   54    HD2  PRO   9           1HD      PRO   9  -7.234  -1.526  -0.334
   55    HD3  PRO   9           2HD      PRO   9  -7.362  -2.734   0.961
   56    H    SER  10           H        SER  10  -5.319  -1.645  -2.093
   57    HA   SER  10           HA       SER  10  -4.612  -2.454  -4.826
   58    HG   SER  10           HG       SER  10  -5.820   0.516  -6.127
   59    HB2  SER  10           1HB      SER  10  -6.744  -1.132  -4.390
   60    HB3  SER  10           2HB      SER  10  -5.698   0.243  -4.040
   61    H    CYS  11           H        CYS  11  -2.812  -1.634  -2.310
   62    HA   CYS  11           HA       CYS  11  -1.481   0.705  -3.034
   63    HB2  CYS  11           1HB      CYS  11  -1.349  -0.500  -0.805
   64    HB3  CYS  11           2HB      CYS  11  -0.257  -1.632  -1.578
   65    H    SER  12           H        SER  12  -0.354   1.082  -4.852
   66    HA   SER  12           HA       SER  12   0.583  -0.825  -6.638
   67    HG   SER  12           HG       SER  12   2.363   0.896  -8.392
   68    HB2  SER  12           1HB      SER  12   0.513   1.342  -7.491
   69    HB3  SER  12           2HB      SER  12   1.334   2.029  -6.105
   70    HA   PRO  13           HA       PRO  13   4.016  -2.713  -4.634
   71    HB2  PRO  13           1HB      PRO  13   5.856  -2.521  -6.810
   72    HB3  PRO  13           2HB      PRO  13   4.873  -3.927  -6.398
   73    HG2  PRO  13           1HG      PRO  13   4.428  -1.850  -8.453
   74    HG3  PRO  13           2HG      PRO  13   3.885  -3.535  -8.410
   75    HD2  PRO  13           1HD      PRO  13   2.210  -1.465  -8.025
   76    HD3  PRO  13           2HD      PRO  13   1.985  -3.025  -7.205
   77    H    SER  14           H        SER  14   4.275   0.282  -6.456
   78    HA   SER  14           HA       SER  14   6.784   1.091  -5.377
   79    HG   SER  14           HG       SER  14   6.415   2.762  -8.272
   80    HB2  SER  14           1HB      SER  14   4.692   2.319  -7.038
   81    HB3  SER  14           2HB      SER  14   5.625   3.449  -6.056
   82    H    CYS  15           H        CYS  15   3.473   1.588  -4.323
   83    HA   CYS  15           HA       CYS  15   4.357   3.296  -2.158
   84    HB2  CYS  15           1HB      CYS  15   1.604   2.342  -2.958
   85    HB3  CYS  15           2HB      CYS  15   1.925   3.371  -1.566
   86    H    ALA  16           H        ALA  16   4.792   0.193  -2.504
   87    HA   ALA  16           HA       ALA  16   4.048  -0.384   0.288
   88    HB1  ALA  16           3HB      ALA  16   4.247  -2.770  -1.346
   89    HB2  ALA  16           1HB      ALA  16   3.001  -1.660  -1.922
   90    HB3  ALA  16           2HB      ALA  16   2.957  -2.243  -0.264
   91    HA   PRO  17           HA       PRO  17   4.346  -2.418   1.379
   92    HB2  PRO  17           1HB      PRO  17   5.627  -3.761   3.205
   93    HB3  PRO  17           2HB      PRO  17   5.752  -4.298   1.521
   94    HG2  PRO  17           1HG      PRO  17   7.687  -2.652   3.125
   95    HG3  PRO  17           2HG      PRO  17   8.021  -4.067   2.106
   96    HD2  PRO  17           1HD      PRO  17   8.275  -1.426   1.294
   97    HD3  PRO  17           2HD      PRO  17   8.068  -2.808   0.200
   98    H    GLN  18           H        GLN  18   5.875   0.319   1.916
   99    HA   GLN  18           HA       GLN  18   6.192   0.671   4.648
  100    HB2  GLN  18           1HB      GLN  18   5.807   3.037   4.228
  101    HB3  GLN  18           2HB      GLN  18   6.806   2.313   2.994
  102    HG2  GLN  18           1HG      GLN  18   3.912   2.523   2.464
  103    HG3  GLN  18           2HG      GLN  18   4.892   3.972   2.394
  104   HE21  GLN  18          1HE2      GLN  18   5.307   4.442   0.370
  105   HE22  GLN  18          2HE2      GLN  18   5.817   3.325  -0.846
  106    H    CYS  19           H        CYS  19   3.413   0.176   2.813
  107    HA   CYS  19           HA       CYS  19   1.200  -0.007   3.242
  108    HB2  CYS  19           1HB      CYS  19   2.082  -0.331   6.107
  109    HB3  CYS  19           2HB      CYS  19   0.561  -0.847   5.407
  110    H    SER  20           H        SER  20   1.840   2.668   2.987
  111    HA   SER  20           HA       SER  20   0.253   3.889   5.161
  112    HG   SER  20           HG       SER  20   3.604   5.161   3.559
  113    HB2  SER  20           1HB      SER  20   1.326   6.069   4.364
  114    HB3  SER  20           2HB      SER  20   2.363   4.948   5.248
  115    H    GLN  21           H        GLN  21  -1.667   4.690   4.654
  116    HA   GLN  21           HA       GLN  21  -2.918   4.395   2.235
  117    HB2  GLN  21           1HB      GLN  21  -4.035   4.851   4.434
  118    HB3  GLN  21           2HB      GLN  21  -3.594   6.538   4.264
  119    HG2  GLN  21           1HG      GLN  21  -4.936   5.331   1.979
  120    HG3  GLN  21           2HG      GLN  21  -5.918   5.494   3.411
  121   HE21  GLN  21          1HE2      GLN  21  -3.538   7.909   3.255
  122   HE22  GLN  21          2HE2      GLN  21  -4.524   9.167   2.617
  123    H    GLN  22           H        GLN  22  -0.989   7.064   3.375
  124    HA   GLN  22           HA       GLN  22  -1.743   9.063   1.654
  125    HB2  GLN  22           1HB      GLN  22   0.891   8.462   2.954
  126    HB3  GLN  22           2HB      GLN  22   0.778   9.758   1.774
  127    HG2  GLN  22           1HG      GLN  22  -1.350  10.297   3.373
  128    HG3  GLN  22           2HG      GLN  22  -0.196   9.625   4.523
  129   HE21  GLN  22          1HE2      GLN  22  -0.700  12.124   2.115
  130   HE22  GLN  22          2HE2      GLN  22   0.496  13.213   2.720
  131    H    CYS  23           H        CYS  23   0.885   6.715   0.980
  132    HA   CYS  23           HA       CYS  23   1.072   7.664  -1.720
  133    HB2  CYS  23           1HB      CYS  23   3.035   6.820  -0.408
  134    HB3  CYS  23           2HB      CYS  23   2.365   5.198  -0.535
  135    H    CYS  24           H        CYS  24  -0.045   4.641  -0.186
  136    HA   CYS  24           HA       CYS  24  -0.716   3.353  -2.596
  137    HB2  CYS  24           1HB      CYS  24  -2.087   2.889   0.059
  138    HB3  CYS  24           2HB      CYS  24  -1.924   1.776  -1.280
  139    H    GLN  25           H        GLN  25  -2.562   5.543  -0.541
  140    HA   GLN  25           HA       GLN  25  -4.873   5.219  -2.277
  141    HB2  GLN  25           1HB      GLN  25  -4.644   5.469   0.473
  142    HB3  GLN  25           2HB      GLN  25  -5.291   7.015  -0.067
  143    HG2  GLN  25           1HG      GLN  25  -6.510   4.630  -1.240
  144    HG3  GLN  25           2HG      GLN  25  -6.757   4.843   0.489
  145   HE21  GLN  25          1HE2      GLN  25  -8.066   5.445  -2.432
  146   HE22  GLN  25          2HE2      GLN  25  -9.023   6.835  -2.059
  147    H    GLN  26           H        GLN  26  -3.685   8.079  -0.631
  148    HA   GLN  26           HA       GLN  26  -3.192   9.532  -3.010
  149    HB2  GLN  26           1HB      GLN  26  -5.840   9.769  -1.664
  150    HB3  GLN  26           2HB      GLN  26  -5.108  11.239  -2.287
  151    HG2  GLN  26           1HG      GLN  26  -4.836   9.401  -4.344
  152    HG3  GLN  26           2HG      GLN  26  -6.442   9.099  -3.684
  153   HE21  GLN  26          1HE2      GLN  26  -4.501  11.157  -5.574
  154   HE22  GLN  26          2HE2      GLN  26  -5.696  12.353  -5.927
  155    HA   PRO  27           HA       PRO  27  -0.980  12.217  -0.273
  156    HB2  PRO  27           1HB      PRO  27  -1.675  14.759  -1.001
  157    HB3  PRO  27           2HB      PRO  27  -0.561  13.746  -1.925
  158    HG2  PRO  27           1HG      PRO  27  -3.476  14.254  -2.377
  159    HG3  PRO  27           2HG      PRO  27  -2.155  14.198  -3.558
  160    HD2  PRO  27           1HD      PRO  27  -3.825  12.131  -3.220
  161    HD3  PRO  27           2HD      PRO  27  -2.103  11.885  -3.579
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1  -0.092  -6.020  -9.729
    2    H2   GLY   1           2H       GLY   1  -1.350  -4.964 -10.133
    3    H3   GLY   1           3H       GLY   1  -1.696  -6.450  -9.404
    4    HA2  GLY   1           1HA      GLY   1  -0.112  -4.309  -8.102
    5    HA3  GLY   1           2HA      GLY   1  -1.844  -4.506  -7.877
    6    H    SER   2           H        SER   2   0.846  -4.932  -6.279
    7    HA   SER   2           HA       SER   2   0.321  -7.639  -5.303
    8    HG   SER   2           HG       SER   2   3.682  -6.978  -6.121
    9    HB2  SER   2           1HB      SER   2   2.500  -5.946  -4.165
   10    HB3  SER   2           2HB      SER   2   2.480  -7.678  -4.500
   11    H    SER   3           H        SER   3  -0.864  -7.982  -3.550
   12    HA   SER   3           HA       SER   3  -1.560  -5.720  -1.843
   13    HG   SER   3           HG       SER   3  -3.593  -8.674  -3.193
   14    HB2  SER   3           1HB      SER   3  -3.086  -7.648  -0.864
   15    HB3  SER   3           2HB      SER   3  -3.530  -6.762  -2.320
   16    H    SER   4           H        SER   4   0.900  -6.214  -1.358
   17    HA   SER   4           HA       SER   4   1.308  -8.234   0.674
   18    HG   SER   4           HG       SER   4   4.388  -8.418   0.248
   19    HB2  SER   4           1HB      SER   4   3.126  -7.287  -0.972
   20    HB3  SER   4           2HB      SER   4   3.304  -6.046   0.264
   21    H    CYS   5           H        CYS   5   0.100  -5.182   0.758
   22    HA   CYS   5           HA       CYS   5   0.724  -4.846   3.572
   23    HB2  CYS   5           1HB      CYS   5   0.100  -2.843   1.409
   24    HB3  CYS   5           2HB      CYS   5  -0.172  -2.450   3.088
   25    HA   PRO   6           HA       PRO   6  -3.575  -6.047   3.976
   26    HB2  PRO   6           1HB      PRO   6  -3.773  -5.901   6.672
