*HEADER    PRESYNAPTIC NEUROTOXIN                  28-APR-93   1OMC      
*COMPND    OMEGA-CONOTOXIN GVIA (NMR, 21 STRUCTURES)                     
*SOURCE    (CONUS GEOGRAPHUS)                                            
*EXPDTA    NMR                                                           
*AUTHOR    J.H.DAVIS,E.K.BRADLEY,G.P.MILJANICH,L.NADASDI,                
*AUTHOR   2 J.RAMACHANDRAN,V.J.BASUS                                     
*REVDAT   1   12-OCT-04 1OMC    0   

The following is the list of restraints used to calculate the structures:

	      Atom 1		   Atom 2	 Upper   Lower   (IN ANGSTROMS)
						 Bound   Bound

CONSTRAINT   2  LYS  HN           1  CYS  HA     3.059   2.304
CONSTRAINT   2  LYS  HN           1  CYS  HB1    3.129   2.648
CONSTRAINT   2  LYS  HN           1  CYS  HB2    5.016   3.348
CONSTRAINT   2  LYS  HA           2  LYS  HN     2.989   2.438
CONSTRAINT   2  LYS  CG           2  LYS  HA     5.146   1.748
CONSTRAINT   3  SER  HN           2  LYS  HN     5.018   3.724
CONSTRAINT   3  SER  HN           2  LYS  HB1    5.080   3.496
CONSTRAINT   3  SER  HN           2  LYS  HB2    3.746   3.013
CONSTRAINT   3  SER  HN           2  LYS  CG     6.020   2.581
CONSTRAINT   5  GLY  HN           4  HYP  HA     2.792   2.280
CONSTRAINT   5  GLY  HN           4  HYP  HB2    4.271   3.372
CONSTRAINT   6  SER  HN           2  LYS  HB2    5.097   4.381
CONSTRAINT   6  SER  HN           5  GLY  HN     3.748   3.072
CONSTRAINT   6  SER  HB1          2  LYS  HB1    4.916   2.996
CONSTRAINT   6  SER  HB1          2  LYS  HB2    3.233   2.414
CONSTRAINT   6  SER  HB2          2  LYS  HB1    4.916   2.966
CONSTRAINT   6  SER  HB2          2  LYS  HB2    3.233   2.414
CONSTRAINT   7  SER  HN           6  SER  HN     5.064   4.096
CONSTRAINT   7  SER  HN           6  SER  HA     2.768   2.276
CONSTRAINT   8  CYS  HN           7  SER  HN     5.070   4.009
CONSTRAINT   8  CYS  HN           7  SER  HA     2.573   2.171
CONSTRAINT   8  CYS  HA           8  CYS  HN     3.302   2.562
CONSTRAINT   9  SER  HN           8  CYS  HA     2.934   1.302
CONSTRAINT   9  SER  HN           8  CYS  HB1    2.932   1.836
CONSTRAINT   9  SER  HA           9  SER  HN     3.047   2.009
CONSTRAINT  10  HYP  HD21         9  SER  HN     5.510   2.645
CONSTRAINT  11  THR  HN           9  SER  CB     6.062   2.442
CONSTRAINT  11  THR  HN          10  HYP  HA     4.450   2.466
CONSTRAINT  11  THR  HN          10  HYP  HB1    3.710   2.495
CONSTRAINT  11  THR  HN          10  HYP  HB2    5.054   2.617
CONSTRAINT  11  THR  HN          10  HYP  HD21   5.019   3.291
CONSTRAINT  11  THR  HB          11  THR  HN     4.079   2.936
CONSTRAINT  11  THR  HB          11  THR  HA     3.020   2.216
CONSTRAINT  11  THR  CG2         10  HYP  HB1    5.861   3.884
CONSTRAINT  11  THR  CG2         11  THR  HN     4.701   3.122
CONSTRAINT  11  THR  CG2         11  THR  HA     4.016   2.832
CONSTRAINT  12  SER  HN           9  SER  HN     4.976   2.930
CONSTRAINT  12  SER  HN           9  SER  CB     6.096   2.730
CONSTRAINT  12  SER  HN           9  SER  CB     6.084   2.456
CONSTRAINT  12  SER  HN          11  THR  HN     2.930   2.172
CONSTRAINT  12  SER  HN          11  THR  HA     3.880   2.865
CONSTRAINT  12  SER  HA          12  SER  HN     3.348   2.792
CONSTRAINT  12  SER  CB           9  SER  HN     5.295   2.521
CONSTRAINT  12  SER  CB          11  THR  HN     6.090   3.471
CONSTRAINT  12  SER  CB          12  SER  HN     4.359   2.269
CONSTRAINT  13  TYR  HN          11  THR  HA     5.095   3.638
CONSTRAINT  13  TYR  HN          13  TYR  HA     2.748   2.275
CONSTRAINT  13  TYR  HN          12  SER  HN     3.377   2.616
CONSTRAINT  13  TYR  HN          12  SER  HA     3.200   2.422
CONSTRAINT  13  TYR  HN          12  SER  CB     5.318   2.826
CONSTRAINT  13  TYR  CG          11  THR  HA     6.477   3.468
CONSTRAINT  13  TYR  CZ          11  THR  HA     6.022   3.071
CONSTRAINT  14  ASN  HN          12  SER  CB     6.067   3.055
CONSTRAINT  14  ASN  HN          13  TYR  HN     3.621   3.025
CONSTRAINT  14  ASN  HN          13  TYR  HA     3.176   2.640
CONSTRAINT  14  ASN  HN          13  TYR  HB1    4.269   3.369
CONSTRAINT  14  ASN  HN          13  TYR  HB2    5.046   3.919
CONSTRAINT  14  ASN  HB1         14  ASN  HN     3.573   2.975
CONSTRAINT  14  ASN  HB1         14  ASN  HA     2.668   2.223
CONSTRAINT  14  ASN  HB2         14  ASN  HA     2.786   2.368
CONSTRAINT  14  ASN  HD22         2  LYS  CG     5.982   2.211
CONSTRAINT  14  ASN  HD22         2  LYS  CG     5.853   2.567
CONSTRAINT  14  ASN  HD22        12  SER  CB     6.049   2.897
CONSTRAINT  15  CYS  HN          13  TYR  HN     5.499   4.187
CONSTRAINT  15  CYS  HN          14  ASN  HN     3.238   2.706
CONSTRAINT  15  CYS  HN          14  ASN  HA     3.571   2.668
CONSTRAINT  16  CYS  HN          15  CYS  HB1    5.004   3.531
CONSTRAINT  16  CYS  HN          15  CYS  HB2    3.392   2.803
CONSTRAINT  17  ARG  HN          15  CYS  HB1    4.320   3.378
CONSTRAINT  17  ARG  HN          15  CYS  HB2    3.198   2.660
CONSTRAINT  17  ARG  HN          16  CYS  HN     3.768   3.063
CONSTRAINT  17  ARG  HN          16  CYS  HB1    3.341   2.531
CONSTRAINT  17  ARG  HN          16  CYS  HB2    3.525   2.983
CONSTRAINT  17  ARG  HB1          4  HYP  HD1    4.513   1.234
CONSTRAINT  17  ARG  HB2          4  HYP  HD1    4.928   1.779
CONSTRAINT  17  ARG  CD          17  ARG  HB2    4.829   2.150
CONSTRAINT  19  CYS  HN          15  CYS  HB1    5.034   3.727
CONSTRAINT  19  CYS  HN          18  SER  HN     5.026   3.936
CONSTRAINT  19  CYS  HN          18  SER  HA     2.990   2.456
CONSTRAINT  19  CYS  HN          18  SER  CB     4.653   2.308
CONSTRAINT  19  CYS  HA          19  CYS  HN     2.950   2.400
CONSTRAINT  20  ASN  HN          19  CYS  HN     5.051   4.280
CONSTRAINT  20  ASN  HN          19  CYS  HA     2.516   2.010
CONSTRAINT  20  ASN  HN          19  CYS  HB1    5.015   3.576
CONSTRAINT  20  ASN  HN          19  CYS  HB2    4.972   3.590
CONSTRAINT  20  ASN  HA          20  ASN  HN     3.371   2.841
CONSTRAINT  20  ASN  HB2         19  CYS  HA     5.057   3.894
CONSTRAINT  20  ASN  HD21        20  ASN  HB2    3.999   2.232
CONSTRAINT  20  ASN  HD22        20  ASN  HB2    3.180   2.134
CONSTRAINT  21  HYP  CB          10  HYP  HG     6.049   2.745
CONSTRAINT  21  HYP  CD2         20  ASN  HN     6.037   3.138
CONSTRAINT  22  TYR  HN          20  ASN  HB2    5.075   3.505
CONSTRAINT  22  TYR  HN          20  ASN  HD22   5.010   2.701
CONSTRAINT  22  TYR  HN          20  ASN  HD21   5.012   3.592
CONSTRAINT  22  TYR  HN          21  HYP  HA     3.667   2.961
CONSTRAINT  22  TYR  HN          21  HYP  CB     6.062   3.208
CONSTRAINT  22  TYR  HN          21  HYP  CB     4.769   1.887
CONSTRAINT  22  TYR  HA          22  TYR  HN     3.264   2.583
CONSTRAINT  22  TYR  CB          20  ASN  HD22   5.000   0.000
CONSTRAINT  22  TYR  CB          22  TYR  HN     3.860   1.859
CONSTRAINT  23  THR  HN          20  ASN  HB1    5.087   3.238
CONSTRAINT  23  THR  HN          22  TYR  HN     2.844   2.191
CONSTRAINT  23  THR  HN          22  TYR  HA     3.531   2.920
CONSTRAINT  23  THR  HN          22  TYR  CB     3.979   1.873
CONSTRAINT  23  THR  CG2         20  ASN  HD22   4.241   2.885
CONSTRAINT  23  THR  CG2         22  TYR  HN     6.047   4.058
CONSTRAINT  23  THR  CG2         22  TYR  HA     6.033   4.150
CONSTRAINT  23  THR  CG2         23  THR  HN     4.187   3.055
CONSTRAINT  24  LYS  HN          20  ASN  HN     5.084   4.088
CONSTRAINT  24  LYS  HN          20  ASN  HB2    4.465   3.118
CONSTRAINT  24  LYS  HN          21  HYP  HA     4.901   3.413
CONSTRAINT  24  LYS  HN          22  TYR  HN     4.903   3.218
CONSTRAINT  24  LYS  HN          22  TYR  HA     5.019   4.199
CONSTRAINT  24  LYS  HN          23  THR  HN     2.657   2.096
CONSTRAINT  24  LYS  HN          23  THR  CG2    6.076   4.156
CONSTRAINT  24  LYS  HA           8  CYS  HN     4.713   3.209
CONSTRAINT  24  LYS  HA          20  ASN  HN     5.097   3.851
CONSTRAINT  24  LYS  HA          21  HYP  HA     4.500   2.500
CONSTRAINT  24  LYS  HA          23  THR  HN     5.039   3.752
CONSTRAINT  24  LYS  HA          24  LYS  HN     2.565   2.093
CONSTRAINT  24  LYS  CG           9  SER  HA     6.000   2.835
CONSTRAINT  24  LYS  CD           9  SER  HA     6.046   2.564
CONSTRAINT  24  LYS  HD1         10  HYP  HD21   4.500   2.500
CONSTRAINT  24  LYS  HD2         10  HYP  HD21   4.500   2.500
CONSTRAINT  24  LYS  CD          24  LYS  HA     5.264   2.222
CONSTRAINT  25  ARG  HN          20  ASN  HN     3.396   2.845
CONSTRAINT  25  ARG  HN          20  ASN  HB2    3.327   2.576
CONSTRAINT  25  ARG  HN          24  LYS  HN     2.994   2.494
CONSTRAINT  25  ARG  HN          24  LYS  HA     3.111   2.466
CONSTRAINT  25  ARG  HA           7  SER  HN     5.031   4.223
CONSTRAINT  25  ARG  HA           7  SER  HA     2.839   2.355
CONSTRAINT  25  ARG  HA           8  CYS  HN     3.324   2.772
CONSTRAINT  25  ARG  HB2          5  GLY  HN     4.743   3.421
CONSTRAINT  25  ARG  HB2          6  SER  HN     5.042   3.683
CONSTRAINT  25  ARG  HB2          7  SER  HA     5.555   4.318
CONSTRAINT  25  ARG  HB1          7  SER  HA     5.513   4.079
CONSTRAINT  25  ARG  HG1          7  SER  HA     4.613   3.020
CONSTRAINT  25  ARG  HG1         25  ARG  HN     5.091   2.945
CONSTRAINT  25  ARG  HG1         25  ARG  HA     3.548   2.446
CONSTRAINT  25  ARG  HG2          7  SER  HA     4.613   3.020
CONSTRAINT  25  ARG  HG2         25  ARG  HN     5.091   2.945
CONSTRAINT  25  ARG  HG2         25  ARG  HA     3.548   2.446
CONSTRAINT  26  CYS  HN           6  SER  HN     4.197   3.326
CONSTRAINT  26  CYS  HN           7  SER  HA     4.775   3.704
CONSTRAINT  26  CYS  HN           8  CYS  HN     5.028   4.255
CONSTRAINT  26  CYS  HN          19  CYS  HA     5.095   3.816
CONSTRAINT  26  CYS  HN          25  ARG  HN     5.023   3.819
CONSTRAINT  26  CYS  HN          25  ARG  HA     2.752   2.296
CONSTRAINT  26  CYS  HN          25  ARG  HB2    3.454   2.872
CONSTRAINT  26  CYS  HN          25  ARG  HB1    4.917   3.586
CONSTRAINT  26  CYS  HN          25  ARG  CG     5.908   2.664
CONSTRAINT  26  CYS  HA          19  CYS  HA     2.443   2.020
CONSTRAINT  26  CYS  HA          20  ASN  HN     3.246   2.835
CONSTRAINT  26  CYS  HB2         15  CYS  HB1    3.663   2.900
CONSTRAINT  26  CYS  HB1         15  CYS  HB1    4.956   3.394
CONSTRAINT  26  CYS  HB1         15  CYS  HB2    3.685   2.946
CONSTRAINT  27  TYR  HN          17  ARG  HB1    5.047   3.891
CONSTRAINT  27  TYR  HN          18  SER  HN     4.500   3.000
CONSTRAINT  27  TYR  HN          19  CYS  HA     3.491   3.008
CONSTRAINT  27  TYR  HN          20  ASN  HN     4.432   3.497
CONSTRAINT  27  TYR  HN          20  ASN  HB1    5.086   3.499
CONSTRAINT  27  TYR  HN          26  CYS  HA     2.769   2.336
CONSTRAINT  27  TYR  HA           4  HYP  HB2    5.029   3.505
CONSTRAINT  27  TYR  HB1         17  ARG  HB1    3.385   2.633
CONSTRAINT  27  TYR  HB1         17  ARG  HB2    4.961   3.076
CONSTRAINT  27  TYR  HB2         17  ARG  HB1    4.238   3.160
CONSTRAINT  27  TYR  CG          18  SER  CB     7.010   3.254
CONSTRAINT  27  TYR  CG          19  CYS  HN     6.451   4.714
CONSTRAINT  27  TYR  CZ          20  ASN  HA     3.821   2.200
CONSTRAINT  15  CYS  HN          14  ASN  HB2    5.073   3.890
CONSTRAINT  27  TYR  CZ          21  HYP  CD2    5.628   1.545
CONSTRAINT  27  TYR  CZ          20  ASN  HB1    4.000   0.000
CONSTRAINT  10  HYP  HA          19  CYS  HB1    5.000   1.000
CONSTRAINT  10  HYP  HA          19  CYS  HB2    5.000   1.000
CONSTRAINT  27  TYR  H2           4  HYP  HB1    3.969   2.908
CONSTRAINT  27  TYR  H2           4  HYP  HB2    3.337   2.435
CONSTRAINT  27  TYR  H2          27  TYR  HA     4.375   2.440
CONSTRAINT  27  TYR  H2          27  TYR  HB1    5.088   3.793
CONSTRAINT  27  TYR  H2          27  TYR  CG     5.464   3.234
CONSTRAINT  27  TYR  H1           4  HYP  HB1    5.479   3.182
CONSTRAINT  27  TYR  H1           4  HYP  HB2    4.531   2.704
CONSTRAINT  27  TYR  H1           4  HYP  HD1    5.000   3.298
CONSTRAINT  27  TYR  H1          17  ARG  HB1    5.003   3.773
CONSTRAINT  27  TYR  H1          17  ARG  HB2    5.075   3.267
CONSTRAINT  27  TYR  H1          27  TYR  HN     5.080   4.349
CONSTRAINT  27  TYR  H1          27  TYR  HA     2.676   1.917
CONSTRAINT  27  TYR  H1          27  TYR  HB1    3.826   2.544
CONSTRAINT  27  TYR  H1          27  TYR  CG     4.982   3.054