   27    HB3  PRO   6           2HB      PRO   6  -2.933  -7.208   5.830
   28    HG2  PRO   6           1HG      PRO   6  -1.800  -4.753   7.117
   29    HG3  PRO   6           2HG      PRO   6  -1.228  -6.428   7.215
   30    HD2  PRO   6           1HD      PRO   6  -0.083  -4.612   5.575
   31    HD3  PRO   6           2HD      PRO   6  -0.196  -6.328   5.153
   32    H    GLN   7           H        GLN   7  -2.466  -2.897   4.982
   33    HA   GLN   7           HA       GLN   7  -4.917  -1.926   5.981
   34    HB2  GLN   7           1HB      GLN   7  -2.452  -0.531   4.931
   35    HB3  GLN   7           2HB      GLN   7  -3.799   0.270   5.668
   36    HG2  GLN   7           1HG      GLN   7  -1.525  -0.624   6.904
   37    HG3  GLN   7           2HG      GLN   7  -2.988  -0.043   7.685
   38   HE21  GLN   7          1HE2      GLN   7  -0.852  -2.218   8.154
   39   HE22  GLN   7          2HE2      GLN   7  -1.788  -3.588   8.631
   40    H    PHE   8           H        PHE   8  -3.384  -2.113   2.851
   41    HA   PHE   8           HA       PHE   8  -5.793  -0.981   1.620
   42    HD1  PHE   8           HD1      PHE   8  -5.464   2.014   2.175
   43    HD2  PHE   8           HD2      PHE   8  -1.690   0.061   2.561
   44    HE1  PHE   8           HE1      PHE   8  -4.898   3.437   4.051
   45    HE2  PHE   8           HE2      PHE   8  -1.148   1.511   4.442
   46    HZ   PHE   8           HZ       PHE   8  -2.743   3.215   5.201
   47    HB2  PHE   8           1HB      PHE   8  -3.035  -0.319   0.678
   48    HB3  PHE   8           2HB      PHE   8  -4.525   0.566   0.369
   49    HA   PRO   9           HA       PRO   9  -4.766  -4.688  -0.803
   50    HB2  PRO   9           1HB      PRO   9  -7.042  -4.980  -2.187
   51    HB3  PRO   9           2HB      PRO   9  -6.938  -5.356  -0.465
   52    HG2  PRO   9           1HG      PRO   9  -8.081  -2.947  -1.811
   53    HG3  PRO   9           2HG      PRO   9  -8.666  -3.826  -0.393
   54    HD2  PRO   9           1HD      PRO   9  -7.222  -1.470  -0.273
   55    HD3  PRO   9           2HD      PRO   9  -7.354  -2.667   1.033
   56    H    SER  10           H        SER  10  -5.326  -1.628  -2.041
   57    HA   SER  10           HA       SER  10  -4.629  -2.436  -4.772
   58    HG   SER  10           HG       SER  10  -5.003   0.302  -6.046
   59    HB2  SER  10           1HB      SER  10  -6.746  -1.089  -4.332
   60    HB3  SER  10           2HB      SER  10  -5.682   0.272  -3.975
   61    H    CYS  11           H        CYS  11  -2.818  -1.651  -2.258
   62    HA   CYS  11           HA       CYS  11  -1.458   0.679  -2.945
   63    HB2  CYS  11           1HB      CYS  11  -1.286  -0.587  -0.750
   64    HB3  CYS  11           2HB      CYS  11  -0.234  -1.715  -1.575
   65    H    SER  12           H        SER  12  -0.369   1.097  -4.778
   66    HA   SER  12           HA       SER  12   0.462  -0.736  -6.667
   67    HG   SER  12           HG       SER  12   2.719   1.978  -7.802
   68    HB2  SER  12           1HB      SER  12   0.509   1.453  -7.422
   69    HB3  SER  12           2HB      SER  12   1.326   2.049  -5.994
   70    HA   PRO  13           HA       PRO  13   3.787  -2.923  -4.814
   71    HB2  PRO  13           1HB      PRO  13   5.594  -2.765  -7.022
   72    HB3  PRO  13           2HB      PRO  13   4.534  -4.121  -6.634
   73    HG2  PRO  13           1HG      PRO  13   4.175  -1.954  -8.608
   74    HG3  PRO  13           2HG      PRO  13   3.521  -3.600  -8.601
   75    HD2  PRO  13           1HD      PRO  13   2.002  -1.434  -8.109
   76    HD3  PRO  13           2HD      PRO  13   1.689  -3.003  -7.337
   77    H    SER  14           H        SER  14   4.226   0.110  -6.536
   78    HA   SER  14           HA       SER  14   6.796   0.703  -5.454
   79    HG   SER  14           HG       SER  14   5.631   4.146  -6.509
   80    HB2  SER  14           1HB      SER  14   6.401   1.945  -7.352
   81    HB3  SER  14           2HB      SER  14   4.716   2.245  -6.934
   82    H    CYS  15           H        CYS  15   3.540   1.437  -4.376
   83    HA   CYS  15           HA       CYS  15   4.525   3.080  -2.225
   84    HB2  CYS  15           1HB      CYS  15   1.728   2.144  -2.889
   85    HB3  CYS  15           2HB      CYS  15   2.127   3.224  -1.559
   86    H    ALA  16           H        ALA  16   4.634  -0.157  -2.645
   87    HA   ALA  16           HA       ALA  16   4.032  -0.669   0.196
   88    HB1  ALA  16           3HB      ALA  16   3.425  -2.860  -0.340
   89    HB2  ALA  16           1HB      ALA  16   4.204  -2.770  -1.915
   90    HB3  ALA  16           2HB      ALA  16   2.712  -1.876  -1.614
   91    HA   PRO  17           HA       PRO  17   4.411  -2.525   1.448
   92    HB2  PRO  17           1HB      PRO  17   5.756  -3.658   3.374
   93    HB3  PRO  17           2HB      PRO  17   5.843  -4.368   1.753
   94    HG2  PRO  17           1HG      PRO  17   7.801  -2.549   3.124
   95    HG3  PRO  17           2HG      PRO  17   8.123  -4.057   2.242
   96    HD2  PRO  17           1HD      PRO  17   8.332  -1.514   1.160
   97    HD3  PRO  17           2HD      PRO  17   8.100  -2.999   0.218
   98    H    GLN  18           H        GLN  18   5.924   0.241   1.642
   99    HA   GLN  18           HA       GLN  18   6.301   0.938   4.296
  100    HB2  GLN  18           1HB      GLN  18   6.102   3.165   3.693
  101    HB3  GLN  18           2HB      GLN  18   6.563   2.424   2.183
  102    HG2  GLN  18           1HG      GLN  18   4.388   2.666   1.300
  103    HG3  GLN  18           2HG      GLN  18   3.711   3.016   2.885
  104   HE21  GLN  18          1HE2      GLN  18   5.183   4.918   3.922
  105   HE22  GLN  18          2HE2      GLN  18   5.230   6.326   2.921
  106    H    CYS  19           H        CYS  19   3.447   0.284   2.558
  107    HA   CYS  19           HA       CYS  19   1.270   0.018   3.066
  108    HB2  CYS  19           1HB      CYS  19   2.340  -0.330   5.867
  109    HB3  CYS  19           2HB      CYS  19   0.746  -0.792   5.310
  110    H    SER  20           H        SER  20   1.795   2.723   2.828
  111    HA   SER  20           HA       SER  20   0.193   3.850   5.039
  112    HG   SER  20           HG       SER  20   2.897   6.183   3.122
  113    HB2  SER  20           1HB      SER  20   1.248   6.045   4.531
  114    HB3  SER  20           2HB      SER  20   2.410   4.846   5.097
  115    H    GLN  21           H        GLN  21  -1.701   4.783   4.530
  116    HA   GLN  21           HA       GLN  21  -2.943   4.464   2.110
  117    HB2  GLN  21           1HB      GLN  21  -4.041   5.014   4.311
  118    HB3  GLN  21           2HB      GLN  21  -3.584   6.687   4.063
  119    HG2  GLN  21           1HG      GLN  21  -4.933   5.444   1.814
  120    HG3  GLN  21           2HG      GLN  21  -5.918   5.576   3.250
  121   HE21  GLN  21          1HE2      GLN  21  -3.527   8.013   2.953
  122   HE22  GLN  21          2HE2      GLN  21  -4.564   9.268   2.394
  123    H    GLN  22           H        GLN  22  -0.962   7.131   3.193
  124    HA   GLN  22           HA       GLN  22  -1.664   9.081   1.399
  125    HB2  GLN  22           1HB      GLN  22   0.962   8.477   2.722
  126    HB3  GLN  22           2HB      GLN  22   0.843   9.770   1.538
  127    HG2  GLN  22           1HG      GLN  22   0.083  11.124   3.098
  128    HG3  GLN  22           2HG      GLN  22  -1.315  10.075   3.331
  129   HE21  GLN  22          1HE2      GLN  22   2.068  10.476   4.276
  130   HE22  GLN  22          2HE2      GLN  22   1.885   9.829   5.866
  131    H    CYS  23           H        CYS  23   0.926   6.667   0.819
  132    HA   CYS  23           HA       CYS  23   1.135   7.541  -1.911
  133    HB2  CYS  23           1HB      CYS  23   3.096   6.741  -0.568
  134    HB3  CYS  23           2HB      CYS  23   2.423   5.118  -0.643
  135    H    CYS  24           H        CYS  24   0.004   4.586  -0.283
  136    HA   CYS  24           HA       CYS  24  -0.643   3.210  -2.651
  137    HB2  CYS  24           1HB      CYS  24  -2.007   2.829   0.017
  138    HB3  CYS  24           2HB      CYS  24  -1.843   1.675  -1.288
  139    H    GLN  25           H        GLN  25  -2.533   5.463  -0.691
  140    HA   GLN  25           HA       GLN  25  -4.894   4.924  -2.250
  141    HB2  GLN  25           1HB      GLN  25  -4.575   5.659   0.347
  142    HB3  GLN  25           2HB      GLN  25  -5.026   7.187  -0.413
  143    HG2  GLN  25           1HG      GLN  25  -6.608   4.863  -1.191
  144    HG3  GLN  25           2HG      GLN  25  -6.738   5.334   0.499
  145   HE21  GLN  25          1HE2      GLN  25  -7.402   6.210  -2.780
  146   HE22  GLN  25          2HE2      GLN  25  -8.408   7.572  -2.439
  147    H    GLN  26           H        GLN  26  -3.509   8.032  -1.407
  148    HA   GLN  26           HA       GLN  26  -4.339   9.016  -4.024
  149    HB2  GLN  26           1HB      GLN  26  -4.272  11.223  -3.106
  150    HB3  GLN  26           2HB      GLN  26  -5.070  10.198  -1.930
  151    HG2  GLN  26           1HG      GLN  26  -2.171  10.465  -1.565
  152    HG3  GLN  26           2HG      GLN  26  -3.095  11.950  -1.357
  153   HE21  GLN  26          1HE2      GLN  26  -3.717  12.315   0.634
  154   HE22  GLN  26          2HE2      GLN  26  -4.068  11.123   1.834
  155    HA   PRO  27           HA       PRO  27  -0.193   9.555  -5.480
  156    HB2  PRO  27           1HB      PRO  27  -0.080  12.000  -6.600
  157    HB3  PRO  27           2HB      PRO  27  -1.055  10.698  -7.291
  158    HG2  PRO  27           1HG      PRO  27  -1.908  12.995  -5.570
  159    HG3  PRO  27           2HG      PRO  27  -2.684  12.338  -7.024
  160    HD2  PRO  27           1HD      PRO  27  -3.510  11.755  -4.502
  161    HD3  PRO  27           2HD      PRO  27  -3.697  10.638  -5.868
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1   3.088 -11.612  -2.845
    2    H2   GLY   1           2H       GLY   1   2.769 -12.301  -4.356
    3    H3   GLY   1           3H       GLY   1   3.112 -13.294  -3.031
    4    HA2  GLY   1           1HA      GLY   1   0.745 -13.303  -3.527
    5    HA3  GLY   1           2HA      GLY   1   1.083 -12.638  -1.936
    6    H    SER   2           H        SER   2  -1.301 -12.147  -3.290
    7    HA   SER   2           HA       SER   2  -1.212  -9.638  -4.657
    8    HG   SER   2           HG       SER   2  -2.328 -11.924  -5.452
    9    HB2  SER   2           1HB      SER   2  -3.724 -10.616  -3.367
   10    HB3  SER   2           2HB      SER   2  -3.487  -9.886  -4.956
   11    H    SER   3           H        SER   3  -0.771  -7.775  -3.697
   12    HA   SER   3           HA       SER   3  -0.793  -6.038  -2.221
   13    HG   SER   3           HG       SER   3  -2.382  -5.976   0.437
   14    HB2  SER   3           1HB      SER   3  -2.908  -5.632  -1.712
   15    HB3  SER   3           2HB      SER   3  -3.328  -7.333  -1.865
   16    H    SER   4           H        SER   4   1.146  -6.359  -1.334
   17    HA   SER   4           HA       SER   4   1.597  -8.307   0.746
   18    HG   SER   4           HG       SER   4   3.824  -8.796   0.875
   19    HB2  SER   4           1HB      SER   4   3.403  -7.349  -0.888
   20    HB3  SER   4           2HB      SER   4   3.508  -6.040   0.284
   21    H    CYS   5           H        CYS   5   0.293  -5.294   0.757
   22    HA   CYS   5           HA       CYS   5   0.844  -4.902   3.581
   23    HB2  CYS   5           1HB      CYS   5   0.255  -2.946   1.366
   24    HB3  CYS   5           2HB      CYS   5  -0.074  -2.519   3.023
   25    HA   PRO   6           HA       PRO   6  -3.455  -6.176   3.887
   26    HB2  PRO   6           1HB      PRO   6  -3.689  -6.129   6.570
   27    HB3  PRO   6           2HB      PRO   6  -2.763  -7.370   5.718
   28    HG2  PRO   6           1HG      PRO   6  -1.780  -4.871   7.064
   29    HG3  PRO   6           2HG      PRO   6  -1.146  -6.524   7.187
   30    HD2  PRO   6           1HD      PRO   6  -0.014  -4.685   5.572
   31    HD3  PRO   6           2HD      PRO   6  -0.071  -6.401   5.146
   32    H    GLN   7           H        GLN   7  -2.378  -3.063   4.769
   33    HA   GLN   7           HA       GLN   7  -4.784  -2.067   5.901
   34    HB2  GLN   7           1HB      GLN   7  -2.245  -0.779   4.900
   35    HB3  GLN   7           2HB      GLN   7  -3.639   0.159   5.312
   36    HG2  GLN   7           1HG      GLN   7  -3.053  -1.626   7.456
   37    HG3  GLN   7           2HG      GLN   7  -1.615  -0.714   6.987
   38   HE21  GLN   7          1HE2      GLN   7  -1.403   1.295   7.687
   39   HE22  GLN   7          2HE2      GLN   7  -2.634   2.219   8.471
   40    H    PHE   8           H        PHE   8  -3.327  -2.203   2.722
   41    HA   PHE   8           HA       PHE   8  -5.774  -1.092   1.561
   42    HD1  PHE   8           HD1      PHE   8  -5.481   1.904   2.179
   43    HD2  PHE   8           HD2      PHE   8  -1.686  -0.029   2.541
   44    HE1  PHE   8           HE1      PHE   8  -4.934   3.291   4.093
   45    HE2  PHE   8           HE2      PHE   8  -1.165   1.383   4.452
   46    HZ   PHE   8           HZ       PHE   8  -2.780   3.058   5.245
   47    HB2  PHE   8           1HB      PHE   8  -3.040  -0.345   0.606
   48    HB3  PHE   8           2HB      PHE   8  -4.551   0.520   0.348
   49    HA   PRO   9           HA       PRO   9  -4.717  -4.720  -0.966
   50    HB2  PRO   9           1HB      PRO   9  -6.999  -5.007  -2.341
   51    HB3  PRO   9           2HB      PRO   9  -6.877  -5.427  -0.631
   52    HG2  PRO   9           1HG      PRO   9  -8.063  -2.999  -1.902
   53    HG3  PRO   9           2HG      PRO   9  -8.626  -3.925  -0.505
   54    HD2  PRO   9           1HD      PRO   9  -7.213  -1.554  -0.327
   55    HD3  PRO   9           2HD      PRO   9  -7.316  -2.790   0.943
   56    H    SER  10           H        SER  10  -5.330  -1.637  -2.118
   57    HA   SER  10           HA       SER  10  -4.646  -2.369  -4.874
   58    HG   SER  10           HG       SER  10  -6.536  -0.500  -6.382
   59    HB2  SER  10           1HB      SER  10  -6.767  -1.047  -4.380
   60    HB3  SER  10           2HB      SER  10  -5.707   0.312  -4.003
   61    H    CYS  11           H        CYS  11  -2.820  -1.637  -2.354
   62    HA   CYS  11           HA       CYS  11  -1.472   0.714  -3.017
   63    HB2  CYS  11           1HB      CYS  11  -1.300  -0.562  -0.830
   64    HB3  CYS  11           2HB      CYS  11  -0.246  -1.686  -1.657
   65    H    SER  12           H        SER  12  -0.379   1.143  -4.848
   66    HA   SER  12           HA       SER  12   0.448  -0.680  -6.746
   67    HG   SER  12           HG       SER  12   2.794   2.060  -7.731
   68    HB2  SER  12           1HB      SER  12   0.511   1.515  -7.484
   69    HB3  SER  12           2HB      SER  12   1.329   2.095  -6.049
   70    HA   PRO  13           HA       PRO  13   3.752  -2.899  -4.889
   71    HB2  PRO  13           1HB      PRO  13   5.566  -2.750  -7.093
   72    HB3  PRO  13           2HB      PRO  13   4.496  -4.099  -6.709
   73    HG2  PRO  13           1HG      PRO  13   4.157  -1.926  -8.680
   74    HG3  PRO  13           2HG      PRO  13   3.492  -3.566  -8.679
   75    HD2  PRO  13           1HD      PRO  13   1.986  -1.391  -8.186
   76    HD3  PRO  13           2HD      PRO  13   1.660  -2.958  -7.418
   77    H    SER  14           H        SER  14   4.217   0.136  -6.603
   78    HA   SER  14           HA       SER  14   6.784   0.704  -5.508
   79    HG   SER  14           HG       SER  14   6.704   1.187  -7.975
   80    HB2  SER  14           1HB      SER  14   4.798   2.155  -7.126
   81    HB3  SER  14           2HB      SER  14   5.846   3.166  -6.130
   82    H    CYS  15           H        CYS  15   3.530   1.450  -4.428
   83    HA   CYS  15           HA       CYS  15   4.537   3.082  -2.277
   84    HB2  CYS  15           1HB      CYS  15   1.733   2.184  -2.958
   85    HB3  CYS  15           2HB      CYS  15   2.134   3.210  -1.585
   86    H    ALA  16           H        ALA  16   4.608  -0.158  -2.711
   87    HA   ALA  16           HA       ALA  16   4.027  -0.671   0.132
   88    HB1  ALA  16           3HB      ALA  16   3.425  -2.863  -0.400
   89    HB2  ALA  16           1HB      ALA  16   4.202  -2.773  -1.976
   90    HB3  ALA  16           2HB      ALA  16   2.708  -1.885  -1.675
   91    HA   PRO  17           HA       PRO  17   4.434  -2.541   1.373
   92    HB2  PRO  17           1HB      PRO  17   5.799  -3.668   3.288
   93    HB3  PRO  17           2HB      PRO  17   5.889  -4.367   1.662
   94    HG2  PRO  17           1HG      PRO  17   7.828  -2.530   3.037
   95    HG3  PRO  17           2HG      PRO  17   8.166  -4.030   2.147
   96    HD2  PRO  17           1HD      PRO  17   8.338  -1.477   1.078
   97    HD3  PRO  17           2HD      PRO  17   8.121  -2.960   0.128
   98    H    GLN  18           H        GLN  18   5.907   0.247   1.584
   99    HA   GLN  18           HA       GLN  18   6.303   0.938   4.229
  100    HB2  GLN  18           1HB      GLN  18   5.999   3.166   3.658
  101    HB3  GLN  18           2HB      GLN  18   6.478   2.453   2.142
  102    HG2  GLN  18           1HG      GLN  18   4.394   2.739   1.203
  103    HG3  GLN  18           2HG      GLN  18   3.583   2.784   2.764
  104   HE21  GLN  18          1HE2      GLN  18   4.912   4.677   4.129
  105   HE22  GLN  18          2HE2      GLN  18   4.782   6.206   3.336
  106    H    CYS  19           H        CYS  19   3.424   0.199   2.565
  107    HA   CYS  19           HA       CYS  19   1.271  -0.126   3.131
  108    HB2  CYS  19           1HB      CYS  19   2.444  -0.449   5.896
  109    HB3  CYS  19           2HB      CYS  19   0.835  -0.928   5.406
  110    H    SER  20           H        SER  20   1.740   2.575   2.871
  111    HA   SER  20           HA       SER  20   0.109   3.671   5.079
  112    HG   SER  20           HG       SER  20   3.197   3.726   4.313
  113    HB2  SER  20           1HB      SER  20   1.883   5.550   3.570
  114    HB3  SER  20           2HB      SER  20   1.304   5.625   5.232
  115    H    GLN  21           H        GLN  21  -1.731   4.638   4.559
  116    HA   GLN  21           HA       GLN  21  -2.930   4.393   2.107
  117    HB2  GLN  21           1HB      GLN  21  -4.042   4.904   4.322
  118    HB3  GLN  21           2HB      GLN  21  -3.601   6.586   4.072
  119    HG2  GLN  21           1HG      GLN  21  -4.918   5.304   1.825
  120    HG3  GLN  21           2HG      GLN  21  -5.918   5.479   3.249
  121   HE21  GLN  21          1HE2      GLN  21  -6.982   7.316   3.437
  122   HE22  GLN  21          2HE2      GLN  21  -6.577   8.809   2.668
  123    H    GLN  22           H        GLN  22  -0.929   6.986   3.276
  124    HA   GLN  22           HA       GLN  22  -1.594   9.015   1.550
  125    HB2  GLN  22           1HB      GLN  22   1.005   8.330   2.884
  126    HB3  GLN  22           2HB      GLN  22   0.931   9.651   1.728
  127    HG2  GLN  22           1HG      GLN  22   0.368  10.918   3.456
  128    HG3  GLN  22           2HG      GLN  22  -1.219  10.159   3.340
  129   HE21  GLN  22          1HE2      GLN  22   1.942   9.095   4.553
  130   HE22  GLN  22          2HE2      GLN  22   1.376   8.621   6.115
  131    H    CYS  23           H        CYS  23   0.986   6.601   0.909
  132    HA   CYS  23           HA       CYS  23   1.221   7.554  -1.792
  133    HB2  CYS  23           1HB      CYS  23   3.161   6.678  -0.464
  134    HB3  CYS  23           2HB      CYS  23   2.464   5.070  -0.596