PHI ANGLE CONSTRAINTS:

The following residues had PHI constrained to -65 deg. +/- 25 deg.

Residue   HA-HN Coupling Constant

SER 6		5.4
SER 7		4.0
CYS 16		4.3
CYS 26		2.8
TYR 27		5.0

The following residues had PHI constrained to -120 deg. +/- 40 deg.

THR 11		8.7
ASN 14		8.5
ARG 25		9.7

CHI-1 ANGLE CONSTRAINTS:

Where CHI-1 angles were determined, they were constrained into one
rotamer, with an allowed variation of +/- 20 deg. (+/- 40 deg.
for HYP residues).  For a definition of nomenclature for rotamer
description, see Methods in Enzymology, Vol. 177 (1989), Pg. 145.

Residue   Rotamer

CYS 1	   g2g3
LYS 2	   t2g3
HYP 4	   t2g3
CYS 8	   g2g3
HYP 10	   t2g3
TYR 13	   t2g3
CYS 15	   t2g3
CYS 16	   t2g3
ARG 17	   t2g3
CYS 19	   g2t3
ASN 20	   g2t3
LYS 24	   t2g3
ARG 25	   t2g3
CYS 26	   t2g3
TYR 27	   t2g3

  Entry H atom name         Submitted Coord H atom name

  Start of MODEL    1
    1   1H    CYS   1          1H        CYS   1  10.996  -1.261  -1.261
    2   2H    CYS   1          2H        CYS   1  10.976  -1.364  -1.364
    3   3H    CYS   1          3H        CYS   1  10.741  -2.577  -2.577
    4    HA   CYS   1           HA       CYS   1   8.892  -0.308  -0.308
    5   1HB   CYS   1          1HB       CYS   1   7.521  -1.421  -1.421
    6   2HB   CYS   1          2HB       CYS   1   9.158  -1.673  -1.673
    7    H    LYS   2           H        LYS   2   6.638  -1.197  -1.197
    8    HA   LYS   2           HA       LYS   2   6.663  -3.264  -3.264
    9   1HB   LYS   2          1HB       LYS   2   4.602  -1.268  -1.268
   10   2HB   LYS   2          2HB       LYS   2   4.165  -2.712  -2.712
   11   1HG   LYS   2          1HG       LYS   2   5.833  -2.134  -2.134
   12   2HG   LYS   2          2HG       LYS   2   6.315  -0.709  -0.709
   13   1HD   LYS   2          1HD       LYS   2   4.033   0.207   0.207
   14   2HD   LYS   2          2HD       LYS   2   3.556  -1.215  -1.215
   15   1HE   LYS   2          1HE       LYS   2   5.118  -0.650  -0.650
   16   2HE   LYS   2          2HE       LYS   2   5.834   0.644   0.644
   17   1HZ   LYS   2          1HZ       LYS   2   3.045   0.629   0.629
   18   2HZ   LYS   2          2HZ       LYS   2   4.097   1.510   1.510
   19   3HZ   LYS   2          3HZ       LYS   2   3.647   1.718   1.718
   20    H    SER   3           H        SER   3   6.008  -5.134  -5.134
   21    HA   SER   3           HA       SER   3   5.362  -6.627  -6.627
   22   1HB   SER   3          1HB       SER   3   4.253  -7.185  -7.185
   23   2HB   SER   3          2HB       SER   3   4.831  -8.359  -8.359
   24    HG   SER   3           HG       SER   3   6.359  -8.106  -8.106
   25    HA   HYP   4           HA       HYP   4   0.985  -5.784  -5.784
   26   1HB   HYP   4          1HB       HYP   4   1.272  -8.751  -8.751
   27   2HB   HYP   4          2HB       HYP   4   0.405  -7.513  -7.513
   28    HG   HYP   4           HG       HYP   4   2.818  -8.299  -8.299
   29    HD1  HYP   4           HD1      HYP   4   3.380  -6.161  -6.161
   30   1HD2  HYP   4          1HD2      HYP   4   4.233  -6.248  -6.248
   31   2HD2  HYP   4          2HD2      HYP   4   4.233  -7.930  -7.930
   32    H    GLY   5           H        GLY   5  -0.933  -6.122  -6.122
   33   1HA   GLY   5          1HA       GLY   5  -2.473  -6.716  -6.716
   34   2HA   GLY   5          2HA       GLY   5  -1.315  -7.900  -7.900
   35    H    SER   6           H        SER   6   0.705  -5.577  -5.577
   36    HA   SER   6           HA       SER   6   0.247  -5.114  -5.114
   37   1HB   SER   6          1HB       SER   6   2.469  -3.958  -3.958
   38   2HB   SER   6          2HB       SER   6   2.429  -4.055  -4.055
   39    HG   SER   6           HG       SER   6   3.753  -5.788  -5.788
   40    H    SER   7           H        SER   7  -0.019  -3.603  -3.603
   41    HA   SER   7           HA       SER   7  -1.635  -1.412  -1.412
   42   1HB   SER   7          1HB       SER   7   0.118  -2.047  -2.047
   43   2HB   SER   7          2HB       SER   7  -1.164  -0.823  -0.823
   44    HG   SER   7           HG       SER   7  -1.925  -2.882  -2.882
   45    H    CYS   8           H        CYS   8  -1.056   0.217   0.217
   46    HA   CYS   8           HA       CYS   8   1.488   1.633   1.633
   47   1HB   CYS   8          1HB       CYS   8   1.394   1.791   1.791
   48   2HB   CYS   8          2HB       CYS   8   1.700   0.164   0.164
   49    H    SER   9           H        SER   9   1.419   3.761   3.761
   50    HA   SER   9           HA       SER   9  -1.111   5.154   5.154
   51   1HB   SER   9          1HB       SER   9   0.465   7.159   7.159
   52   2HB   SER   9          2HB       SER   9   0.286   6.409   6.409
   53    HG   SER   9           HG       SER   9   2.566   6.734   6.734
   54    HA   HYP  10           HA       HYP  10  -2.318   4.742   4.742
   55   1HB   HYP  10          1HB       HYP  10  -3.688   7.354   7.354
   56   2HB   HYP  10          2HB       HYP  10  -4.332   5.969   5.969
   57    HG   HYP  10           HG       HYP  10  -4.955   6.179   6.179
   58    HD1  HYP  10           HD1      HYP  10  -4.819   3.829   3.829
   59   1HD2  HYP  10          1HD2      HYP  10  -2.853   4.788   4.788
   60   2HD2  HYP  10          2HD2      HYP  10  -2.820   6.558   6.558
   61    H    THR  11           H        THR  11  -1.540   8.100   8.100
   62    HA   THR  11           HA       THR  11  -1.038   8.989   8.989
   63    HB   THR  11           HB       THR  11   0.135  10.932  10.932
   64    HG1  THR  11           HG1      THR  11  -0.221  11.095  11.095
   65   1HG2  THR  11          1HG2      THR  11  -2.731  10.240  10.240
   66   2HG2  THR  11          2HG2      THR  11  -2.014  11.859  11.859
   67   3HG2  THR  11          3HG2      THR  11  -2.212  11.017  11.017
   68    H    SER  12           H        SER  12   1.280   7.891   7.891
   69    HA   SER  12           HA       SER  12   3.632   8.588   8.588
   70   1HB   SER  12          1HB       SER  12   4.655   6.911   6.911
   71   2HB   SER  12          2HB       SER  12   3.872   8.364   8.364
   72    HG   SER  12           HG       SER  12   3.198   6.396   6.396
   73    H    TYR  13           H        TYR  13   1.478   5.960   5.960
   74    HA   TYR  13           HA       TYR  13   1.470   3.828   3.828
   75   1HB   TYR  13          1HB       TYR  13   2.787   5.533   5.533
   76   2HB   TYR  13          2HB       TYR  13   2.284   3.855   3.855
   77    HD1  TYR  13           HD2      TYR  13  -0.222   3.258   3.258
   78    HD2  TYR  13           HD1      TYR  13   1.313   7.314   7.314
   79    HE1  TYR  13           HE2      TYR  13  -2.541   4.129   4.129
   80    HE2  TYR  13           HE1      TYR  13  -1.008   8.186   8.186
   81    HH   TYR  13           HH       TYR  13  -3.850   5.880   5.880
   82    H    ASN  14           H        ASN  14   3.289   3.733   3.733
   83    HA   ASN  14           HA       ASN  14   5.907   3.028   3.028
   84   1HB   ASN  14          1HB       ASN  14   6.484   2.789   2.789
   85   2HB   ASN  14          2HB       ASN  14   5.886   4.373   4.373
   86   1HD2  ASN  14          1HD2      ASN  14   5.770   2.151   2.151
   87   2HD2  ASN  14          2HD2      ASN  14   4.363   2.552   2.552