  135    H    CYS  24           H        CYS  24   0.037   4.571  -0.255
  136    HA   CYS  24           HA       CYS  24  -0.624   3.266  -2.657
  137    HB2  CYS  24           1HB      CYS  24  -2.005   2.848  -0.002
  138    HB3  CYS  24           2HB      CYS  24  -1.852   1.717  -1.327
  139    H    GLN  25           H        GLN  25  -2.471   5.507  -0.651
  140    HA   GLN  25           HA       GLN  25  -4.760   5.160  -2.418
  141    HB2  GLN  25           1HB      GLN  25  -4.565   5.396   0.339
  142    HB3  GLN  25           2HB      GLN  25  -5.243   6.926  -0.204
  143    HG2  GLN  25           1HG      GLN  25  -6.445   4.639  -1.497
  144    HG3  GLN  25           2HG      GLN  25  -6.590   4.584   0.256
  145   HE21  GLN  25          1HE2      GLN  25  -8.418   5.212  -2.156
  146   HE22  GLN  25          2HE2      GLN  25  -9.270   6.624  -1.642
  147    H    GLN  26           H        GLN  26  -3.649   8.021  -0.716
  148    HA   GLN  26           HA       GLN  26  -3.274   9.488  -3.149
  149    HB2  GLN  26           1HB      GLN  26  -5.532  10.271  -1.291
  150    HB3  GLN  26           2HB      GLN  26  -5.010  11.173  -2.704
  151    HG2  GLN  26           1HG      GLN  26  -5.609   9.189  -4.094
  152    HG3  GLN  26           2HG      GLN  26  -6.306   8.464  -2.647
  153   HE21  GLN  26          1HE2      GLN  26  -7.614   9.189  -5.126
  154   HE22  GLN  26          2HE2      GLN  26  -8.852  10.321  -4.714
  155    HA   PRO  27           HA       PRO  27  -0.614  11.909  -0.550
  156    HB2  PRO  27           1HB      PRO  27  -0.972  14.477  -1.375
  157    HB3  PRO  27           2HB      PRO  27  -0.073  13.277  -2.312
  158    HG2  PRO  27           1HG      PRO  27  -2.909  14.186  -2.625
  159    HG3  PRO  27           2HG      PRO  27  -1.678  13.912  -3.872
  160    HD2  PRO  27           1HD      PRO  27  -3.600  12.111  -3.356
  161    HD3  PRO  27           2HD      PRO  27  -1.957  11.622  -3.826
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  -0.404 -12.608  -1.796
    2    H2   GLY   1           2H       GLY   1   0.338 -13.952  -2.505
    3    H3   GLY   1           3H       GLY   1  -1.250 -14.066  -1.937
    4    HA2  GLY   1           1HA      GLY   1  -0.622 -13.645  -4.492
    5    HA3  GLY   1           2HA      GLY   1  -2.140 -13.151  -3.758
    6    H    SER   2           H        SER   2  -2.693 -11.112  -4.097
    7    HA   SER   2           HA       SER   2  -0.615  -9.206  -4.894
    8    HG   SER   2           HG       SER   2  -2.716  -7.538  -6.958
    9    HB2  SER   2           1HB      SER   2  -2.706  -9.634  -6.314
   10    HB3  SER   2           2HB      SER   2  -3.594  -8.760  -5.066
   11    H    SER   3           H        SER   3  -0.647  -7.039  -4.054
   12    HA   SER   3           HA       SER   3  -0.713  -5.474  -2.398
   13    HG   SER   3           HG       SER   3  -3.833  -6.497  -0.236
   14    HB2  SER   3           1HB      SER   3  -2.841  -5.062  -1.962
   15    HB3  SER   3           2HB      SER   3  -3.294  -6.723  -2.326
   16    H    SER   4           H        SER   4   1.167  -5.952  -1.453
   17    HA   SER   4           HA       SER   4   1.430  -8.118   0.448
   18    HG   SER   4           HG       SER   4   4.810  -7.896   0.422
   19    HB2  SER   4           1HB      SER   4   3.348  -7.091  -1.022
   20    HB3  SER   4           2HB      SER   4   3.468  -5.928   0.295
   21    H    CYS   5           H        CYS   5   0.238  -5.077   0.684
   22    HA   CYS   5           HA       CYS   5   0.730  -4.927   3.539
   23    HB2  CYS   5           1HB      CYS   5   0.237  -2.786   1.480
   24    HB3  CYS   5           2HB      CYS   5  -0.118  -2.491   3.164
   25    HA   PRO   6           HA       PRO   6  -3.594  -6.102   3.672
   26    HB2  PRO   6           1HB      PRO   6  -3.902  -6.180   6.355
   27    HB3  PRO   6           2HB      PRO   6  -3.013  -7.412   5.452
   28    HG2  PRO   6           1HG      PRO   6  -1.957  -5.050   6.964
   29    HG3  PRO   6           2HG      PRO   6  -1.385  -6.728   6.982
   30    HD2  PRO   6           1HD      PRO   6  -0.163  -4.819   5.518
   31    HD3  PRO   6           2HD      PRO   6  -0.265  -6.501   4.977
   32    H    GLN   7           H        GLN   7  -2.493  -3.048   4.893
   33    HA   GLN   7           HA       GLN   7  -4.929  -2.107   5.943
   34    HB2  GLN   7           1HB      GLN   7  -2.466  -0.674   4.935
   35    HB3  GLN   7           2HB      GLN   7  -3.797   0.091   5.735
   36    HG2  GLN   7           1HG      GLN   7  -1.509  -0.849   6.890
   37    HG3  GLN   7           2HG      GLN   7  -2.973  -0.346   7.725
   38   HE21  GLN   7          1HE2      GLN   7  -0.793  -2.501   8.042
   39   HE22  GLN   7          2HE2      GLN   7  -1.698  -3.918   8.440
   40    H    PHE   8           H        PHE   8  -3.410  -2.166   2.804
   41    HA   PHE   8           HA       PHE   8  -5.811  -0.964   1.627
   42    HD1  PHE   8           HD1      PHE   8  -5.446   1.992   2.308
   43    HD2  PHE   8           HD2      PHE   8  -1.685   0.002   2.580
   44    HE1  PHE   8           HE1      PHE   8  -4.853   3.334   4.238
   45    HE2  PHE   8           HE2      PHE   8  -1.106   1.373   4.511
   46    HZ   PHE   8           HZ       PHE   8  -2.687   3.054   5.355
   47    HB2  PHE   8           1HB      PHE   8  -3.047  -0.302   0.695
   48    HB3  PHE   8           2HB      PHE   8  -4.527   0.613   0.429
   49    HA   PRO   9           HA       PRO   9  -4.851  -4.614  -0.902
   50    HB2  PRO   9           1HB      PRO   9  -7.131  -4.829  -2.291
   51    HB3  PRO   9           2HB      PRO   9  -7.034  -5.251  -0.580
   52    HG2  PRO   9           1HG      PRO   9  -8.132  -2.786  -1.861
   53    HG3  PRO   9           2HG      PRO   9  -8.734  -3.693  -0.468
   54    HD2  PRO   9           1HD      PRO   9  -7.248  -1.369  -0.281
   55    HD3  PRO   9           2HD      PRO   9  -7.401  -2.601   0.989
   56    H    SER  10           H        SER  10  -5.357  -1.514  -2.063
   57    HA   SER  10           HA       SER  10  -4.682  -2.276  -4.815
   58    HG   SER  10           HG       SER  10  -5.840   0.764  -6.037
   59    HB2  SER  10           1HB      SER  10  -6.762  -0.887  -4.339
   60    HB3  SER  10           2HB      SER  10  -5.666   0.438  -3.952
   61    H    CYS  11           H        CYS  11  -2.848  -1.595  -2.286
   62    HA   CYS  11           HA       CYS  11  -1.428   0.713  -2.939
   63    HB2  CYS  11           1HB      CYS  11  -1.317  -0.578  -0.754
   64    HB3  CYS  11           2HB      CYS  11  -0.279  -1.720  -1.580
   65    H    SER  12           H        SER  12  -0.310   1.115  -4.754
   66    HA   SER  12           HA       SER  12   0.527  -0.756  -6.624
   67    HG   SER  12           HG       SER  12   2.838   1.987  -7.665
   68    HB2  SER  12           1HB      SER  12   0.532   1.437  -7.401
   69    HB3  SER  12           2HB      SER  12   1.385   2.047  -5.999
   70    HA   PRO  13           HA       PRO  13   3.906  -2.852  -4.742
   71    HB2  PRO  13           1HB      PRO  13   5.719  -2.659  -6.939
   72    HB3  PRO  13           2HB      PRO  13   4.685  -4.038  -6.558
   73    HG2  PRO  13           1HG      PRO  13   4.297  -1.874  -8.534
   74    HG3  PRO  13           2HG      PRO  13   3.684  -3.535  -8.540
   75    HD2  PRO  13           1HD      PRO  13   2.104  -1.412  -8.058
   76    HD3  PRO  13           2HD      PRO  13   1.826  -2.989  -7.288
   77    H    SER  14           H        SER  14   4.265   0.192  -6.463
   78    HA   SER  14           HA       SER  14   6.824   0.861  -5.401
   79    HG   SER  14           HG       SER  14   3.786   2.557  -5.996
   80    HB2  SER  14           1HB      SER  14   6.555   2.953  -6.419
   81    HB3  SER  14           2HB      SER  14   5.590   1.878  -7.431
   82    H    CYS  15           H        CYS  15   3.552   1.482  -4.300
   83    HA   CYS  15           HA       CYS  15   4.515   3.074  -2.086
   84    HB2  CYS  15           1HB      CYS  15   1.718   2.209  -2.839
   85    HB3  CYS  15           2HB      CYS  15   2.112   3.253  -1.476
   86    H    ALA  16           H        ALA  16   4.769  -0.067  -2.565
   87    HA   ALA  16           HA       ALA  16   4.061  -0.689   0.228
   88    HB1  ALA  16           3HB      ALA  16   4.170  -3.004  -1.532
   89    HB2  ALA  16           1HB      ALA  16   2.904  -1.847  -1.953
   90    HB3  ALA  16           2HB      ALA  16   2.962  -2.536  -0.334
   91    HA   PRO  17           HA       PRO  17   4.326  -2.644   1.361
   92    HB2  PRO  17           1HB      PRO  17   5.616  -3.829   3.312
   93    HB3  PRO  17           2HB      PRO  17   5.658  -4.542   1.691
   94    HG2  PRO  17           1HG      PRO  17   7.718  -2.841   3.062
   95    HG3  PRO  17           2HG      PRO  17   7.950  -4.352   2.158
   96    HD2  PRO  17           1HD      PRO  17   8.300  -1.814   1.108
   97    HD3  PRO  17           2HD      PRO  17   7.968  -3.268   0.147
   98    H    GLN  18           H        GLN  18   5.998   0.063   1.660
   99    HA   GLN  18           HA       GLN  18   6.366   0.762   4.279
  100    HB2  GLN  18           1HB      GLN  18   6.112   2.996   3.699
  101    HB3  GLN  18           2HB      GLN  18   6.584   2.253   2.194
  102    HG2  GLN  18           1HG      GLN  18   4.410   2.455   1.304
  103    HG3  GLN  18           2HG      GLN  18   3.724   2.806   2.885
  104   HE21  GLN  18          1HE2      GLN  18   4.368   4.163   0.060
  105   HE22  GLN  18          2HE2      GLN  18   4.705   5.787   0.543
  106    H    CYS  19           H        CYS  19   3.428   0.114   2.674
  107    HA   CYS  19           HA       CYS  19   1.271  -0.128   3.296