   88    H    CYS  15           H        CYS  15   4.091   1.234   1.234
   89    HA   CYS  15           HA       CYS  15   4.753  -1.367  -1.367
   90   1HB   CYS  15          1HB       CYS  15   2.542  -0.635  -0.635
   91   2HB   CYS  15          2HB       CYS  15   2.779  -2.202  -2.202
   92    H    CYS  16           H        CYS  16   5.368  -3.043  -3.043
   93    HA   CYS  16           HA       CYS  16   6.667  -2.355  -2.355
   94   1HB   CYS  16          1HB       CYS  16   5.883  -4.924  -4.924
   95   2HB   CYS  16          2HB       CYS  16   6.430  -4.837  -4.837
   96    H    ARG  17           H        ARG  17   3.512  -3.883  -3.883
   97    HA   ARG  17           HA       ARG  17   2.464  -2.567  -2.567
   98   1HB   ARG  17          1HB       ARG  17   1.213  -4.819  -4.819
   99   2HB   ARG  17          2HB       ARG  17   0.487  -4.002  -4.002
  100   1HG   ARG  17          1HG       ARG  17   2.399  -4.818  -4.818
  101   2HG   ARG  17          2HG       ARG  17   2.960  -5.749  -5.749
  102   1HD   ARG  17          1HD       ARG  17   0.125  -6.062  -6.062
  103   2HD   ARG  17          2HD       ARG  17   1.456  -6.946  -6.946
  104    HE   ARG  17           HE       ARG  17   1.764  -7.368  -7.368
  105   1HH1  ARG  17          1HH1      ARG  17  -0.832  -8.269  -8.269
  106   2HH1  ARG  17          2HH1      ARG  17  -1.312  -9.508  -9.508
  107   1HH2  ARG  17          1HH2      ARG  17   1.068  -9.176  -9.176
  108   2HH2  ARG  17          2HH2      ARG  17  -0.255 -10.013 -10.013
  109    H    SER  18           H        SER  18   1.321  -0.948  -0.948
  110    HA   SER  18           HA       SER  18   1.361   0.840   0.840
  111   1HB   SER  18          1HB       SER  18  -0.439   2.035   2.035
  112   2HB   SER  18          2HB       SER  18   0.621   1.283   1.283
  113    HG   SER  18           HG       SER  18  -1.684   0.904   0.904
  114    H    CYS  19           H        CYS  19   0.120   1.766   1.766
  115    HA   CYS  19           HA       CYS  19  -1.340   0.036   0.036
  116   1HB   CYS  19          1HB       CYS  19   0.250   1.975   1.975
  117   2HB   CYS  19          2HB       CYS  19  -1.096   3.050   3.050
  118    H    ASN  20           H        ASN  20  -3.443  -0.375  -0.375
  119    HA   ASN  20           HA       ASN  20  -5.278   0.969   0.969
  120   1HB   ASN  20          1HB       ASN  20  -5.605  -1.366  -1.366
  121   2HB   ASN  20          2HB       ASN  20  -5.843  -0.796  -0.796
  122   1HD2  ASN  20          1HD2      ASN  20  -7.831  -2.244  -2.244
  123   2HD2  ASN  20          2HD2      ASN  20  -9.155  -1.363  -1.363
  124    HA   HYP  21           HA       HYP  21  -5.506   4.539   4.539
  125   1HB   HYP  21          1HB       HYP  21  -7.718   5.322   5.322
  126   2HB   HYP  21          2HB       HYP  21  -6.238   6.205   6.205
  127    HG   HYP  21           HG       HYP  21  -6.360   5.083   5.083
  128    HD1  HYP  21           HD1      HYP  21  -4.082   4.422   4.422
  129   1HD2  HYP  21          1HD2      HYP  21  -5.514   2.544   2.544
  130   2HD2  HYP  21          2HD2      HYP  21  -7.232   2.887   2.887
  131    H    TYR  22           H        TYR  22  -8.421   2.789   2.789
  132    HA   TYR  22           HA       TYR  22 -10.043   3.872   3.872
  133   1HB   TYR  22          1HB       TYR  22 -10.319   1.337   1.337
  134   2HB   TYR  22          2HB       TYR  22 -11.561   1.983   1.983
  135    HD1  TYR  22           HD2      TYR  22 -12.771   4.102   4.102
  136    HD2  TYR  22           HD1      TYR  22  -9.945   2.234   2.234
  137    HE1  TYR  22           HE2      TYR  22 -13.176   5.921   5.921
  138    HE2  TYR  22           HE1      TYR  22 -10.319   4.077   4.077
  139    HH   TYR  22           HH       TYR  22 -12.533   6.886   6.886
  140    H    THR  23           H        THR  23  -7.994   1.062   1.062
  141    HA   THR  23           HA       THR  23  -8.977   0.206   0.206
  142    HB   THR  23           HB       THR  23  -7.943  -1.982  -1.982
  143    HG1  THR  23           HG1      THR  23  -7.211  -2.388  -2.388
  144   1HG2  THR  23          1HG2      THR  23  -9.870  -1.011  -1.011
  145   2HG2  THR  23          2HG2      THR  23  -9.509  -2.702  -2.702
  146   3HG2  THR  23          3HG2      THR  23 -10.325  -1.679  -1.679
  147    H    LYS  24           H        LYS  24  -6.190   1.651   1.651
  148    HA   LYS  24           HA       LYS  24  -4.173   2.230   2.230
  149   1HB   LYS  24          1HB       LYS  24  -5.679   1.428   1.428
  150   2HB   LYS  24          2HB       LYS  24  -3.929   1.685   1.685
  151   1HG   LYS  24          1HG       LYS  24  -4.929   3.725   3.725
  152   2HG   LYS  24          2HG       LYS  24  -4.299   3.939   3.939
  153   1HD   LYS  24          1HD       LYS  24  -6.389   5.085   5.085
  154   2HD   LYS  24          2HD       LYS  24  -6.592   3.697   3.697
  155   1HE   LYS  24          1HE       LYS  24  -7.600   2.417   2.417
  156   2HE   LYS  24          2HE       LYS  24  -7.467   3.859   3.859
  157   1HZ   LYS  24          1HZ       LYS  24  -9.050   3.734   3.734
  158   2HZ   LYS  24          2HZ       LYS  24  -9.634   3.734   3.734
  159   3HZ   LYS  24          3HZ       LYS  24  -8.938   4.948   4.948
  160    H    ARG  25           H        ARG  25  -4.548  -0.284  -0.284
  161    HA   ARG  25           HA       ARG  25  -2.476  -2.011  -2.011
  162   1HB   ARG  25          1HB       ARG  25  -5.270  -2.787  -2.787
  163   2HB   ARG  25          2HB       ARG  25  -3.941  -3.959  -3.959
  164   1HG   ARG  25          1HG       ARG  25  -3.605  -3.764  -3.764
  165   2HG   ARG  25          2HG       ARG  25  -4.668  -2.350  -2.350
  166   1HD   ARG  25          1HD       ARG  25  -5.917  -4.793  -4.793
  167   2HD   ARG  25          2HD       ARG  25  -5.484  -4.893  -4.893
  168    HE   ARG  25           HE       ARG  25  -6.646  -2.525  -2.525
  169   1HH1  ARG  25          1HH2      ARG  25  -7.972  -5.311  -5.311
  170   2HH1  ARG  25          2HH2      ARG  25  -9.524  -4.846  -4.846
  171   1HH2  ARG  25          1HH1      ARG  25  -8.787  -1.960  -1.960
  172   2HH2  ARG  25          2HH1      ARG  25  -9.984  -2.953  -2.953
  173    H    CYS  26           H        CYS  26  -1.124  -2.779  -2.779
  174    HA   CYS  26           HA       CYS  26  -0.929  -1.823  -1.823
  175   1HB   CYS  26          1HB       CYS  26   0.390  -4.274  -4.274
  176   2HB   CYS  26          2HB       CYS  26   0.928  -3.371  -3.371
  177    H    TYR  27           H        TYR  27  -1.651  -2.593  -2.593
  178    HA   TYR  27           HA       TYR  27  -3.352  -4.841  -4.841
  179   1HB   TYR  27          1HB       TYR  27  -1.939  -3.258  -3.258
  180   2HB   TYR  27          2HB       TYR  27  -3.006  -4.631  -4.631
  181    HD1  TYR  27           HD2      TYR  27  -5.367  -4.306  -4.306
  182    HD2  TYR  27           HD1      TYR  27  -2.868  -1.320  -1.320
  183    HE1  TYR  27           HE2      TYR  27  -7.359  -2.796  -2.796
  184    HE2  TYR  27           HE1      TYR  27  -4.842   0.211   0.211
  185    HH   TYR  27           HH       TYR  27  -8.133  -0.821  -0.821
  186   1H    NH2  28          1H1       TYR  27  -2.995  -6.898  -6.898
  187   2H    NH2  28          2H1       TYR  27  -1.532  -7.625  -7.625