  108    HB2  CYS  19           1HB      CYS  19   2.547  -0.437   6.011
  109    HB3  CYS  19           2HB      CYS  19   0.878  -0.804   5.641
  110    H    SER  20           H        SER  20   1.809   2.579   2.968
  111    HA   SER  20           HA       SER  20   0.267   3.745   5.198
  112    HG   SER  20           HG       SER  20   3.199   5.900   3.379
  113    HB2  SER  20           1HB      SER  20   1.356   5.914   4.698
  114    HB3  SER  20           2HB      SER  20   2.506   4.693   5.240
  115    H    GLN  21           H        GLN  21  -1.618   4.660   4.697
  116    HA   GLN  21           HA       GLN  21  -2.876   4.397   2.278
  117    HB2  GLN  21           1HB      GLN  21  -3.958   4.909   4.491
  118    HB3  GLN  21           2HB      GLN  21  -3.479   6.582   4.286
  119    HG2  GLN  21           1HG      GLN  21  -4.856   5.419   2.012
  120    HG3  GLN  21           2HG      GLN  21  -5.831   5.523   3.456
  121   HE21  GLN  21          1HE2      GLN  21  -3.405   7.938   3.190
  122   HE22  GLN  21          2HE2      GLN  21  -4.435   9.220   2.681
  123    H    GLN  22           H        GLN  22  -0.858   7.017   3.388
  124    HA   GLN  22           HA       GLN  22  -1.568   9.017   1.640
  125    HB2  GLN  22           1HB      GLN  22   1.028   8.388   2.991
  126    HB3  GLN  22           2HB      GLN  22   0.991   9.631   1.751
  127    HG2  GLN  22           1HG      GLN  22  -1.096   9.793   3.828
  128    HG3  GLN  22           2HG      GLN  22   0.561  10.119   4.337
  129   HE21  GLN  22          1HE2      GLN  22  -0.558  12.242   4.742
  130   HE22  GLN  22          2HE2      GLN  22  -0.532  13.395   3.455
  131    H    CYS  23           H        CYS  23   1.042   6.639   1.007
  132    HA   CYS  23           HA       CYS  23   1.241   7.552  -1.704
  133    HB2  CYS  23           1HB      CYS  23   3.193   6.700  -0.382
  134    HB3  CYS  23           2HB      CYS  23   2.506   5.085  -0.498
  135    H    CYS  24           H        CYS  24   0.087   4.551  -0.154
  136    HA   CYS  24           HA       CYS  24  -0.588   3.265  -2.565
  137    HB2  CYS  24           1HB      CYS  24  -1.972   2.814   0.085
  138    HB3  CYS  24           2HB      CYS  24  -1.814   1.704  -1.256
  139    H    GLN  25           H        GLN  25  -2.418   5.468  -0.509
  140    HA   GLN  25           HA       GLN  25  -4.732   5.170  -2.239
  141    HB2  GLN  25           1HB      GLN  25  -4.501   5.477   0.501
  142    HB3  GLN  25           2HB      GLN  25  -5.091   7.035  -0.070
  143    HG2  GLN  25           1HG      GLN  25  -6.339   4.517  -1.013
  144    HG3  GLN  25           2HG      GLN  25  -6.733   5.151   0.582
  145   HE21  GLN  25          1HE2      GLN  25  -8.198   6.731   0.743
  146   HE22  GLN  25          2HE2      GLN  25  -8.909   7.568  -0.590
  147    H    GLN  26           H        GLN  26  -3.449   8.035  -0.677
  148    HA   GLN  26           HA       GLN  26  -2.977  10.193  -1.529
  149    HB2  GLN  26           1HB      GLN  26  -2.295   8.392  -3.606
  150    HB3  GLN  26           2HB      GLN  26  -3.204   9.696  -4.352
  151    HG2  GLN  26           1HG      GLN  26  -1.652  11.298  -3.761
  152    HG3  GLN  26           2HG      GLN  26  -0.994  10.321  -2.448
  153   HE21  GLN  26          1HE2      GLN  26  -1.267  10.486  -5.964
  154   HE22  GLN  26          2HE2      GLN  26   0.239   9.707  -6.297
  155    HA   PRO  27           HA       PRO  27  -7.499  10.507  -2.719
  156    HB2  PRO  27           1HB      PRO  27  -8.622  11.128  -0.374
  157    HB3  PRO  27           2HB      PRO  27  -8.271   9.451  -0.807
  158    HG2  PRO  27           1HG      PRO  27  -6.770  11.298   0.997
  159    HG3  PRO  27           2HG      PRO  27  -7.107   9.570   1.191
  160    HD2  PRO  27           1HD      PRO  27  -4.726  10.629   0.260
  161    HD3  PRO  27           2HD      PRO  27  -5.277   8.968  -0.025
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  -0.454  -6.153 -10.064
    2    H2   GLY   1           2H       GLY   1   1.117  -5.805  -9.540
    3    H3   GLY   1           3H       GLY   1   0.176  -4.592 -10.250
    4    HA2  GLY   1           1HA      GLY   1   0.090  -4.132  -7.974
    5    HA3  GLY   1           2HA      GLY   1  -1.443  -4.895  -8.367
    6    H    SER   2           H        SER   2   0.808  -4.791  -6.068
    7    HA   SER   2           HA       SER   2   0.464  -7.629  -5.351
    8    HG   SER   2           HG       SER   2   3.667  -8.090  -4.290
    9    HB2  SER   2           1HB      SER   2   2.858  -6.442  -5.784
   10    HB3  SER   2           2HB      SER   2   2.658  -6.112  -4.063
   11    H    SER   3           H        SER   3  -0.674  -8.021  -3.571
   12    HA   SER   3           HA       SER   3  -1.410  -5.778  -1.857
   13    HG   SER   3           HG       SER   3  -3.043  -8.617  -3.460
   14    HB2  SER   3           1HB      SER   3  -2.879  -7.741  -0.863
   15    HB3  SER   3           2HB      SER   3  -3.355  -6.871  -2.319
   16    H    SER   4           H        SER   4   1.074  -6.225  -1.395
   17    HA   SER   4           HA       SER   4   1.558  -8.227   0.624
   18    HG   SER   4           HG       SER   4   4.700  -8.191   0.271
   19    HB2  SER   4           1HB      SER   4   3.348  -7.210  -0.991
   20    HB3  SER   4           2HB      SER   4   3.449  -5.932   0.218
   21    H    CYS   5           H        CYS   5   0.262  -5.200   0.727
   22    HA   CYS   5           HA       CYS   5   0.793  -4.919   3.564
   23    HB2  CYS   5           1HB      CYS   5   0.263  -2.875   1.416
   24    HB3  CYS   5           2HB      CYS   5  -0.079  -2.502   3.085
   25    HA   PRO   6           HA       PRO   6  -3.515  -6.161   3.799
   26    HB2  PRO   6           1HB      PRO   6  -3.784  -6.141   6.485
   27    HB3  PRO   6           2HB      PRO   6  -2.876  -7.389   5.623
   28    HG2  PRO   6           1HG      PRO   6  -1.859  -4.937   7.023
   29    HG3  PRO   6           2HG      PRO   6  -1.252  -6.602   7.111
   30    HD2  PRO   6           1HD      PRO   6  -0.081  -4.740   5.549
   31    HD3  PRO   6           2HD      PRO   6  -0.158  -6.446   5.082
   32    H    GLN   7           H        GLN   7  -2.431  -3.068   4.750
   33    HA   GLN   7           HA       GLN   7  -4.846  -2.067   5.856
   34    HB2  GLN   7           1HB      GLN   7  -2.293  -0.787   4.880
   35    HB3  GLN   7           2HB      GLN   7  -3.691   0.159   5.264
   36    HG2  GLN   7           1HG      GLN   7  -3.118  -1.628   7.422
   37    HG3  GLN   7           2HG      GLN   7  -1.697  -0.677   6.976
   38   HE21  GLN   7          1HE2      GLN   7  -1.538   1.306   7.744
   39   HE22  GLN   7          2HE2      GLN   7  -2.812   2.207   8.486
   40    H    PHE   8           H        PHE   8  -3.362  -2.206   2.695
   41    HA   PHE   8           HA       PHE   8  -5.795  -1.101   1.500
   42    HD1  PHE   8           HD2      PHE   8  -5.511   1.893   2.119
   43    HD2  PHE   8           HD1      PHE   8  -1.718  -0.028   2.520
   44    HE1  PHE   8           HE2      PHE   8  -4.983   3.287   4.032
   45    HE2  PHE   8           HE1      PHE   8  -1.214   1.391   4.430
   46    HZ   PHE   8           HZ       PHE   8  -2.837   3.066   5.201
   47    HB2  PHE   8           1HB      PHE   8  -3.049  -0.360   0.574
   48    HB3  PHE   8           2HB      PHE   8  -4.556   0.504   0.295
   49    HA   PRO   9           HA       PRO   9  -4.708  -4.754  -0.978
   50    HB2  PRO   9           1HB      PRO   9  -6.972  -5.053  -2.379
   51    HB3  PRO   9           2HB      PRO   9  -6.873  -5.452  -0.662
   52    HG2  PRO   9           1HG      PRO   9  -8.034  -3.036  -1.979
   53    HG3  PRO   9           2HG      PRO   9  -8.622  -3.945  -0.581
   54    HD2  PRO   9           1HD      PRO   9  -7.206  -1.577  -0.406
   55    HD3  PRO   9           2HD      PRO   9  -7.329  -2.801   0.876
   56    H    SER  10           H        SER  10  -5.294  -1.682  -2.172
   57    HA   SER  10           HA       SER  10  -4.580  -2.452  -4.912
   58    HG   SER  10           HG       SER  10  -5.409   0.541  -6.136
   59    HB2  SER  10           1HB      SER  10  -6.707  -1.126  -4.465
   60    HB3  SER  10           2HB      SER  10  -5.656   0.238  -4.084
   61    H    CYS  11           H        CYS  11  -2.781  -1.682  -2.380
   62    HA   CYS  11           HA       CYS  11  -1.433   0.661  -3.066
   63    HB2  CYS  11           1HB      CYS  11  -1.295  -0.577  -0.856
   64    HB3  CYS  11           2HB      CYS  11  -0.219  -1.707  -1.647
   65    H    SER  12           H        SER  12  -0.316   1.061  -4.885
   66    HA   SER  12           HA       SER  12   0.562  -0.806  -6.728
   67    HG   SER  12           HG       SER  12   2.445   0.548  -8.286
   68    HB2  SER  12           1HB      SER  12   0.547   1.374  -7.526
   69    HB3  SER  12           2HB      SER  12   1.373   2.013  -6.121
   70    HA   PRO  13           HA       PRO  13   3.955  -2.857  -4.827
   71    HB2  PRO  13           1HB      PRO  13   5.769  -2.659  -7.025
   72    HB3  PRO  13           2HB      PRO  13   4.753  -4.047  -6.631
   73    HG2  PRO  13           1HG      PRO  13   4.338  -1.909  -8.628
   74    HG3  PRO  13           2HG      PRO  13   3.741  -3.576  -8.614
   75    HD2  PRO  13           1HD      PRO  13   2.142  -1.462  -8.154
   76    HD3  PRO  13           2HD      PRO  13   1.878  -3.033  -7.370
   77    H    SER  14           H        SER  14   4.292   0.177  -6.575
   78    HA   SER  14           HA       SER  14   6.834   0.865  -5.484
   79    HG   SER  14           HG       SER  14   7.621   2.403  -7.074
   80    HB2  SER  14           1HB      SER  14   4.794   2.207  -7.121