  Start of MODEL    2
    1   1H    CYS   1          1H        CYS  28  10.981  -1.239  -1.239
    2   2H    CYS   1          2H        CYS  28  10.965  -1.808  -1.808
    3   3H    CYS   1          3H        CYS  28  10.894  -2.714  -2.714
    4    HA   CYS   1           HA       CYS  28   8.764  -0.841  -0.841
    5   1HB   CYS   1          1HB       CYS  28   7.483  -1.785  -1.785
    6   2HB   CYS   1          2HB       CYS  28   9.046  -1.226  -1.226
    7    H    LYS   2           H        LYS  29   6.846  -1.636  -1.636
    8    HA   LYS   2           HA       LYS  29   7.082  -3.900  -3.900
    9   1HB   LYS   2          1HB       LYS  29   5.308  -1.533  -1.533
   10   2HB   LYS   2          2HB       LYS  29   4.739  -2.968  -2.968
   11   1HG   LYS   2          1HG       LYS  29   7.382  -1.595  -1.595
   12   2HG   LYS   2          2HG       LYS  29   5.881  -1.249  -1.249
   13   1HD   LYS   2          1HD       LYS  29   5.734  -3.618  -3.618
   14   2HD   LYS   2          2HD       LYS  29   7.238  -3.960  -3.960
   15   1HE   LYS   2          1HE       LYS  29   8.462  -2.443  -2.443
   16   2HE   LYS   2          2HE       LYS  29   6.960  -2.068  -2.068
   17   1HZ   LYS   2          1HZ       LYS  29   8.127  -4.739  -4.739
   18   2HZ   LYS   2          2HZ       LYS  29   8.162  -3.888  -3.888
   19   3HZ   LYS   2          3HZ       LYS  29   6.863  -4.425  -4.425
   20    H    SER   3           H        SER  30   5.838  -5.642  -5.642
   21    HA   SER   3           HA       SER  30   5.265  -6.871  -6.871
   22   1HB   SER   3          1HB       SER  30   4.302  -8.691  -8.691
   23   2HB   SER   3          2HB       SER  30   5.847  -8.122  -8.122
   24    HG   SER   3           HG       SER  30   4.216  -8.428  -8.428
   25    HA   HYP   4           HA       HYP  31   0.959  -5.979  -5.979
   26   1HB   HYP   4          1HB       HYP  31   0.969  -8.972  -8.972
   27   2HB   HYP   4          2HB       HYP  31   0.289  -7.685  -7.685
   28    HG   HYP   4           HG       HYP  31   2.588  -8.727  -8.727
   29    HD1  HYP   4           HD1      HYP  31   3.440  -6.631  -6.631
   30   1HD2  HYP   4          1HD2      HYP  31   4.305  -7.039  -7.039
   31   2HD2  HYP   4          2HD2      HYP  31   3.861  -8.610  -8.610
   32    H    GLY   5           H        GLY  32  -0.651  -5.876  -5.876
   33   1HA   GLY   5          1HA       GLY  32  -2.236  -6.652  -6.652
   34   2HA   GLY   5          2HA       GLY  32  -1.015  -7.803  -7.803
   35    H    SER   6           H        SER  33   1.063  -5.655  -5.655
   36    HA   SER   6           HA       SER  33   0.695  -4.905  -4.905
   37   1HB   SER   6          1HB       SER  33   2.829  -3.929  -3.929
   38   2HB   SER   6          2HB       SER  33   2.900  -5.416  -5.416
   39    HG   SER   6           HG       SER  33   4.031  -3.619  -3.619
   40    H    SER   7           H        SER  34   0.948  -2.744  -2.744
   41    HA   SER   7           HA       SER  34  -1.113  -1.013  -1.013
   42   1HB   SER   7          1HB       SER  34  -0.245   0.422   0.422
   43   2HB   SER   7          2HB       SER  34  -0.631  -1.247  -1.247
   44    HG   SER   7           HG       SER  34   1.461  -0.546  -0.546
   45    H    CYS   8           H        CYS  35  -1.086   0.970   0.970
   46    HA   CYS   8           HA       CYS  35   1.179   2.512   2.512
   47   1HB   CYS   8          1HB       CYS  35   0.653   2.415   2.415
   48   2HB   CYS   8          2HB       CYS  35   1.049   0.799   0.799
   49    H    SER   9           H        SER  36   0.628   4.447   4.447
   50    HA   SER   9           HA       SER  36  -1.885   5.575   5.575
   51   1HB   SER   9          1HB       SER  36   0.096   6.579   6.579
   52   2HB   SER   9          2HB       SER  36   0.826   6.804   6.804
   53    HG   SER   9           HG       SER  36  -0.122   8.829   8.829
   54    HA   HYP  10           HA       HYP  37  -3.278   6.715   6.715
   55   1HB   HYP  10          1HB       HYP  37  -4.110   9.316   9.316
   56   2HB   HYP  10          2HB       HYP  37  -5.088   8.140   8.140
   57    HG   HYP  10           HG       HYP  37  -5.106   8.494   8.494
   58    HD1  HYP  10           HD1      HYP  37  -6.354   6.474   6.474
   59   1HD2  HYP  10          1HD2      HYP  37  -4.075   5.845   5.845
   60   2HD2  HYP  10          2HD2      HYP  37  -3.358   7.311   7.311
   61    H    THR  11           H        THR  38  -1.289   8.771   8.771
   62    HA   THR  11           HA       THR  38  -0.264  10.315  10.315
   63    HB   THR  11           HB       THR  38   1.046  11.530  11.530
   64    HG1  THR  11           HG1      THR  38   0.267  11.356  11.356
   65   1HG2  THR  11          1HG2      THR  38  -1.990  11.586  11.586
   66   2HG2  THR  11          2HG2      THR  38  -0.896  12.868  12.868
   67   3HG2  THR  11          3HG2      THR  38  -1.015  12.474  12.474
   68    H    SER  12           H        SER  39   0.614   7.487   7.487
   69    HA   SER  12           HA       SER  39   3.358   7.583   7.583
   70   1HB   SER  12          1HB       SER  39   2.710   6.631   6.631
   71   2HB   SER  12          2HB       SER  39   4.261   6.439   6.439
   72    HG   SER  12           HG       SER  39   4.247   8.364   8.364
   73    H    TYR  13           H        TYR  40   2.845   6.260   6.260
   74    HA   TYR  13           HA       TYR  40   1.614   3.670   3.670
   75   1HB   TYR  13          1HB       TYR  40   3.051   5.083   5.083
   76   2HB   TYR  13          2HB       TYR  40   2.213   3.528   3.528
   77    HD1  TYR  13           HD2      TYR  40   1.717   7.214   7.214
   78    HD2  TYR  13           HD1      TYR  40  -0.138   3.377   3.377
   79    HE1  TYR  13           HE2      TYR  40  -0.533   8.325   8.325
   80    HE2  TYR  13           HE1      TYR  40  -2.386   4.474   4.474
   81    HH   TYR  13           HH       TYR  40  -2.737   8.066   8.066
   82    H    ASN  14           H        ASN  41   3.350   3.466   3.466
   83    HA   ASN  14           HA       ASN  41   6.019   2.743   2.743
   84   1HB   ASN  14          1HB       ASN  41   6.194   2.220   2.220
   85   2HB   ASN  14          2HB       ASN  41   5.513   3.825   3.825
   86   1HD2  ASN  14          1HD2      ASN  41   4.597   0.517   0.517
   87   2HD2  ASN  14          2HD2      ASN  41   3.247   0.895   0.895
   88    H    CYS  15           H        CYS  42   4.363   1.134   1.134
   89    HA   CYS  15           HA       CYS  42   4.408  -1.570  -1.570
   90   1HB   CYS  15          1HB       CYS  42   2.451  -0.313  -0.313
   91   2HB   CYS  15          2HB       CYS  42   2.415  -1.993  -1.993
   92    H    CYS  16           H        CYS  43   5.050  -3.150  -3.150
   93    HA   CYS  16           HA       CYS  43   6.629  -3.016  -3.016
   94   1HB   CYS  16          1HB       CYS  43   5.218  -5.366  -5.366
   95   2HB   CYS  16          2HB       CYS  43   6.504  -5.417  -5.417
   96    H    ARG  17           H        ARG  44   3.260  -4.197  -4.197
   97    HA   ARG  17           HA       ARG  44   2.725  -3.015  -3.015
   98   1HB   ARG  17          1HB       ARG  44   1.166  -5.190  -5.190
   99   2HB   ARG  17          2HB       ARG  44   0.679  -4.406  -4.406
  100   1HG   ARG  17          1HG       ARG  44   2.747  -5.227  -5.227
  101   2HG   ARG  17          2HG       ARG  44   3.185  -6.047  -6.047
  102   1HD   ARG  17          1HD       ARG  44   0.689  -6.629  -6.629
  103   2HD   ARG  17          2HD       ARG  44   2.183  -7.580  -7.580
  104    HE   ARG  17           HE       ARG  44   1.645  -7.706  -7.706
  105   1HH1  ARG  17          1HH2      ARG  44  -0.607  -8.231  -8.231
  106   2HH1  ARG  17          2HH2      ARG  44  -1.579  -9.203  -9.203
  107   1HH2  ARG  17          1HH1      ARG  44   0.152  -8.916  -8.916
  108   2HH2  ARG  17          2HH1      ARG  44  -1.151  -9.587  -9.587
  109    H    SER  18           H        SER  45   1.695  -1.286  -1.286
  110    HA   SER  18           HA       SER  45   1.582   0.643   0.643
  111   1HB   SER  18          1HB       SER  45  -0.428   1.575   1.575
  112   2HB   SER  18          2HB       SER  45   0.917   1.051   1.051
  113    HG   SER  18           HG       SER  45  -1.187   0.305   0.305
  114    H    CYS  19           H        CYS  46   0.300   1.834   1.834
  115    HA   CYS  19           HA       CYS  46  -1.145   0.371   0.371
  116   1HB   CYS  19          1HB       CYS  46  -0.005   2.578   2.578
  117   2HB   CYS  19          2HB       CYS  46  -1.346   3.348   3.348
  118    H    ASN  20           H        ASN  47  -3.283  -0.076  -0.076
  119    HA   ASN  20           HA       ASN  47  -5.256   1.312   1.312
  120   1HB   ASN  20          1HB       ASN  47  -5.610  -1.127  -1.127
  121   2HB   ASN  20          2HB       ASN  47  -5.746  -0.847  -0.847
  122   1HD2  ASN  20          1HD2      ASN  47  -7.927  -1.997  -1.997
  123   2HD2  ASN  20          2HD2      ASN  47  -9.181  -0.951  -0.951
  124    HA   HYP  21           HA       HYP  48  -5.277   4.493   4.493
  125   1HB   HYP  21          1HB       HYP  48  -7.611   5.096   5.096
  126   2HB   HYP  21          2HB       HYP  48  -6.525   6.237   6.237
  127    HG   HYP  21           HG       HYP  48  -5.997   5.649   5.649
  128    HD1  HYP  21           HD1      HYP  48  -3.631   5.550   5.550
  129   1HD2  HYP  21          1HD2      HYP  48  -4.538   3.382   3.382
  130   2HD2  HYP  21          2HD2      HYP  48  -6.291   3.292   3.292
  131    H    TYR  22           H        TYR  49  -8.063   2.667   2.667
  132    HA   TYR  22           HA       TYR  49  -9.768   3.492   3.492
  133   1HB   TYR  22          1HB       TYR  49 -10.247   1.528   1.528
  134   2HB   TYR  22          2HB       TYR  49 -11.478   2.205   2.205
  135    HD1  TYR  22           HD1      TYR  49 -10.945   5.103   5.103
  136    HD2  TYR  22           HD2      TYR  49 -10.501   2.288   2.288
  137    HE1  TYR  22           HE1      TYR  49 -11.505   6.916   6.916
  138    HE2  TYR  22           HE2      TYR  49 -11.087   4.110   4.110
  139    HH   TYR  22           HH       TYR  49 -11.956   6.062   6.062
  140    H    THR  23           H        THR  50  -8.027   0.547   0.547
  141    HA   THR  23           HA       THR  50  -9.062  -0.683  -0.683
  142    HB   THR  23           HB       THR  50  -7.325  -2.447  -2.447
  143    HG1  THR  23           HG1      THR  50  -6.263  -2.403  -2.403
  144   1HG2  THR  23          1HG2      THR  50  -9.219  -1.835  -1.835
  145   2HG2  THR  23          2HG2      THR  50  -8.444  -3.395  -3.395
  146   3HG2  THR  23          3HG2      THR  50  -9.625  -2.741  -2.741
  147    H    LYS  24           H        LYS  51  -6.481   1.312   1.312
  148    HA   LYS  24           HA       LYS  51  -4.560   2.152   2.152
  149   1HB   LYS  24          1HB       LYS  51  -5.477   0.944   0.944
  150   2HB   LYS  24          2HB       LYS  51  -4.073   2.004   2.004
  151   1HG   LYS  24          1HG       LYS  51  -6.774   2.930   2.930
  152   2HG   LYS  24          2HG       LYS  51  -6.370   2.969   2.969
  153   1HD   LYS  24          1HD       LYS  51  -4.321   4.309   4.309
  154   2HD   LYS  24          2HD       LYS  51  -4.945   4.403   4.403
  155   1HE   LYS  24          1HE       LYS  51  -6.533   5.313   5.313
  156   2HE   LYS  24          2HE       LYS  51  -5.463   6.392   6.392
  157   1HZ   LYS  24          1HZ       LYS  51  -7.761   5.011   5.011
  158   2HZ   LYS  24          2HZ       LYS  51  -7.731   6.470   6.470
  159   3HZ   LYS  24          3HZ       LYS  51  -6.861   5.919   5.919
  160    H    ARG  25           H        ARG  52  -4.809  -0.591  -0.591
  161    HA   ARG  25           HA       ARG  52  -2.389  -1.921  -1.921
  162   1HB   ARG  25          1HB       ARG  52  -4.916  -3.145  -3.145
  163   2HB   ARG  25          2HB       ARG  52  -3.406  -4.038  -4.038
  164   1HG   ARG  25          1HG       ARG  52  -3.552  -3.691  -3.691
  165   2HG   ARG  25          2HG       ARG  52  -4.987  -2.672  -2.672
  166   1HD   ARG  25          1HD       ARG  52  -5.652  -4.917  -4.917
  167   2HD   ARG  25          2HD       ARG  52  -6.208  -4.618  -4.618
  168    HE   ARG  25           HE       ARG  52  -3.702  -6.049  -6.049
  169   1HH1  ARG  25          1HH1      ARG  52  -6.962  -6.376  -6.376
  170   2HH1  ARG  25          2HH1      ARG  52  -6.626  -7.781  -7.781
  171   1HH2  ARG  25          1HH2      ARG  52  -3.677  -8.243  -8.243
  172   2HH2  ARG  25          2HH2      ARG  52  -4.765  -8.856  -8.856
  173    H    CYS  26           H        CYS  53  -1.001  -2.685  -2.685
  174    HA   CYS  26           HA       CYS  53  -0.757  -1.750  -1.750
  175   1HB   CYS  26          1HB       CYS  53   0.489  -4.212  -4.212
  176   2HB   CYS  26          2HB       CYS  53   1.052  -3.411  -3.411
  177    H    TYR  27           H        TYR  54  -1.403  -2.522  -2.522
  178    HA   TYR  27           HA       TYR  54  -3.193  -4.646  -4.646
  179   1HB   TYR  27          1HB       TYR  54  -1.455  -2.973  -2.973
  180   2HB   TYR  27          2HB       TYR  54  -2.483  -4.278  -4.278
  181    HD1  TYR  27           HD1      TYR  54  -5.035  -4.031  -4.031
  182    HD2  TYR  27           HD2      TYR  54  -2.285  -0.948  -0.948
  183    HE1  TYR  27           HE1      TYR  54  -6.941  -2.414  -2.414
  184    HE2  TYR  27           HE2      TYR  54  -4.190   0.674   0.674
  185    HH   TYR  27           HH       TYR  54  -6.266   1.120   1.120
  186   1H    NH2  28          1H1       TYR  54  -2.588  -6.360  -6.360
  187   2H    NH2  28          2H1       TYR  54  -1.194  -7.203  -7.203