   81    HB3  SER  14           2HB      SER  14   5.771   3.279  -6.118
   82    H    CYS  15           H        CYS  15   3.545   1.479  -4.419
   83    HA   CYS  15           HA       CYS  15   4.489   3.124  -2.238
   84    HB2  CYS  15           1HB      CYS  15   1.708   2.207  -2.986
   85    HB3  CYS  15           2HB      CYS  15   2.074   3.238  -1.606
   86    H    ALA  16           H        ALA  16   4.705  -0.058  -2.693
   87    HA   ALA  16           HA       ALA  16   4.037  -0.632   0.121
   88    HB1  ALA  16           3HB      ALA  16   4.284  -2.975  -1.595
   89    HB2  ALA  16           1HB      ALA  16   2.967  -1.887  -2.045
   90    HB3  ALA  16           2HB      ALA  16   3.043  -2.546  -0.416
   91    HA   PRO  17           HA       PRO  17   4.368  -2.543   1.295
   92    HB2  PRO  17           1HB      PRO  17   5.666  -3.721   3.233
   93    HB3  PRO  17           2HB      PRO  17   5.784  -4.395   1.599
   94    HG2  PRO  17           1HG      PRO  17   7.722  -2.619   3.053
   95    HG3  PRO  17           2HG      PRO  17   8.053  -4.107   2.142
   96    HD2  PRO  17           1HD      PRO  17   8.298  -1.539   1.128
   97    HD3  PRO  17           2HD      PRO  17   8.078  -2.999   0.145
   98    H    GLN  18           H        GLN  18   5.890   0.221   1.615
   99    HA   GLN  18           HA       GLN  18   6.238   0.884   4.262
  100    HB2  GLN  18           1HB      GLN  18   5.945   3.115   3.712
  101    HB3  GLN  18           2HB      GLN  18   6.411   2.421   2.183
  102    HG2  GLN  18           1HG      GLN  18   4.262   2.645   1.302
  103    HG3  GLN  18           2HG      GLN  18   3.536   2.820   2.895
  104   HE21  GLN  18          1HE2      GLN  18   2.677   4.630   1.326
  105   HE22  GLN  18          2HE2      GLN  18   3.467   6.154   1.519
  106    H    CYS  19           H        CYS  19   3.353   0.169   2.591
  107    HA   CYS  19           HA       CYS  19   1.192  -0.130   3.158
  108    HB2  CYS  19           1HB      CYS  19   2.315  -0.409   5.947
  109    HB3  CYS  19           2HB      CYS  19   0.727  -0.915   5.417
  110    H    SER  20           H        SER  20   1.709   2.558   2.850
  111    HA   SER  20           HA       SER  20   0.119   3.727   5.046
  112    HG   SER  20           HG       SER  20   3.068   3.948   5.281
  113    HB2  SER  20           1HB      SER  20   1.690   5.661   3.493
  114    HB3  SER  20           2HB      SER  20   1.477   5.516   5.236
  115    H    GLN  21           H        GLN  21  -1.740   4.655   4.524
  116    HA   GLN  21           HA       GLN  21  -2.957   4.375   2.077
  117    HB2  GLN  21           1HB      GLN  21  -4.076   4.873   4.286
  118    HB3  GLN  21           2HB      GLN  21  -3.636   6.557   4.057
  119    HG2  GLN  21           1HG      GLN  21  -4.954   5.289   1.799
  120    HG3  GLN  21           2HG      GLN  21  -5.954   5.473   3.222
  121   HE21  GLN  21          1HE2      GLN  21  -7.262   7.116   2.726
  122   HE22  GLN  21          2HE2      GLN  21  -6.742   8.683   2.220
  123    H    GLN  22           H        GLN  22  -0.997   7.015   3.245
  124    HA   GLN  22           HA       GLN  22  -1.691   9.016   1.498
  125    HB2  GLN  22           1HB      GLN  22   0.920   8.383   2.838
  126    HB3  GLN  22           2HB      GLN  22   0.821   9.696   1.674
  127    HG2  GLN  22           1HG      GLN  22  -0.254  11.034   3.091
  128    HG3  GLN  22           2HG      GLN  22  -1.300   9.740   3.675
  129   HE21  GLN  22          1HE2      GLN  22   0.777  11.917   4.724
  130   HE22  GLN  22          2HE2      GLN  22   1.511  11.076   6.042
  131    H    CYS  23           H        CYS  23   0.918   6.626   0.883
  132    HA   CYS  23           HA       CYS  23   1.157   7.563  -1.822
  133    HB2  CYS  23           1HB      CYS  23   3.098   6.717  -0.476
  134    HB3  CYS  23           2HB      CYS  23   2.419   5.099  -0.601
  135    H    CYS  24           H        CYS  24   0.001   4.565  -0.280
  136    HA   CYS  24           HA       CYS  24  -0.635   3.251  -2.684
  137    HB2  CYS  24           1HB      CYS  24  -2.032   2.820  -0.038
  138    HB3  CYS  24           2HB      CYS  24  -1.856   1.690  -1.362
  139    H    GLN  25           H        GLN  25  -2.508   5.467  -0.686
  140    HA   GLN  25           HA       GLN  25  -4.819   5.077  -2.398
  141    HB2  GLN  25           1HB      GLN  25  -4.584   5.464   0.326
  142    HB3  GLN  25           2HB      GLN  25  -5.206   6.996  -0.282
  143    HG2  GLN  25           1HG      GLN  25  -6.887   5.531  -1.553
  144    HG3  GLN  25           2HG      GLN  25  -6.382   4.272  -0.431
  145   HE21  GLN  25          1HE2      GLN  25  -7.988   7.342  -0.764
  146   HE22  GLN  25          2HE2      GLN  25  -8.750   7.341   0.786
  147    H    GLN  26           H        GLN  26  -3.591   8.019  -0.944
  148    HA   GLN  26           HA       GLN  26  -4.477   9.514  -3.246
  149    HB2  GLN  26           1HB      GLN  26  -4.226  11.463  -1.987
  150    HB3  GLN  26           2HB      GLN  26  -4.671  10.279  -0.778
  151    HG2  GLN  26           1HG      GLN  26  -2.733  10.497   0.320
  152    HG3  GLN  26           2HG      GLN  26  -1.778  10.550  -1.160
  153   HE21  GLN  26          1HE2      GLN  26  -3.006  12.310   1.418
  154   HE22  GLN  26          2HE2      GLN  26  -2.632  13.897   0.846
  155    HA   PRO  27           HA       PRO  27  -0.537  10.027  -5.187
  156    HB2  PRO  27           1HB      PRO  27  -0.304  12.616  -5.844
  157    HB3  PRO  27           2HB      PRO  27  -1.553  11.588  -6.558
  158    HG2  PRO  27           1HG      PRO  27  -1.776  13.573  -4.330
  159    HG3  PRO  27           2HG      PRO  27  -2.879  13.285  -5.688
  160    HD2  PRO  27           1HD      PRO  27  -3.265  12.300  -3.161
  161    HD3  PRO  27           2HD      PRO  27  -3.920  11.549  -4.630
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  -5.440 -10.488  -5.028
    2    H2   GLY   1           2H       GLY   1  -4.607 -11.904  -5.434
    3    H3   GLY   1           3H       GLY   1  -5.868 -11.353  -6.417
    4    HA2  GLY   1           1HA      GLY   1  -3.870 -10.791  -7.523
    5    HA3  GLY   1           2HA      GLY   1  -4.558  -9.312  -6.873
    6    H    SER   2           H        SER   2  -2.668  -8.172  -6.685
    7    HA   SER   2           HA       SER   2  -0.592  -9.314  -4.940
    8    HG   SER   2           HG       SER   2   0.549  -9.690  -6.983
    9    HB2  SER   2           1HB      SER   2  -0.408  -7.022  -6.912
   10    HB3  SER   2           2HB      SER   2   0.919  -7.622  -5.918
   11    H    SER   3           H        SER   3  -0.598  -8.628  -2.912
   12    HA   SER   3           HA       SER   3  -0.780  -5.858  -2.245
   13    HG   SER   3           HG       SER   3  -2.269  -5.373  -0.243
   14    HB2  SER   3           1HB      SER   3  -3.203  -6.747  -2.535
   15    HB3  SER   3           2HB      SER   3  -2.901  -7.536  -0.990
   16    H    SER   4           H        SER   4   1.176  -6.291  -1.337
   17    HA   SER   4           HA       SER   4   1.496  -8.307   0.707
   18    HG   SER   4           HG       SER   4   3.587  -8.835   1.022
   19    HB2  SER   4           1HB      SER   4   3.388  -7.334  -0.829
   20    HB3  SER   4           2HB      SER   4   3.475  -6.080   0.403
   21    H    CYS   5           H        CYS   5   0.225  -5.286   0.736
   22    HA   CYS   5           HA       CYS   5   0.705  -4.940   3.579
   23    HB2  CYS   5           1HB      CYS   5   0.161  -2.952   1.382
   24    HB3  CYS   5           2HB      CYS   5  -0.208  -2.551   3.038
   25    HA   PRO   6           HA       PRO   6  -3.611  -6.182   3.764
   26    HB2  PRO   6           1HB      PRO   6  -3.899  -6.202   6.443
   27    HB3  PRO   6           2HB      PRO   6  -2.964  -7.430   5.579
   28    HG2  PRO   6           1HG      PRO   6  -1.990  -4.971   7.003
   29    HG3  PRO   6           2HG      PRO   6  -1.374  -6.632   7.104
   30    HD2  PRO   6           1HD      PRO   6  -0.186  -4.771   5.555
   31    HD3  PRO   6           2HD      PRO   6  -0.256  -6.477   5.088
   32    H    GLN   7           H        GLN   7  -2.508  -3.106   4.809
   33    HA   GLN   7           HA       GLN   7  -4.886  -2.098   5.919
   34    HB2  GLN   7           1HB      GLN   7  -2.447  -0.718   4.788
   35    HB3  GLN   7           2HB      GLN   7  -3.706   0.048   5.707
   36    HG2  GLN   7           1HG      GLN   7  -1.924  -0.261   7.155
   37    HG3  GLN   7           2HG      GLN   7  -3.121  -1.473   7.599
   38   HE21  GLN   7          1HE2      GLN   7  -1.101  -2.326   8.645
   39   HE22  GLN   7          2HE2      GLN   7  -0.128  -3.406   7.712
   40    H    PHE   8           H        PHE   8  -3.446  -2.223   2.733
   41    HA   PHE   8           HA       PHE   8  -5.859  -1.009   1.604
   42    HD1  PHE   8           HD2      PHE   8  -5.543   1.980   2.219
   43    HD2  PHE   8           HD1      PHE   8  -1.783  -0.007   2.633
   44    HE1  PHE   8           HE2      PHE   8  -5.003   3.362   4.137
   45    HE2  PHE   8           HE1      PHE   8  -1.266   1.409   4.543
   46    HZ   PHE   8           HZ       PHE   8  -2.865   3.104   5.314
   47    HB2  PHE   8           1HB      PHE   8  -3.101  -0.300   0.684
   48    HB3  PHE   8           2HB      PHE   8  -4.594   0.585   0.396
   49    HA   PRO   9           HA       PRO   9  -4.906  -4.611  -0.993
   50    HB2  PRO   9           1HB      PRO   9  -7.179  -4.776  -2.410
   51    HB3  PRO   9           2HB      PRO   9  -7.088  -5.258  -0.714
   52    HG2  PRO   9           1HG      PRO   9  -8.187  -2.756  -1.916
   53    HG3  PRO   9           2HG      PRO   9  -8.782  -3.703  -0.545
   54    HD2  PRO   9           1HD      PRO   9  -7.298  -1.382  -0.304
   55    HD3  PRO   9           2HD      PRO   9  -7.447  -2.644   0.936
   56    H    SER  10           H        SER  10  -5.407  -1.488  -2.099
   57    HA   SER  10           HA       SER  10  -4.697  -2.188  -4.855
   58    HG   SER  10           HG       SER  10  -7.622  -0.480  -5.250
   59    HB2  SER  10           1HB      SER  10  -5.883   0.371  -3.770
   60    HB3  SER  10           2HB      SER  10  -5.521   0.051  -5.467
   61    H    CYS  11           H        CYS  11  -2.886  -1.556  -2.292
   62    HA   CYS  11           HA       CYS  11  -1.468   0.771  -2.892
   63    HB2  CYS  11           1HB      CYS  11  -1.352  -0.551  -0.728
   64    HB3  CYS  11           2HB      CYS  11  -0.316  -1.682  -1.563
   65    H    SER  12           H        SER  12  -0.344   1.214  -4.694
   66    HA   SER  12           HA       SER  12   0.474  -0.588  -6.619
   67    HG   SER  12           HG       SER  12   2.481   0.700  -8.028
   68    HB2  SER  12           1HB      SER  12   0.576   1.617  -7.319
   69    HB3  SER  12           2HB      SER  12   1.383   2.162  -5.865
   70    HA   PRO  13           HA       PRO  13   3.724  -2.886  -4.767
   71    HB2  PRO  13           1HB      PRO  13   5.565  -2.722  -6.949
   72    HB3  PRO  13           2HB      PRO  13   4.472  -4.063  -6.602
   73    HG2  PRO  13           1HG      PRO  13   4.186  -1.848  -8.536
   74    HG3  PRO  13           2HG      PRO  13   3.497  -3.478  -8.572
   75    HD2  PRO  13           1HD      PRO  13   2.018  -1.290  -8.055
   76    HD3  PRO  13           2HD      PRO  13   1.660  -2.868  -7.320
   77    H    SER  14           H        SER  14   4.252   0.172  -6.421
   78    HA   SER  14           HA       SER  14   6.815   0.684  -5.284
   79    HG   SER  14           HG       SER  14   7.692   1.934  -6.825
   80    HB2  SER  14           1HB      SER  14   4.871   2.191  -6.902
   81    HB3  SER  14           2HB      SER  14   5.921   3.169  -5.876
   82    H    CYS  15           H        CYS  15   3.557   1.459  -4.235
   83    HA   CYS  15           HA       CYS  15   4.556   3.042  -2.042
   84    HB2  CYS  15           1HB      CYS  15   1.747   2.184  -2.756
   85    HB3  CYS  15           2HB      CYS  15   2.156   3.226  -1.397
   86    H    ALA  16           H        ALA  16   4.600  -0.186  -2.526
   87    HA   ALA  16           HA       ALA  16   3.957  -0.741   0.296
   88    HB1  ALA  16           3HB      ALA  16   3.325  -2.914  -0.290
   89    HB2  ALA  16           1HB      ALA  16   4.118  -2.803  -1.856
   90    HB3  ALA  16           2HB      ALA  16   2.638  -1.894  -1.549
   91    HA   PRO  17           HA       PRO  17   4.304  -2.630   1.512
   92    HB2  PRO  17           1HB      PRO  17   5.613  -3.821   3.427
   93    HB3  PRO  17           2HB      PRO  17   5.709  -4.496   1.793
   94    HG2  PRO  17           1HG      PRO  17   7.673  -2.730   3.225
   95    HG3  PRO  17           2HG      PRO  17   7.987  -4.221   2.314
   96    HD2  PRO  17           1HD      PRO  17   8.236  -1.657   1.292
   97    HD3  PRO  17           2HD      PRO  17   8.000  -3.118   0.314
   98    H    GLN  18           H        GLN  18   5.840   0.113   1.789
   99    HA   GLN  18           HA       GLN  18   6.195   0.743   4.461
  100    HB2  GLN  18           1HB      GLN  18   6.032   2.983   3.912
  101    HB3  GLN  18           2HB      GLN  18   6.498   2.274   2.389
  102    HG2  GLN  18           1HG      GLN  18   4.334   2.564   1.491
  103    HG3  GLN  18           2HG      GLN  18   3.648   2.887   3.078
  104   HE21  GLN  18          1HE2      GLN  18   4.500   4.281   0.277
  105   HE22  GLN  18          2HE2      GLN  18   4.825   5.890   0.818
  106    H    CYS  19           H        CYS  19   3.351   0.163   2.685
  107    HA   CYS  19           HA       CYS  19   1.166  -0.081   3.162
  108    HB2  CYS  19           1HB      CYS  19   2.152  -0.478   5.989
  109    HB3  CYS  19           2HB      CYS  19   0.590  -0.946   5.355
  110    H    SER  20           H        SER  20   1.733   2.618   2.976
  111    HA   SER  20           HA       SER  20   0.112   3.730   5.180
  112    HG   SER  20           HG       SER  20   3.081   5.925   3.468
  113    HB2  SER  20           1HB      SER  20   1.205   5.914   4.745
  114    HB3  SER  20           2HB      SER  20   2.349   4.687   5.289
  115    H    GLN  21           H        GLN  21  -1.760   4.675   4.650
  116    HA   GLN  21           HA       GLN  21  -2.954   4.427   2.196
  117    HB2  GLN  21           1HB      GLN  21  -4.083   4.943   4.396
  118    HB3  GLN  21           2HB      GLN  21  -3.620   6.621   4.165
  119    HG2  GLN  21           1HG      GLN  21  -4.936   5.368   1.899
  120    HG3  GLN  21           2HG      GLN  21  -5.945   5.559   3.315
  121   HE21  GLN  21          1HE2      GLN  21  -7.172   7.286   3.070
  122   HE22  GLN  21          2HE2      GLN  21  -6.656   8.822   2.472
  123    H    GLN  22           H        GLN  22  -0.962   7.035   3.371
  124    HA   GLN  22           HA       GLN  22  -1.619   9.047   1.617
  125    HB2  GLN  22           1HB      GLN  22   0.954   8.391   3.008
  126    HB3  GLN  22           2HB      GLN  22   0.925   9.665   1.801
  127    HG2  GLN  22           1HG      GLN  22  -1.253   9.872   3.714
  128    HG3  GLN  22           2HG      GLN  22   0.342   9.945   4.461
  129   HE21  GLN  22          1HE2      GLN  22   1.909  11.393   3.183
  130   HE22  GLN  22          2HE2      GLN  22   1.280  12.930   2.708
  131    H    CYS  23           H        CYS  23   0.985   6.644   1.035
  132    HA   CYS  23           HA       CYS  23   1.251   7.557  -1.673
  133    HB2  CYS  23           1HB      CYS  23   3.171   6.695  -0.310
  134    HB3  CYS  23           2HB      CYS  23   2.473   5.086  -0.433
  135    H    CYS  24           H        CYS  24   0.044   4.577  -0.133
  136    HA   CYS  24           HA       CYS  24  -0.588   3.271  -2.542
  137    HB2  CYS  24           1HB      CYS  24  -2.015   2.860   0.092
  138    HB3  CYS  24           2HB      CYS  24  -1.851   1.731  -1.234
  139    H    GLN  25           H        GLN  25  -2.447   5.506  -0.552
  140    HA   GLN  25           HA       GLN  25  -4.731   5.192  -2.318
  141    HB2  GLN  25           1HB      GLN  25  -4.548   5.514   0.420
  142    HB3  GLN  25           2HB      GLN  25  -5.122   7.072  -0.166
  143    HG2  GLN  25           1HG      GLN  25  -6.416   4.715  -1.310
  144    HG3  GLN  25           2HG      GLN  25  -6.683   4.973   0.410
  145   HE21  GLN  25          1HE2      GLN  25  -7.076   6.336  -2.786
  146   HE22  GLN  25          2HE2      GLN  25  -8.306   7.474  -2.366
  147    H    GLN  26           H        GLN  26  -3.476   8.069  -0.758
  148    HA   GLN  26           HA       GLN  26  -3.083  10.249  -1.588
  149    HB2  GLN  26           1HB      GLN  26  -2.488   8.443  -3.857
  150    HB3  GLN  26           2HB      GLN  26  -2.853  10.107  -4.291
  151    HG2  GLN  26           1HG      GLN  26  -1.123  10.556  -2.307
  152    HG3  GLN  26           2HG      GLN  26  -0.538   8.983  -2.850
  153   HE21  GLN  26          1HE2      GLN  26   0.433   8.797  -4.831
  154   HE22  GLN  26          2HE2      GLN  26   0.867  10.156  -5.805
  155    HA   PRO  27           HA       PRO  27  -7.467  10.377  -3.209
  156    HB2  PRO  27           1HB      PRO  27  -8.855  10.878  -0.984
  157    HB3  PRO  27           2HB      PRO  27  -8.363   9.233  -1.405
  158    HG2  PRO  27           1HG      PRO  27  -7.192  11.110   0.595
  159    HG3  PRO  27           2HG      PRO  27  -7.405   9.354   0.693
  160    HD2  PRO  27           1HD      PRO  27  -5.041  10.673   0.028
  161    HD3  PRO  27           2HD      PRO  27  -5.392   8.963  -0.285
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1   2.598 -12.285  -3.806
    2    H2   GLY   1           2H       GLY   1   3.870 -11.930  -2.749
    3    H3   GLY   1           3H       GLY   1   4.195 -12.601  -4.268
    4    HA2  GLY   1           1HA      GLY   1   4.360  -9.991  -3.727
    5    HA3  GLY   1           2HA      GLY   1   4.080 -10.652  -5.330
    6    H    SER   2           H        SER   2   3.247  -8.109  -4.675
    7    HA   SER   2           HA       SER   2   1.446  -6.728  -4.810
    8    HG   SER   2           HG       SER   2  -1.433  -9.130  -5.690
    9    HB2  SER   2           1HB      SER   2  -0.346  -7.403  -6.143
   10    HB3  SER   2           2HB      SER   2   0.933  -8.506  -6.652
   11    H    SER   3           H        SER   3  -0.515  -6.101  -3.735
   12    HA   SER   3           HA       SER   3  -1.590  -5.777  -1.722
   13    HG   SER   3           HG       SER   3  -3.752  -8.702  -0.985
   14    HB2  SER   3           1HB      SER   3  -3.207  -7.141  -2.737
   15    HB3  SER   3           2HB      SER   3  -2.212  -8.580  -2.559
   16    H    SER   4           H        SER   4   1.035  -6.221  -1.311
   17    HA   SER   4           HA       SER   4   1.449  -8.228   0.722
   18    HG   SER   4           HG       SER   4   3.566  -8.705   1.004
   19    HB2  SER   4           1HB      SER   4   3.286  -7.233  -0.856
   20    HB3  SER   4           2HB      SER   4   3.378  -5.959   0.358
   21    H    CYS   5           H        CYS   5   0.184  -5.189   0.797
   22    HA   CYS   5           HA       CYS   5   0.668  -4.910   3.643
   23    HB2  CYS   5           1HB      CYS   5   0.191  -2.862   1.486
   24    HB3  CYS   5           2HB      CYS   5  -0.183  -2.485   3.146
   25    HA   PRO   6           HA       PRO   6  -3.658  -6.098   3.805
   26    HB2  PRO   6           1HB      PRO   6  -3.971  -6.078   6.487
   27    HB3  PRO   6           2HB      PRO   6  -3.067  -7.338   5.638