  Start of MODEL    3
    1   1H    CYS   1          1H        CYS  55  10.846  -2.302  -2.302
    2   2H    CYS   1          2H        CYS  55  10.709  -0.887  -0.887
    3   3H    CYS   1          3H        CYS  55  10.584  -1.221  -1.221
    4    HA   CYS   1           HA       CYS  55   8.380  -0.762  -0.762
    5   1HB   CYS   1          1HB       CYS  55   7.431  -1.844  -1.844
    6   2HB   CYS   1          2HB       CYS  55   9.030  -1.275  -1.275
    7    H    LYS   2           H        LYS  56   6.848  -1.417  -1.417
    8    HA   LYS   2           HA       LYS  56   6.832  -3.641  -3.641
    9   1HB   LYS   2          1HB       LYS  56   4.733  -1.576  -1.576
   10   2HB   LYS   2          2HB       LYS  56   4.556  -2.767  -2.767
   11   1HG   LYS   2          1HG       LYS  56   6.919  -0.904  -0.904
   12   2HG   LYS   2          2HG       LYS  56   5.380  -0.396  -0.396
   13   1HD   LYS   2          1HD       LYS  56   6.798  -2.914  -2.914
   14   2HD   LYS   2          2HD       LYS  56   7.175  -1.331  -1.331
   15   1HE   LYS   2          1HE       LYS  56   4.489  -2.752  -2.752
   16   2HE   LYS   2          2HE       LYS  56   5.569  -2.466  -2.466
   17   1HZ   LYS   2          1HZ       LYS  56   4.258  -0.347  -0.347
   18   2HZ   LYS   2          2HZ       LYS  56   3.850  -0.769  -0.769
   19   3HZ   LYS   2          3HZ       LYS  56   5.168  -0.106  -0.106
   20    H    SER   3           H        SER  57   6.598  -5.506  -5.506
   21    HA   SER   3           HA       SER  57   5.589  -6.773  -6.773
   22   1HB   SER   3          1HB       SER  57   6.755  -7.905  -7.905
   23   2HB   SER   3          2HB       SER  57   5.235  -7.813  -7.813
   24    HG   SER   3           HG       SER  57   5.482  -9.912  -9.912
   25    HA   HYP   4           HA       HYP  58   1.322  -5.886  -5.886
   26   1HB   HYP   4          1HB       HYP  58   1.365  -8.741  -8.741
   27   2HB   HYP   4          2HB       HYP  58   0.449  -7.354  -7.354
   28    HG   HYP   4           HG       HYP  58   2.749  -7.863  -7.863
   29    HD1  HYP   4           HD1      HYP  58   3.431  -5.560  -5.560
   30   1HD2  HYP   4          1HD2      HYP  58   4.552  -6.698  -6.698
   31   2HD2  HYP   4          2HD2      HYP  58   4.093  -8.387  -8.387
   32    H    GLY   5           H        GLY  59  -0.466  -6.064  -6.064
   33   1HA   GLY   5          1HA       GLY  59  -2.044  -6.983  -6.983
   34   2HA   GLY   5          2HA       GLY  59  -0.791  -8.113  -8.113
   35    H    SER   6           H        SER  60   1.228  -6.060  -6.060
   36    HA   SER   6           HA       SER  60   0.805  -5.066  -5.066
   37   1HB   SER   6          1HB       SER  60   2.874  -3.823  -3.823
   38   2HB   SER   6          2HB       SER  60   3.077  -5.450  -5.450
   39    HG   SER   6           HG       SER  60   3.989  -3.784  -3.784
   40    H    SER   7           H        SER  61   1.139  -2.752  -2.752
   41    HA   SER   7           HA       SER  61  -1.163  -1.325  -1.325
   42   1HB   SER   7          1HB       SER  61  -1.108  -1.789  -1.789
   43   2HB   SER   7          2HB       SER  61   0.397  -0.864  -0.864
   44    HG   SER   7           HG       SER  61  -1.497   0.431   0.431
   45    H    CYS   8           H        CYS  62  -1.253   0.730   0.730
   46    HA   CYS   8           HA       CYS  62   1.075   2.344   2.344
   47   1HB   CYS   8          1HB       CYS  62   0.538   2.542   2.542
   48   2HB   CYS   8          2HB       CYS  62   1.064   0.924   0.924
   49    H    SER   9           H        SER  63   0.724   4.320   4.320
   50    HA   SER   9           HA       SER  63  -1.616   5.783   5.783
   51   1HB   SER   9          1HB       SER  63   0.729   6.449   6.449
   52   2HB   SER   9          2HB       SER  63   1.062   6.812   6.812
   53    HG   SER   9           HG       SER  63   0.421   8.760   8.760
   54    HA   HYP  10           HA       HYP  64  -3.166   6.814   6.814
   55   1HB   HYP  10          1HB       HYP  64  -3.644   9.456   9.456
   56   2HB   HYP  10          2HB       HYP  64  -4.721   8.566   8.566
   57    HG   HYP  10           HG       HYP  64  -5.127   8.404   8.404
   58    HD1  HYP  10           HD1      HYP  64  -5.777   6.093   6.093
   59   1HD2  HYP  10          1HD2      HYP  64  -3.619   6.200   6.200
   60   2HD2  HYP  10          2HD2      HYP  64  -2.990   7.836   7.836
   61    H    THR  11           H        THR  65  -1.074   9.058   9.058
   62    HA   THR  11           HA       THR  65  -0.065  10.382  10.382
   63    HB   THR  11           HB       THR  65   1.490  11.476  11.476
   64    HG1  THR  11           HG1      THR  65   1.040  11.149  11.149
   65   1HG2  THR  11          1HG2      THR  65  -1.443  11.624  11.624
   66   2HG2  THR  11          2HG2      THR  65  -0.207  12.810  12.810
   67   3HG2  THR  11          3HG2      THR  65  -0.594  12.541  12.541
   68    H    SER  12           H        SER  66   0.864   7.588   7.588
   69    HA   SER  12           HA       SER  66   3.429   7.505   7.505
   70   1HB   SER  12          1HB       SER  66   2.982   6.605   6.605
   71   2HB   SER  12          2HB       SER  66   4.490   6.457   6.457
   72    HG   SER  12           HG       SER  66   4.528   8.331   8.331
   73    H    TYR  13           H        TYR  67   2.582   6.222   6.222
   74    HA   TYR  13           HA       TYR  67   1.421   3.642   3.642
   75   1HB   TYR  13          1HB       TYR  67   2.928   4.874   4.874
   76   2HB   TYR  13          2HB       TYR  67   1.972   3.383   3.383
   77    HD1  TYR  13           HD1      TYR  67   1.779   7.113   7.113
   78    HD2  TYR  13           HD2      TYR  67  -0.383   3.416   3.416
   79    HE1  TYR  13           HE1      TYR  67  -0.377   8.381   8.381
   80    HE2  TYR  13           HE2      TYR  67  -2.533   4.688   4.688
   81    HH   TYR  13           HH       TYR  67  -3.558   6.493   6.493
   82    H    ASN  14           H        ASN  68   3.041   3.271   3.271
   83    HA   ASN  14           HA       ASN  68   5.830   2.933   2.933
   84   1HB   ASN  14          1HB       ASN  68   5.925   2.284   2.284
   85   2HB   ASN  14          2HB       ASN  68   5.302   3.902   3.902
   86   1HD2  ASN  14          1HD2      ASN  68   4.160   0.617   0.617
   87   2HD2  ASN  14          2HD2      ASN  68   2.846   1.116   1.116
   88    H    CYS  15           H        CYS  69   4.474   1.136   1.136
   89    HA   CYS  15           HA       CYS  69   4.580  -1.526  -1.526
   90   1HB   CYS  15          1HB       CYS  69   2.552  -0.442  -0.442
   91   2HB   CYS  15          2HB       CYS  69   2.528  -2.040  -2.040
   92    H    CYS  16           H        CYS  70   4.949  -3.234  -3.234
   93    HA   CYS  16           HA       CYS  70   6.543  -2.985  -2.985
   94   1HB   CYS  16          1HB       CYS  70   5.227  -5.445  -5.445
   95   2HB   CYS  16          2HB       CYS  70   6.505  -5.437  -5.437
   96    H    ARG  17           H        ARG  71   3.236  -4.293  -4.293
   97    HA   ARG  17           HA       ARG  71   2.706  -2.737  -2.737
   98   1HB   ARG  17          1HB       ARG  71   1.287  -5.157  -5.157
   99   2HB   ARG  17          2HB       ARG  71   0.608  -3.953  -3.953
  100   1HG   ARG  17          1HG       ARG  71   3.304  -5.223  -5.223
  101   2HG   ARG  17          2HG       ARG  71   1.801  -5.953  -5.953
  102   1HD   ARG  17          1HD       ARG  71   2.721  -4.787  -4.787
  103   2HD   ARG  17          2HD       ARG  71   1.391  -3.775  -3.775
  104    HE   ARG  17           HE       ARG  71   4.187  -3.244  -3.244
  105   1HH1  ARG  17          1HH1      ARG  71   1.146  -1.779  -1.779
  106   2HH1  ARG  17          2HH1      ARG  71   1.817  -0.277  -0.277
  107   1HH2  ARG  17          1HH2      ARG  71   4.772  -1.171  -1.171
  108   2HH2  ARG  17          2HH2      ARG  71   3.858   0.067   0.067
  109    H    SER  18           H        SER  72   1.842  -1.059  -1.059
  110    HA   SER  18           HA       SER  72   1.343   0.823   0.823
  111   1HB   SER  18          1HB       SER  72   0.577   0.733   0.733
  112   2HB   SER  18          2HB       SER  72  -0.897  -0.102  -0.102
  113    HG   SER  18           HG       SER  72  -1.260   2.224   2.224
  114    H    CYS  19           H        CYS  73   0.123   1.770   1.770
  115    HA   CYS  19           HA       CYS  73  -1.443   0.344   0.344
  116   1HB   CYS  19          1HB       CYS  73  -0.233   2.615   2.615
  117   2HB   CYS  19          2HB       CYS  73  -1.664   3.322   3.322
  118    H    ASN  20           H        ASN  74  -3.646  -0.136  -0.136
  119    HA   ASN  20           HA       ASN  74  -5.390   1.492   1.492
  120   1HB   ASN  20          1HB       ASN  74  -5.895  -0.945  -0.945
  121   2HB   ASN  20          2HB       ASN  74  -6.198  -0.771  -0.771
  122   1HD2  ASN  20          1HD2      ASN  74  -8.395  -1.050  -1.050
  123   2HD2  ASN  20          2HD2      ASN  74  -9.519  -0.140  -0.140
  124    HA   HYP  21           HA       HYP  75  -5.277   4.371   4.371
  125   1HB   HYP  21          1HB       HYP  75  -7.494   5.503   5.503
  126   2HB   HYP  21          2HB       HYP  75  -6.230   6.387   6.387
  127    HG   HYP  21           HG       HYP  75  -5.743   6.021   6.021
  128    HD1  HYP  21           HD1      HYP  75  -3.492   5.337   5.337
  129   1HD2  HYP  21          1HD2      HYP  75  -4.812   3.430   3.430
  130   2HD2  HYP  21          2HD2      HYP  75  -6.568   3.646   3.646
  131    H    TYR  22           H        TYR  76  -8.224   3.188   3.188
  132    HA   TYR  22           HA       TYR  76 -10.176   3.774   3.774
  133   1HB   TYR  22          1HB       TYR  76 -10.192   2.678   2.678
  134   2HB   TYR  22          2HB       TYR  76  -9.935   1.142   1.142
  135    HD1  TYR  22           HD2      TYR  76 -12.090   4.152   4.152
  136    HD2  TYR  22           HD1      TYR  76 -11.830  -0.071  -0.071
  137    HE1  TYR  22           HE2      TYR  76 -14.550   4.120   4.120
  138    HE2  TYR  22           HE1      TYR  76 -14.296  -0.108  -0.108
  139    HH   TYR  22           HH       TYR  76 -16.275   3.011   3.011
  140    H    THR  23           H        THR  77  -8.071   0.962   0.962
  141    HA   THR  23           HA       THR  77  -9.234   0.015   0.015
  142    HB   THR  23           HB       THR  77  -8.367  -2.208  -2.208
  143    HG1  THR  23           HG1      THR  77  -7.823  -2.712  -2.712
  144   1HG2  THR  23          1HG2      THR  77 -10.298  -0.997  -0.997
  145   2HG2  THR  23          2HG2      THR  77 -10.130  -2.722  -2.722
  146   3HG2  THR  23          3HG2      THR  77 -10.732  -1.609  -1.609
  147    H    LYS  24           H        LYS  78  -6.554   1.574   1.574
  148    HA   LYS  24           HA       LYS  78  -4.459   2.042   2.042
  149   1HB   LYS  24          1HB       LYS  78  -5.446   0.844   0.844
  150   2HB   LYS  24          2HB       LYS  78  -4.016   1.869   1.869
  151   1HG   LYS  24          1HG       LYS  78  -6.692   2.877   2.877
  152   2HG   LYS  24          2HG       LYS  78  -6.285   2.881   2.881
  153   1HD   LYS  24          1HD       LYS  78  -4.358   4.299   4.299
  154   2HD   LYS  24          2HD       LYS  78  -4.620   4.206   4.206
  155   1HE   LYS  24          1HE       LYS  78  -6.724   5.303   5.303
  156   2HE   LYS  24          2HE       LYS  78  -5.462   6.327   6.327
  157   1HZ   LYS  24          1HZ       LYS  78  -7.355   4.750   4.750
  158   2HZ   LYS  24          2HZ       LYS  78  -7.429   6.233   6.233
  159   3HZ   LYS  24          3HZ       LYS  78  -6.294   5.613   5.613
  160    H    ARG  25           H        ARG  79  -4.995  -0.742  -0.742
  161    HA   ARG  25           HA       ARG  79  -2.589  -2.088  -2.088
  162   1HB   ARG  25          1HB       ARG  79  -5.010  -3.314  -3.314
  163   2HB   ARG  25          2HB       ARG  79  -3.480  -4.170  -4.170
  164   1HG   ARG  25          1HG       ARG  79  -3.739  -3.984  -3.984
  165   2HG   ARG  25          2HG       ARG  79  -5.196  -2.995  -2.995
  166   1HD   ARG  25          1HD       ARG  79  -4.950  -5.812  -5.812
  167   2HD   ARG  25          2HD       ARG  79  -5.589  -5.461  -5.461
  168    HE   ARG  25           HE       ARG  79  -7.347  -4.214  -4.214
  169   1HH1  ARG  25          1HH2      ARG  79  -5.713  -6.449  -6.449
  170   2HH1  ARG  25          2HH2      ARG  79  -6.959  -6.536  -6.536
  171   1HH2  ARG  25          1HH1      ARG  79  -8.974  -4.304  -4.304
  172   2HH2  ARG  25          2HH1      ARG  79  -8.815  -5.313  -5.313
  173    H    CYS  26           H        CYS  80  -1.121  -2.713  -2.713
  174    HA   CYS  26           HA       CYS  80  -0.745  -1.764  -1.764
  175   1HB   CYS  26          1HB       CYS  80   0.567  -4.044  -4.044
  176   2HB   CYS  26          2HB       CYS  80   1.193  -3.289  -3.289
  177    H    TYR  27           H        TYR  81  -1.420  -2.668  -2.668
  178    HA   TYR  27           HA       TYR  81  -3.107  -4.899  -4.899
  179   1HB   TYR  27          1HB       TYR  81  -1.573  -3.207  -3.207
  180   2HB   TYR  27          2HB       TYR  81  -2.595  -4.565  -4.565
  181    HD1  TYR  27           HD2      TYR  81  -5.024  -4.394  -4.394
  182    HD2  TYR  27           HD1      TYR  81  -2.520  -1.221  -1.221
  183    HE1  TYR  27           HE2      TYR  81  -7.074  -3.034  -3.034
  184    HE2  TYR  27           HE1      TYR  81  -4.570   0.136   0.136
  185    HH   TYR  27           HH       TYR  81  -7.920  -1.304  -1.304
  186   1H    NH2  28          1H1       TYR  81  -2.734  -6.828  -6.828
  187   2H    NH2  28          2H1       TYR  81  -1.257  -7.548  -7.548

  Start of MODEL    4
    1   1H    CYS   1          1H        CYS  82  11.039  -1.664  -1.664
    2   2H    CYS   1          2H        CYS  82  10.897  -2.399  -2.399
    3   3H    CYS   1          3H        CYS  82  10.756  -3.128  -3.128
    4    HA   CYS   1           HA       CYS  82   8.872  -1.106  -1.106
    5   1HB   CYS   1          1HB       CYS  82   7.446  -1.743  -1.743
    6   2HB   CYS   1          2HB       CYS  82   9.005  -1.093  -1.093
    7    H    LYS   2           H        LYS  83   6.951  -1.482  -1.482
    8    HA   LYS   2           HA       LYS  83   6.535  -3.552  -3.552
    9   1HB   LYS   2          1HB       LYS  83   4.826  -1.365  -1.365
   10   2HB   LYS   2          2HB       LYS  83   4.131  -2.637  -2.637
   11   1HG   LYS   2          1HG       LYS  83   5.811  -2.149  -2.149
   12   2HG   LYS   2          2HG       LYS  83   6.493  -0.870  -0.870
   13   1HD   LYS   2          1HD       LYS  83   4.449   0.405   0.405
   14   2HD   LYS   2          2HD       LYS  83   3.601  -0.929  -0.929
   15   1HE   LYS   2          1HE       LYS  83   4.911  -0.698  -0.698
   16   2HE   LYS   2          2HE       LYS  83   6.084   0.355   0.355
   17   1HZ   LYS   2          1HZ       LYS  83   3.305   1.103   1.103
   18   2HZ   LYS   2          2HZ       LYS  83   4.468   1.647   1.647
   19   3HZ   LYS   2          3HZ       LYS  83   4.291   1.989   1.989
   20    H    SER   3           H        SER  84   6.215  -5.456  -5.456
   21    HA   SER   3           HA       SER  84   5.246  -6.959  -6.959
   22   1HB   SER   3          1HB       SER  84   4.526  -8.564  -8.564
   23   2HB   SER   3          2HB       SER  84   6.225  -8.062  -8.062
   24    HG   SER   3           HG       SER  84   5.298  -7.970  -7.970
   25    HA   HYP   4           HA       HYP  85   0.991  -5.731  -5.731
   26   1HB   HYP   4          1HB       HYP  85   0.917  -8.602  -8.602
   27   2HB   HYP   4          2HB       HYP  85   0.206  -7.160  -7.160
   28    HG   HYP   4           HG       HYP  85   2.422  -7.998  -7.998
   29    HD1  HYP   4           HD1      HYP  85   3.403  -5.859  -5.859
   30   1HD2  HYP   4          1HD2      HYP  85   4.301  -6.845  -6.845
   31   2HD2  HYP   4          2HD2      HYP  85   3.692  -8.462  -8.462
   32    H    GLY   5           H        GLY  86  -0.587  -5.694  -5.694
   33   1HA   GLY   5          1HA       GLY  86  -2.117  -6.759  -6.759
   34   2HA   GLY   5          2HA       GLY  86  -0.690  -7.631  -7.631
   35    H    SER   6           H        SER  87   1.167  -5.763  -5.763
   36    HA   SER   6           HA       SER  87   0.872  -4.706  -4.706
   37   1HB   SER   6          1HB       SER  87   2.767  -3.694  -3.694
   38   2HB   SER   6          2HB       SER  87   2.995  -3.621  -3.621
   39    HG   SER   6           HG       SER  87   4.248  -5.396  -5.396
   40    H    SER   7           H        SER  88   0.029  -3.022  -3.022
   41    HA   SER   7           HA       SER  88  -1.481  -1.064  -1.064
   42   1HB   SER   7          1HB       SER  88  -0.299  -0.955  -0.955
   43   2HB   SER   7          2HB       SER  88  -1.596   0.072   0.072
   44    HG   SER   7           HG       SER  88  -2.463  -1.807  -1.807
   45    H    CYS   8           H        CYS  89  -1.228   0.770   0.770
   46    HA   CYS   8           HA       CYS  89   1.142   2.447   2.447
   47   1HB   CYS   8          1HB       CYS  89   0.903   2.562   2.562
   48   2HB   CYS   8          2HB       CYS  89   1.411   0.968   0.968
   49    H    SER   9           H        SER  90   0.571   4.597   4.597
   50    HA   SER   9           HA       SER  90  -2.192   5.378   5.378
   51   1HB   SER   9          1HB       SER  90  -0.599   6.699   6.699
   52   2HB   SER   9          2HB       SER  90   0.399   6.912   6.912
   53    HG   SER   9           HG       SER  90  -0.849   8.867   8.867
   54    HA   HYP  10           HA       HYP  91  -3.303   6.490   6.490
   55   1HB   HYP  10          1HB       HYP  91  -3.980   9.058   9.058
   56   2HB   HYP  10          2HB       HYP  91  -4.869   8.323   8.323
   57    HG   HYP  10           HG       HYP  91  -5.666   7.914   7.914
   58    HD1  HYP  10           HD1      HYP  91  -6.520   5.787   5.787
   59   1HD2  HYP  10          1HD2      HYP  91  -4.347   5.450   5.450
   60   2HD2  HYP  10          2HD2      HYP  91  -3.866   6.933   6.933
   61    H    THR  11           H        THR  92  -1.496   8.637   8.637
   62    HA   THR  11           HA       THR  92  -0.160  10.023  10.023
   63    HB   THR  11           HB       THR  92   0.790  11.451  11.451
   64    HG1  THR  11           HG1      THR  92   0.069  11.244  11.244
   65   1HG2  THR  11          1HG2      THR  92  -2.214  11.142  11.142
   66   2HG2  THR  11          2HG2      THR  92  -1.266  12.555  12.555
   67   3HG2  THR  11          3HG2      THR  92  -1.374  12.116  12.116
   68    H    SER  12           H        SER  93   0.429   7.203   7.203
   69    HA   SER  12           HA       SER  93   3.311   7.200   7.200
   70   1HB   SER  12          1HB       SER  93   1.707   5.462   5.462
   71   2HB   SER  12          2HB       SER  93   3.467   5.648   5.648
   72    HG   SER  12           HG       SER  93   2.536   6.851   6.851
   73    H    TYR  13           H        TYR  94   3.271   6.468   6.468
   74    HA   TYR  13           HA       TYR  94   2.105   3.858   3.858
   75   1HB   TYR  13          1HB       TYR  94   3.386   6.036   6.036
   76   2HB   TYR  13          2HB       TYR  94   2.972   4.438   4.438
   77    HD1  TYR  13           HD2      TYR  94   0.519   3.612   3.612
   78    HD2  TYR  13           HD1      TYR  94   1.774   7.759   7.759
   79    HE1  TYR  13           HE2      TYR  94  -1.881   4.348   4.348
   80    HE2  TYR  13           HE1      TYR  94  -0.622   8.483   8.483
   81    HH   TYR  13           HH       TYR  94  -3.316   5.991   5.991
   82    H    ASN  14           H        ASN  95   4.010   3.702   3.702
   83    HA   ASN  14           HA       ASN  95   6.518   2.827   2.827
   84   1HB   ASN  14          1HB       ASN  95   7.242   2.658   2.658
   85   2HB   ASN  14          2HB       ASN  95   6.538   4.239   4.239
   86   1HD2  ASN  14          1HD2      ASN  95   6.756   2.091   2.091
   87   2HD2  ASN  14          2HD2      ASN  95   5.328   2.292   2.292
   88    H    CYS  15           H        CYS  96   4.464   1.192   1.192
   89    HA   CYS  15           HA       CYS  96   4.735  -1.374  -1.374
   90   1HB   CYS  15          1HB       CYS  96   2.549  -0.407  -0.407
   91   2HB   CYS  15          2HB       CYS  96   2.609  -1.978  -1.978
   92    H    CYS  16           H        CYS  97   4.941  -3.237  -3.237
   93    HA   CYS  16           HA       CYS  97   6.429  -3.013  -3.013
   94   1HB   CYS  16          1HB       CYS  97   5.220  -5.440  -5.440
   95   2HB   CYS  16          2HB       CYS  97   6.413  -5.381  -5.381
   96    H    ARG  17           H        ARG  98   3.037  -4.141  -4.141
   97    HA   ARG  17           HA       ARG  98   2.416  -2.713  -2.713
   98   1HB   ARG  17          1HB       ARG  98   0.801  -4.862  -4.862
   99   2HB   ARG  17          2HB       ARG  98   0.215  -3.877  -3.877
  100   1HG   ARG  17          1HG       ARG  98   1.740  -4.893  -4.893
  101   2HG   ARG  17          2HG       ARG  98   2.608  -5.698  -5.698
  102   1HD   ARG  17          1HD       ARG  98   1.039  -7.210  -7.210
  103   2HD   ARG  17          2HD       ARG  98   0.703  -7.108  -7.108
  104    HE   ARG  17           HE       ARG  98  -0.827  -5.256  -5.256
  105   1HH1  ARG  17          1HH2      ARG  98  -1.017  -8.349  -8.349
  106   2HH1  ARG  17          2HH2      ARG  98  -2.593  -8.586  -8.586
  107   1HH2  ARG  17          1HH1      ARG  98  -3.025  -5.492  -5.492
  108   2HH2  ARG  17          2HH1      ARG  98  -3.755  -6.928  -6.928
  109    H    SER  18           H        SER  99   2.073  -0.824  -0.824
  110    HA   SER  18           HA       SER  99   1.581   0.930   0.930
  111   1HB   SER  18          1HB       SER  99  -0.515   0.414   0.414
  112   2HB   SER  18          2HB       SER  99  -0.341   1.935   1.935
  113    HG   SER  18           HG       SER  99   0.808   2.000   2.000
  114    H    CYS  19           H        CYS 100   0.289   1.983   1.983
  115    HA   CYS  19           HA       CYS 100  -1.145   0.445   0.445
  116   1HB   CYS  19          1HB       CYS 100  -0.051   2.788   2.788
  117   2HB   CYS  19          2HB       CYS 100  -1.578   3.410   3.410
  118    H    ASN  20           H        ASN 101  -3.158  -0.343  -0.343
  119    HA   ASN  20           HA       ASN 101  -5.095   0.566   0.566
  120   1HB   ASN  20          1HB       ASN 101  -4.980  -1.842  -1.842
  121   2HB   ASN  20          2HB       ASN 101  -5.545  -1.368  -1.368
  122   1HD2  ASN  20          1HD2      ASN 101  -7.527  -2.490  -2.490
  123   2HD2  ASN  20          2HD2      ASN 101  -8.746  -2.036  -2.036
  124    HA   HYP  21           HA       HYP 102  -5.204   3.912   3.912
  125   1HB   HYP  21          1HB       HYP 102  -7.233   5.121   5.121
  126   2HB   HYP  21          2HB       HYP 102  -5.664   5.765   5.765
  127    HG   HYP  21           HG       HYP 102  -5.982   4.847   4.847
  128    HD1  HYP  21           HD1      HYP 102  -3.722   4.194   4.194
  129   1HD2  HYP  21          1HD2      HYP 102  -5.181   2.305   2.305
  130   2HD2  HYP  21          2HD2      HYP 102  -6.894   2.696   2.696
  131    H    TYR  22           H        TYR 103  -8.186   2.557   2.557
  132    HA   TYR  22           HA       TYR 103 -10.047   3.466   3.466
  133   1HB   TYR  22          1HB       TYR 103 -10.582   2.272   2.272
  134   2HB   TYR  22          2HB       TYR 103  -9.876   0.791   0.791
  135    HD1  TYR  22           HD2      TYR 103 -12.565   3.350   3.350
  136    HD2  TYR  22           HD1      TYR 103 -11.229  -0.776  -0.776
  137    HE1  TYR  22           HE2      TYR 103 -14.709   2.728   2.728
  138    HE2  TYR  22           HE1      TYR 103 -13.366  -1.391  -1.391
  139    HH   TYR  22           HH       TYR 103 -15.964   1.158   1.158
  140    H    THR  23           H        THR 104  -8.039   0.581   0.581
  141    HA   THR  23           HA       THR 104  -9.030   0.042   0.042
  142    HB   THR  23           HB       THR 104  -7.946  -2.180  -2.180
  143    HG1  THR  23           HG1      THR 104  -7.060  -2.785  -2.785
  144   1HG2  THR  23          1HG2      THR 104  -9.751  -1.486  -1.486
  145   2HG2  THR  23          2HG2      THR 104  -9.396  -3.117  -3.117
  146   3HG2  THR  23          3HG2      THR 104 -10.289  -1.978  -1.978
  147    H    LYS  24           H        LYS 105  -6.471   1.605   1.605
  148    HA   LYS  24           HA       LYS 105  -4.355   2.227   2.227
  149   1HB   LYS  24          1HB       LYS 105  -5.414   1.644   1.644
  150   2HB   LYS  24          2HB       LYS 105  -3.924   2.526   2.526
  151   1HG   LYS  24          1HG       LYS 105  -5.317   4.102   4.102
  152   2HG   LYS  24          2HG       LYS 105  -6.759   3.288   3.288
  153   1HD   LYS  24          1HD       LYS 105  -6.026   3.893   3.893
  154   2HD   LYS  24          2HD       LYS 105  -4.685   4.811   4.811
  155   1HE   LYS  24          1HE       LYS 105  -6.472   6.374   6.374
  156   2HE   LYS  24          2HE       LYS 105  -6.396   6.152   6.152
  157   1HZ   LYS  24          1HZ       LYS 105  -8.329   4.812   4.812
  158   2HZ   LYS  24          2HZ       LYS 105  -8.667   5.945   5.945
  159   3HZ   LYS  24          3HZ       LYS 105  -8.264   4.626   4.626
  160    H    ARG  25           H        ARG 106  -4.523  -0.379  -0.379
  161    HA   ARG  25           HA       ARG 106  -2.396  -1.850  -1.850
  162   1HB   ARG  25          1HB       ARG 106  -5.048  -2.919  -2.919
  163   2HB   ARG  25          2HB       ARG 106  -3.618  -3.957  -3.957
  164   1HG   ARG  25          1HG       ARG 106  -3.443  -3.352  -3.352
  165   2HG   ARG  25          2HG       ARG 106  -4.938  -2.412  -2.412
  166   1HD   ARG  25          1HD       ARG 106  -5.340  -4.676  -4.676
  167   2HD   ARG  25          2HD       ARG 106  -6.183  -4.427  -4.427
  168    HE   ARG  25           HE       ARG 106  -3.608  -5.803  -5.803
  169   1HH1  ARG  25          1HH2      ARG 106  -6.974  -5.973  -5.973
  170   2HH1  ARG  25          2HH2      ARG 106  -6.844  -7.437  -7.437
  171   1HH2  ARG  25          1HH1      ARG 106  -3.500  -7.817  -7.817
  172   2HH2  ARG  25          2HH1      ARG 106  -4.856  -8.492  -8.492
  173    H    CYS  26           H        CYS 107  -0.902  -2.635  -2.635
  174    HA   CYS  26           HA       CYS 107  -0.662  -1.687  -1.687
  175   1HB   CYS  26          1HB       CYS 107   0.754  -3.972  -3.972
  176   2HB   CYS  26          2HB       CYS 107   1.241  -3.228  -3.228
  177    H    TYR  27           H        TYR 108  -1.384  -2.439  -2.439
  178    HA   TYR  27           HA       TYR 108  -3.297  -4.435  -4.435
  179   1HB   TYR  27          1HB       TYR 108  -1.545  -2.798  -2.798
  180   2HB   TYR  27          2HB       TYR 108  -2.471  -4.147  -4.147
  181    HD1  TYR  27           HD1      TYR 108  -5.135  -4.060  -4.060
  182    HD2  TYR  27           HD2      TYR 108  -2.376  -0.746  -0.746
  183    HE1  TYR  27           HE1      TYR 108  -6.973  -2.659  -2.659
  184    HE2  TYR  27           HE2      TYR 108  -4.210   0.649   0.649
  185    HH   TYR  27           HH       TYR 108  -6.331   0.897   0.897
  186   1H    NH2  28          1H1       TYR 108  -3.108  -6.532  -6.532
  187   2H    NH2  28          2H1       TYR 108  -1.691  -7.358  -7.358