   28    HG2  PRO   6           1HG      PRO   6  -2.035  -4.903   7.057
   29    HG3  PRO   6           2HG      PRO   6  -1.456  -6.577   7.152
   30    HD2  PRO   6           1HD      PRO   6  -0.230  -4.732   5.613
   31    HD3  PRO   6           2HD      PRO   6  -0.328  -6.436   5.141
   32    H    GLN   7           H        GLN   7  -2.538  -3.026   4.835
   33    HA   GLN   7           HA       GLN   7  -4.920  -1.980   5.900
   34    HB2  GLN   7           1HB      GLN   7  -2.464  -0.641   4.756
   35    HB3  GLN   7           2HB      GLN   7  -3.727   0.158   5.641
   36    HG2  GLN   7           1HG      GLN   7  -1.965  -0.121   7.116
   37    HG3  GLN   7           2HG      GLN   7  -3.173  -1.316   7.578
   38   HE21  GLN   7          1HE2      GLN   7  -1.157  -2.139   8.667
   39   HE22  GLN   7          2HE2      GLN   7  -0.183  -3.251   7.774
   40    H    PHE   8           H        PHE   8  -3.452  -2.184   2.734
   41    HA   PHE   8           HA       PHE   8  -5.857  -1.019   1.543
   42    HD1  PHE   8           HD1      PHE   8  -5.565   1.981   2.135
   43    HD2  PHE   8           HD2      PHE   8  -1.790   0.036   2.577
   44    HE1  PHE   8           HE1      PHE   8  -5.040   3.388   4.037
   45    HE2  PHE   8           HE2      PHE   8  -1.284   1.478   4.468
   46    HZ   PHE   8           HZ       PHE   8  -2.903   3.166   5.219
   47    HB2  PHE   8           1HB      PHE   8  -3.100  -0.302   0.629
   48    HB3  PHE   8           2HB      PHE   8  -4.600   0.568   0.327
   49    HA   PRO   9           HA       PRO   9  -4.804  -4.681  -0.931
   50    HB2  PRO   9           1HB      PRO   9  -7.062  -4.956  -2.346
   51    HB3  PRO   9           2HB      PRO   9  -6.977  -5.357  -0.628
   52    HG2  PRO   9           1HG      PRO   9  -8.106  -2.928  -1.950
   53    HG3  PRO   9           2HG      PRO   9  -8.708  -3.831  -0.553
   54    HD2  PRO   9           1HD      PRO   9  -7.268  -1.478  -0.374
   55    HD3  PRO   9           2HD      PRO   9  -7.409  -2.699   0.907
   56    H    SER  10           H        SER  10  -5.350  -1.606  -2.135
   57    HA   SER  10           HA       SER  10  -4.625  -2.391  -4.867
   58    HG   SER  10           HG       SER  10  -4.876   0.237  -6.142
   59    HB2  SER  10           1HB      SER  10  -6.738  -1.032  -4.431
   60    HB3  SER  10           2HB      SER  10  -5.665   0.320  -4.062
   61    H    CYS  11           H        CYS  11  -2.835  -1.638  -2.324
   62    HA   CYS  11           HA       CYS  11  -1.452   0.686  -3.012
   63    HB2  CYS  11           1HB      CYS  11  -1.346  -0.540  -0.792
   64    HB3  CYS  11           2HB      CYS  11  -0.277  -1.688  -1.568
   65    H    SER  12           H        SER  12  -0.315   1.058  -4.826
   66    HA   SER  12           HA       SER  12   0.552  -0.835  -6.647
   67    HG   SER  12           HG       SER  12   3.104   1.819  -7.276
   68    HB2  SER  12           1HB      SER  12   0.579   1.339  -7.461
   69    HB3  SER  12           2HB      SER  12   1.401   1.975  -6.052
   70    HA   PRO  13           HA       PRO  13   3.895  -2.924  -4.699
   71    HB2  PRO  13           1HB      PRO  13   5.734  -2.771  -6.879
   72    HB3  PRO  13           2HB      PRO  13   4.689  -4.139  -6.489
   73    HG2  PRO  13           1HG      PRO  13   4.332  -2.004  -8.500
   74    HG3  PRO  13           2HG      PRO  13   3.710  -3.661  -8.487
   75    HD2  PRO  13           1HD      PRO  13   2.137  -1.523  -8.053
   76    HD3  PRO  13           2HD      PRO  13   1.842  -3.086  -7.263
   77    H    SER  14           H        SER  14   4.293   0.093  -6.460
   78    HA   SER  14           HA       SER  14   6.842   0.756  -5.369
   79    HG   SER  14           HG       SER  14   4.746   3.896  -6.632
   80    HB2  SER  14           1HB      SER  14   6.612   2.830  -6.430
   81    HB3  SER  14           2HB      SER  14   5.655   1.748  -7.439
   82    H    CYS  15           H        CYS  15   3.560   1.434  -4.333
   83    HA   CYS  15           HA       CYS  15   4.505   3.068  -2.147
   84    HB2  CYS  15           1HB      CYS  15   1.721   2.188  -2.924
   85    HB3  CYS  15           2HB      CYS  15   2.081   3.206  -1.534
   86    H    ALA  16           H        ALA  16   4.667  -0.124  -2.585
   87    HA   ALA  16           HA       ALA  16   3.973  -0.666   0.229
   88    HB1  ALA  16           3HB      ALA  16   4.201  -3.025  -1.464
   89    HB2  ALA  16           1HB      ALA  16   2.905  -1.923  -1.938
   90    HB3  ALA  16           2HB      ALA  16   2.954  -2.568  -0.302
   91    HA   PRO  17           HA       PRO  17   4.268  -2.583   1.414
   92    HB2  PRO  17           1HB      PRO  17   5.530  -3.777   3.365
   93    HB3  PRO  17           2HB      PRO  17   5.656  -4.453   1.732
   94    HG2  PRO  17           1HG      PRO  17   7.602  -2.701   3.204
   95    HG3  PRO  17           2HG      PRO  17   7.924  -4.193   2.296
   96    HD2  PRO  17           1HD      PRO  17   8.209  -1.628   1.284
   97    HD3  PRO  17           2HD      PRO  17   7.982  -3.086   0.299
   98    H    GLN  18           H        GLN  18   5.819   0.162   1.748
   99    HA   GLN  18           HA       GLN  18   6.153   0.820   4.397
  100    HB2  GLN  18           1HB      GLN  18   5.893   3.055   3.844
  101    HB3  GLN  18           2HB      GLN  18   6.364   2.354   2.320
  102    HG2  GLN  18           1HG      GLN  18   4.224   2.603   1.420
  103    HG3  GLN  18           2HG      GLN  18   3.489   2.792   3.006
  104   HE21  GLN  18          1HE2      GLN  18   2.670   4.610   1.422
  105   HE22  GLN  18          2HE2      GLN  18   3.479   6.123   1.618
  106    H    CYS  19           H        CYS  19   3.273   0.141   2.704
  107    HA   CYS  19           HA       CYS  19   1.103  -0.126   3.255
  108    HB2  CYS  19           1HB      CYS  19   2.198  -0.415   6.055
  109    HB3  CYS  19           2HB      CYS  19   0.608  -0.902   5.508
  110    H    SER  20           H        SER  20   1.661   2.551   2.942
  111    HA   SER  20           HA       SER  20   0.066   3.754   5.118
  112    HG   SER  20           HG       SER  20   3.160   4.255   5.472
  113    HB2  SER  20           1HB      SER  20   1.689   5.657   3.577
  114    HB3  SER  20           2HB      SER  20   1.452   5.521   5.318
  115    H    GLN  21           H        GLN  21  -1.770   4.719   4.566
  116    HA   GLN  21           HA       GLN  21  -2.958   4.445   2.105
  117    HB2  GLN  21           1HB      GLN  21  -4.097   4.971   4.299
  118    HB3  GLN  21           2HB      GLN  21  -3.638   6.649   4.058
  119    HG2  GLN  21           1HG      GLN  21  -4.939   5.367   1.798
  120    HG3  GLN  21           2HG      GLN  21  -5.955   5.582   3.205
  121   HE21  GLN  21          1HE2      GLN  21  -7.121   7.354   3.083
  122   HE22  GLN  21          2HE2      GLN  21  -6.620   8.862   2.404
  123    H    GLN  22           H        GLN  22  -0.973   7.051   3.290
  124    HA   GLN  22           HA       GLN  22  -1.608   9.064   1.533
  125    HB2  GLN  22           1HB      GLN  22   0.968   8.385   2.913
  126    HB3  GLN  22           2HB      GLN  22   0.924   9.684   1.732
  127    HG2  GLN  22           1HG      GLN  22  -1.268  10.158   3.366
  128    HG3  GLN  22           2HG      GLN  22   0.010   9.639   4.465
  129   HE21  GLN  22          1HE2      GLN  22  -0.051  11.567   1.485
  130   HE22  GLN  22          2HE2      GLN  22   0.778  12.931   2.146
  131    H    CYS  23           H        CYS  23   0.965   6.629   0.953
  132    HA   CYS  23           HA       CYS  23   1.250   7.554  -1.751
  133    HB2  CYS  23           1HB      CYS  23   3.162   6.677  -0.383
  134    HB3  CYS  23           2HB      CYS  23   2.456   5.071  -0.512
  135    H    CYS  24           H        CYS  24   0.027   4.575  -0.219
  136    HA   CYS  24           HA       CYS  24  -0.610   3.271  -2.627
  137    HB2  CYS  24           1HB      CYS  24  -2.045   2.873   0.004
  138    HB3  CYS  24           2HB      CYS  24  -1.877   1.736  -1.313
  139    H    GLN  25           H        GLN  25  -2.456   5.522  -0.648
  140    HA   GLN  25           HA       GLN  25  -4.745   5.216  -2.413
  141    HB2  GLN  25           1HB      GLN  25  -4.556   5.539   0.325
  142    HB3  GLN  25           2HB      GLN  25  -5.129   7.098  -0.261
  143    HG2  GLN  25           1HG      GLN  25  -6.655   5.326  -1.660
  144    HG3  GLN  25           2HG      GLN  25  -6.454   4.526  -0.104
  145   HE21  GLN  25          1HE2      GLN  25  -7.257   7.688  -1.488
  146   HE22  GLN  25          2HE2      GLN  25  -8.445   8.101  -0.303
  147    H    GLN  26           H        GLN  26  -3.475   8.083  -0.855
  148    HA   GLN  26           HA       GLN  26  -3.344  10.306  -1.574
  149    HB2  GLN  26           1HB      GLN  26  -1.785  10.536  -3.219
  150    HB3  GLN  26           2HB      GLN  26  -1.519   8.867  -2.791
  151    HG2  GLN  26           1HG      GLN  26  -1.860   8.248  -4.870
  152    HG3  GLN  26           2HG      GLN  26  -3.482   8.926  -4.830
  153   HE21  GLN  26          1HE2      GLN  26  -0.365  10.567  -4.619
  154   HE22  GLN  26          2HE2      GLN  26  -0.568  11.521  -6.044
  155    HA   PRO  27           HA       PRO  27  -6.798  11.554  -4.021
  156    HB2  PRO  27           1HB      PRO  27  -5.987  13.612  -5.553
  157    HB3  PRO  27           2HB      PRO  27  -6.081  13.737  -3.793
  158    HG2  PRO  27           1HG      PRO  27  -3.694  13.245  -5.531
  159    HG3  PRO  27           2HG      PRO  27  -3.855  14.322  -4.131
  160    HD2  PRO  27           1HD      PRO  27  -2.711  11.860  -3.994
  161    HD3  PRO  27           2HD      PRO  27  -3.553  12.617  -2.628