  Start of MODEL    5
    1   1H    CYS   1          1H        CYS 109  10.967  -1.221  -1.221
    2   2H    CYS   1          2H        CYS 109  10.886  -1.651  -1.651
    3   3H    CYS   1          3H        CYS 109  10.970  -2.672  -2.672
    4    HA   CYS   1           HA       CYS 109   8.671  -0.906  -0.906
    5   1HB   CYS   1          1HB       CYS 109   7.563  -2.040  -2.040
    6   2HB   CYS   1          2HB       CYS 109   9.153  -1.539  -1.539
    7    H    LYS   2           H        LYS 110   6.824  -1.588  -1.588
    8    HA   LYS   2           HA       LYS 110   6.909  -3.756  -3.756
    9   1HB   LYS   2          1HB       LYS 110   4.766  -1.772  -1.772
   10   2HB   LYS   2          2HB       LYS 110   4.542  -3.073  -3.073
   11   1HG   LYS   2          1HG       LYS 110   6.203  -2.145  -2.145
   12   2HG   LYS   2          2HG       LYS 110   6.738  -0.995  -0.995
   13   1HD   LYS   2          1HD       LYS 110   4.577   0.110   0.110
   14   2HD   LYS   2          2HD       LYS 110   3.943  -1.097  -1.097
   15   1HE   LYS   2          1HE       LYS 110   5.419  -0.303  -0.303
   16   2HE   LYS   2          2HE       LYS 110   6.229   0.802   0.802
   17   1HZ   LYS   2          1HZ       LYS 110   3.397   0.983   0.983
   18   2HZ   LYS   2          2HZ       LYS 110   4.440   1.925   1.925
   19   3HZ   LYS   2          3HZ       LYS 110   4.079   1.912   1.912
   20    H    SER   3           H        SER 111   6.663  -5.680  -5.680
   21    HA   SER   3           HA       SER 111   5.488  -6.966  -6.966
   22   1HB   SER   3          1HB       SER 111   5.363  -7.949  -7.949
   23   2HB   SER   3          2HB       SER 111   5.466  -8.924  -8.924
   24    HG   SER   3           HG       SER 111   7.590  -8.740  -8.740
   25    HA   HYP   4           HA       HYP 112   1.176  -5.876  -5.876
   26   1HB   HYP   4          1HB       HYP 112   1.131  -8.639  -8.639
   27   2HB   HYP   4          2HB       HYP 112   0.224  -7.190  -7.190
   28    HG   HYP   4           HG       HYP 112   2.359  -7.637  -7.637
   29    HD1  HYP   4           HD1      HYP 112   3.119  -5.394  -5.394
   30   1HD2  HYP   4          1HD2      HYP 112   4.345  -6.622  -6.622
   31   2HD2  HYP   4          2HD2      HYP 112   3.885  -8.322  -8.322
   32    H    GLY   5           H        GLY 113  -0.606  -6.143  -6.143
   33   1HA   GLY   5          1HA       GLY 113  -2.050  -7.193  -7.193
   34   2HA   GLY   5          2HA       GLY 113  -0.599  -7.964  -7.964
   35    H    SER   6           H        SER 114   1.052  -5.718  -5.718
   36    HA   SER   6           HA       SER 114   0.823  -4.804  -4.804
   37   1HB   SER   6          1HB       SER 114   2.445  -3.669  -3.669
   38   2HB   SER   6          2HB       SER 114   2.645  -3.209  -3.209
   39    HG   SER   6           HG       SER 114   4.195  -4.892  -4.892
   40    H    SER   7           H        SER 115   0.518  -2.811  -2.811
   41    HA   SER   7           HA       SER 115  -1.483  -1.050  -1.050
   42   1HB   SER   7          1HB       SER 115  -1.139   0.177   0.177
   43   2HB   SER   7          2HB       SER 115  -1.509  -1.544  -1.544
   44    HG   SER   7           HG       SER 115   0.293  -0.852  -0.852
   45    H    CYS   8           H        CYS 116  -1.257   0.699   0.699
   46    HA   CYS   8           HA       CYS 116   1.098   2.440   2.440
   47   1HB   CYS   8          1HB       CYS 116   0.714   2.793   2.793
   48   2HB   CYS   8          2HB       CYS 116   1.212   1.140   1.140
   49    H    SER   9           H        SER 117   0.670   4.628   4.628
   50    HA   SER   9           HA       SER 117  -1.950   5.659   5.659
   51   1HB   SER   9          1HB       SER 117  -0.066   6.943   6.943
   52   2HB   SER   9          2HB       SER 117   0.657   6.996   6.996
   53    HG   SER   9           HG       SER 117  -0.406   9.054   9.054
   54    HA   HYP  10           HA       HYP 118  -3.746   6.324   6.324
   55   1HB   HYP  10          1HB       HYP 118  -3.792   9.078   9.078
   56   2HB   HYP  10          2HB       HYP 118  -4.995   8.396   8.396
   57    HG   HYP  10           HG       HYP 118  -5.351   8.194   8.194
   58    HD1  HYP  10           HD1      HYP 118  -6.528   6.155   6.155
   59   1HD2  HYP  10          1HD2      HYP 118  -4.243   5.610   5.610
   60   2HD2  HYP  10          2HD2      HYP 118  -3.513   7.069   7.069
   61    H    THR  11           H        THR 119  -1.388   8.732   8.732
   62    HA   THR  11           HA       THR 119  -0.695   9.448   9.448
   63    HB   THR  11           HB       THR 119  -1.158  11.221  11.221
   64    HG1  THR  11           HG1      THR 119   0.619  12.574  12.574
   65   1HG2  THR  11          1HG2      THR 119   1.460  10.529  10.529
   66   2HG2  THR  11          2HG2      THR 119   0.533  12.018  12.018
   67   3HG2  THR  11          3HG2      THR 119  -0.144  10.461  10.461
   68    H    SER  12           H        SER 120   0.425   7.167   7.167
   69    HA   SER  12           HA       SER 120   3.216   7.261   7.261
   70   1HB   SER  12          1HB       SER 120   3.941   6.053   6.053
   71   2HB   SER  12          2HB       SER 120   2.984   7.436   7.436
   72    HG   SER  12           HG       SER 120   2.515   5.475   5.475
   73    H    TYR  13           H        TYR 121   2.638   6.342   6.342
   74    HA   TYR  13           HA       TYR 121   1.769   3.615   3.615
   75   1HB   TYR  13          1HB       TYR 121   3.035   5.723   5.723
   76   2HB   TYR  13          2HB       TYR 121   2.691   4.081   4.081
   77    HD1  TYR  13           HD2      TYR 121   0.429   3.260   3.260
   78    HD2  TYR  13           HD1      TYR 121   1.215   7.328   7.328
   79    HE1  TYR  13           HE2      TYR 121  -2.006   3.786   3.786
   80    HE2  TYR  13           HE1      TYR 121  -1.232   7.864   7.864
   81    HH   TYR  13           HH       TYR 121  -3.578   5.272   5.272
   82    H    ASN  14           H        ASN 122   3.462   3.381   3.381
   83    HA   ASN  14           HA       ASN 122   6.163   2.769   2.769
   84   1HB   ASN  14          1HB       ASN 122   6.720   2.826   2.826
   85   2HB   ASN  14          2HB       ASN 122   5.838   4.287   4.287
   86   1HD2  ASN  14          1HD2      ASN 122   6.264   2.812   2.812
   87   2HD2  ASN  14          2HD2      ASN 122   4.775   2.658   2.658
   88    H    CYS  15           H        CYS 123   4.418   1.047   1.047
   89    HA   CYS  15           HA       CYS 123   4.522  -1.461  -1.461
   90   1HB   CYS  15          1HB       CYS 123   2.439  -0.374  -0.374
   91   2HB   CYS  15          2HB       CYS 123   2.423  -2.014  -2.014
   92    H    CYS  16           H        CYS 124   5.031  -3.274  -3.274
   93    HA   CYS  16           HA       CYS 124   6.602  -3.238  -3.238
   94   1HB   CYS  16          1HB       CYS 124   5.213  -5.561  -5.561
   95   2HB   CYS  16          2HB       CYS 124   6.476  -5.604  -5.604
   96    H    ARG  17           H        ARG 125   3.132  -3.927  -3.927
   97    HA   ARG  17           HA       ARG 125   2.752  -2.743  -2.743
   98   1HB   ARG  17          1HB       ARG 125   1.179  -5.010  -5.010
   99   2HB   ARG  17          2HB       ARG 125   0.635  -4.101  -4.101
  100   1HG   ARG  17          1HG       ARG 125   2.394  -4.927  -4.927
  101   2HG   ARG  17          2HG       ARG 125   3.311  -5.493  -5.493
  102   1HD   ARG  17          1HD       ARG 125   2.272  -7.355  -7.355
  103   2HD   ARG  17          2HD       ARG 125   1.643  -7.223  -7.223
  104    HE   ARG  17           HE       ARG 125   0.118  -5.899  -5.899
  105   1HH1  ARG  17          1HH2      ARG 125   0.293  -8.723  -8.723
  106   2HH1  ARG  17          2HH2      ARG 125  -1.285  -9.123  -9.123
  107   1HH2  ARG  17          1HH1      ARG 125  -1.995  -6.574  -6.574
  108   2HH2  ARG  17          2HH1      ARG 125  -2.593  -7.896  -7.896
  109    H    SER  18           H        SER 126   2.503  -0.826  -0.826
  110    HA   SER  18           HA       SER 126   1.522   1.051   1.051
  111   1HB   SER  18          1HB       SER 126  -0.500   1.548   1.548
  112   2HB   SER  18          2HB       SER 126   0.929   1.091   1.091
  113    HG   SER  18           HG       SER 126  -1.039   0.024   0.024
  114    H    CYS  19           H        CYS 127   0.323   2.070   2.070
  115    HA   CYS  19           HA       CYS 127  -1.135   0.614   0.614
  116   1HB   CYS  19          1HB       CYS 127   0.076   2.841   2.841
  117   2HB   CYS  19          2HB       CYS 127  -1.340   3.594   3.594
  118    H    ASN  20           H        ASN 128  -3.219   0.158   0.158
  119    HA   ASN  20           HA       ASN 128  -5.174   1.457   1.457
  120   1HB   ASN  20          1HB       ASN 128  -5.432  -0.994  -0.994
  121   2HB   ASN  20          2HB       ASN 128  -5.669  -0.739  -0.739
  122   1HD2  ASN  20          1HD2      ASN 128  -7.607  -1.783  -1.783
  123   2HD2  ASN  20          2HD2      ASN 128  -8.933  -0.810  -0.810
  124    HA   HYP  21           HA       HYP 129  -5.071   4.429   4.429
  125   1HB   HYP  21          1HB       HYP 129  -7.199   5.688   5.688
  126   2HB   HYP  21          2HB       HYP 129  -5.742   6.424   6.424
  127    HG   HYP  21           HG       HYP 129  -5.689   5.803   5.803
  128    HD1  HYP  21           HD1      HYP 129  -3.438   4.978   4.978
  129   1HD2  HYP  21          1HD2      HYP 129  -5.005   3.238   3.238
  130   2HD2  HYP  21          2HD2      HYP 129  -6.720   3.620   3.620
  131    H    TYR  22           H        TYR 130  -8.027   3.246   3.246
  132    HA   TYR  22           HA       TYR 130  -9.905   3.919   3.919
  133   1HB   TYR  22          1HB       TYR 130  -9.824   1.631   1.631
  134   2HB   TYR  22          2HB       TYR 130 -11.233   2.012   2.012
  135    HD1  TYR  22           HD2      TYR 130 -11.840   4.676   4.676
  136    HD2  TYR  22           HD1      TYR 130  -9.872   2.409   2.409
  137    HE1  TYR  22           HE2      TYR 130 -12.213   6.566   6.566
  138    HE2  TYR  22           HE1      TYR 130 -10.247   4.303   4.303
  139    HH   TYR  22           HH       TYR 130 -11.751   7.453   7.453
  140    H    THR  23           H        THR 131  -8.196   0.896   0.896
  141    HA   THR  23           HA       THR 131  -9.140  -0.296  -0.296
  142    HB   THR  23           HB       THR 131  -8.128  -2.370  -2.370
  143    HG1  THR  23           HG1      THR 131  -6.992  -2.475  -2.475
  144   1HG2  THR  23          1HG2      THR 131  -9.650  -1.072  -1.072
  145   2HG2  THR  23          2HG2      THR 131  -9.350  -2.807  -2.807
  146   3HG2  THR  23          3HG2      THR 131 -10.328  -1.933  -1.933
  147    H    LYS  24           H        LYS 132  -6.578   1.618   1.618
  148    HA   LYS  24           HA       LYS 132  -4.626   2.174   2.174
  149   1HB   LYS  24          1HB       LYS 132  -5.735   0.681   0.681
  150   2HB   LYS  24          2HB       LYS 132  -4.461   1.913   1.913
  151   1HG   LYS  24          1HG       LYS 132  -7.316   2.434   2.434
  152   2HG   LYS  24          2HG       LYS 132  -6.702   2.696   2.696
  153   1HD   LYS  24          1HD       LYS 132  -5.050   4.308   4.308
  154   2HD   LYS  24          2HD       LYS 132  -5.860   4.130   4.130
  155   1HE   LYS  24          1HE       LYS 132  -7.488   4.844   4.844
  156   2HE   LYS  24          2HE       LYS 132  -6.503   6.096   6.096
  157   1HZ   LYS  24          1HZ       LYS 132  -8.571   4.558   4.558
  158   2HZ   LYS  24          2HZ       LYS 132  -8.722   5.985   5.985
  159   3HZ   LYS  24          3HZ       LYS 132  -7.743   5.611   5.611
  160    H    ARG  25           H        ARG 133  -4.755  -0.385  -0.385
  161    HA   ARG  25           HA       ARG 133  -2.551  -1.917  -1.917
  162   1HB   ARG  25          1HB       ARG 133  -4.945  -2.941  -2.941
  163   2HB   ARG  25          2HB       ARG 133  -3.501  -3.910  -3.910
  164   1HG   ARG  25          1HG       ARG 133  -3.982  -3.601  -3.601
  165   2HG   ARG  25          2HG       ARG 133  -5.523  -2.861  -2.861
  166   1HD   ARG  25          1HD       ARG 133  -4.599  -5.631  -5.631
  167   2HD   ARG  25          2HD       ARG 133  -5.731  -5.295  -5.295
  168    HE   ARG  25           HE       ARG 133  -7.342  -4.722  -4.722
  169   1HH1  ARG  25          1HH1      ARG 133  -4.505  -5.688  -5.688
  170   2HH1  ARG  25          2HH1      ARG 133  -5.325  -5.864  -5.864
  171   1HH2  ARG  25          1HH2      ARG 133  -8.349  -4.908  -4.908
  172   2HH2  ARG  25          2HH2      ARG 133  -7.489  -5.424  -5.424
  173    H    CYS  26           H        CYS 134  -1.026  -2.750  -2.750
  174    HA   CYS  26           HA       CYS 134  -0.534  -1.777  -1.777
  175   1HB   CYS  26          1HB       CYS 134   0.686  -4.111  -4.111
  176   2HB   CYS  26          2HB       CYS 134   1.278  -3.438  -3.438
  177    H    TYR  27           H        TYR 135  -1.246  -2.512  -2.512
  178    HA   TYR  27           HA       TYR 135  -3.278  -4.323  -4.323
  179   1HB   TYR  27          1HB       TYR 135  -1.337  -2.847  -2.847
  180   2HB   TYR  27          2HB       TYR 135  -2.278  -4.159  -4.159
  181    HD1  TYR  27           HD2      TYR 135  -4.907  -3.877  -3.877
  182    HD2  TYR  27           HD1      TYR 135  -2.188  -0.901  -0.901
  183    HE1  TYR  27           HE2      TYR 135  -6.856  -2.453  -2.453
  184    HE2  TYR  27           HE1      TYR 135  -4.134   0.535   0.535
  185    HH   TYR  27           HH       TYR 135  -7.572  -0.549  -0.549
  186   1H    NH2  28          1H1       TYR 135  -3.374  -6.351  -6.351
  187   2H    NH2  28          2H1       TYR 135  -2.111  -7.404  -7.404

  Start of MODEL    6
    1   1H    CYS   1          1H        CYS 136  10.900  -3.328  -3.328
    2   2H    CYS   1          2H        CYS 136  11.106  -2.113  -2.113
    3   3H    CYS   1          3H        CYS 136  11.079  -1.997  -1.997
    4    HA   CYS   1           HA       CYS 136   8.992  -1.136  -1.136
    5   1HB   CYS   1          1HB       CYS 136   7.673  -2.351  -2.351
    6   2HB   CYS   1          2HB       CYS 136   9.322  -2.697  -2.697
    7    H    LYS   2           H        LYS 137   6.953  -1.388  -1.388
    8    HA   LYS   2           HA       LYS 137   6.583  -3.138  -3.138
    9   1HB   LYS   2          1HB       LYS 137   4.830  -1.066  -1.066
   10   2HB   LYS   2          2HB       LYS 137   4.224  -2.136  -2.136
   11   1HG   LYS   2          1HG       LYS 137   5.921  -1.314  -1.314
   12   2HG   LYS   2          2HG       LYS 137   6.618  -0.301  -0.301
   13   1HD   LYS   2          1HD       LYS 137   5.015   1.294   1.294
   14   2HD   LYS   2          2HD       LYS 137   3.725   0.104   0.104
   15   1HE   LYS   2          1HE       LYS 137   5.812   0.630   0.630
   16   2HE   LYS   2          2HE       LYS 137   4.340   1.610   1.610
   17   1HZ   LYS   2          1HZ       LYS 137   4.342  -1.302  -1.302
   18   2HZ   LYS   2          2HZ       LYS 137   3.987  -0.356  -0.356
   19   3HZ   LYS   2          3HZ       LYS 137   3.103  -0.476  -0.476
   20    H    SER   3           H        SER 138   5.803  -5.034  -5.034
   21    HA   SER   3           HA       SER 138   5.139  -6.512  -6.512
   22   1HB   SER   3          1HB       SER 138   4.353  -8.255  -8.255
   23   2HB   SER   3          2HB       SER 138   5.998  -7.671  -7.671
   24    HG   SER   3           HG       SER 138   4.736  -7.853  -7.853
   25    HA   HYP   4           HA       HYP 139   0.969  -5.735  -5.735
   26   1HB   HYP   4          1HB       HYP 139   1.195  -8.661  -8.661
   27   2HB   HYP   4          2HB       HYP 139   0.366  -7.345  -7.345
   28    HG   HYP   4           HG       HYP 139   2.824  -7.996  -7.996
   29    HD1  HYP   4           HD1      HYP 139   3.406  -5.718  -5.718
   30   1HD2  HYP   4          1HD2      HYP 139   4.330  -6.432  -6.432
   31   2HD2  HYP   4          2HD2      HYP 139   3.990  -8.119  -8.119
   32    H    GLY   5           H        GLY 140  -0.605  -5.671  -5.671
   33   1HA   GLY   5          1HA       GLY 140  -2.237  -6.538  -6.538
   34   2HA   GLY   5          2HA       GLY 140  -0.966  -7.606  -7.606
   35    H    SER   6           H        SER 141   0.968  -5.283  -5.283
   36    HA   SER   6           HA       SER 141   0.730  -4.594  -4.594
   37   1HB   SER   6          1HB       SER 141   2.882  -4.709  -4.709
   38   2HB   SER   6          2HB       SER 141   2.433  -3.121  -3.121
   39    HG   SER   6           HG       SER 141   3.874  -2.937  -2.937
   40    H    SER   7           H        SER 142   0.234  -2.922  -2.922
   41    HA   SER   7           HA       SER 142  -1.716  -1.051  -1.051
   42   1HB   SER   7          1HB       SER 142  -1.544  -0.153  -0.153
   43   2HB   SER   7          2HB       SER 142  -1.765  -1.912  -1.912
   44    HG   SER   7           HG       SER 142  -0.047  -1.250  -1.250
   45    H    CYS   8           H        CYS 143  -1.411   0.818   0.818
   46    HA   CYS   8           HA       CYS 143   1.035   2.373   2.373
   47   1HB   CYS   8          1HB       CYS 143   1.074   2.424   2.424
   48   2HB   CYS   8          2HB       CYS 143   1.389   0.812   0.812
   49    H    SER   9           H        SER 144   0.797   4.436   4.436
   50    HA   SER   9           HA       SER 144  -1.797   5.711   5.711
   51   1HB   SER   9          1HB       SER 144   0.110   6.814   6.814
   52   2HB   SER   9          2HB       SER 144   1.005   6.815   6.815
   53    HG   SER   9           HG       SER 144  -0.087   8.912   8.912
   54    HA   HYP  10           HA       HYP 145  -2.436   6.096   6.096
   55   1HB   HYP  10          1HB       HYP 145  -3.324   8.837   8.837
   56   2HB   HYP  10          2HB       HYP 145  -4.087   7.771   7.771
   57    HG   HYP  10           HG       HYP 145  -5.055   7.890   7.890
   58    HD1  HYP  10           HD1      HYP 145  -5.688   5.590   5.590
   59   1HD2  HYP  10          1HD2      HYP 145  -3.696   5.721   5.721
   60   2HD2  HYP  10          2HD2      HYP 145  -3.227   7.393   7.393
   61    H    THR  11           H        THR 146  -1.131   8.793   8.793
   62    HA   THR  11           HA       THR 146   0.182  10.179  10.179
   63    HB   THR  11           HB       THR 146   1.331  11.434  11.434
   64    HG1  THR  11           HG1      THR 146   0.936  10.830  10.830
   65   1HG2  THR  11          1HG2      THR 146  -1.562  11.085  11.085
   66   2HG2  THR  11          2HG2      THR 146  -0.507  12.398  12.398
   67   3HG2  THR  11          3HG2      THR 146  -0.830  12.187  12.187
   68    H    SER  12           H        SER 147   1.108   7.374   7.374
   69    HA   SER  12           HA       SER 147   3.877   7.521   7.521
   70   1HB   SER  12          1HB       SER 147   3.310   7.676   7.676
   71   2HB   SER  12          2HB       SER 147   3.328   5.913   5.913
   72    HG   SER  12           HG       SER 147   5.485   6.769   6.769
   73    H    TYR  13           H        TYR 148   3.015   6.533   6.533
   74    HA   TYR  13           HA       TYR 148   1.970   3.895   3.895
   75   1HB   TYR  13          1HB       TYR 148   3.030   5.783   5.783
   76   2HB   TYR  13          2HB       TYR 148   2.485   4.141   4.141
   77    HD1  TYR  13           HD2      TYR 148   0.040   3.594   3.594
   78    HD2  TYR  13           HD1      TYR 148   1.562   7.454   7.454
   79    HE1  TYR  13           HE2      TYR 148  -2.308   4.468   4.468
   80    HE2  TYR  13           HE1      TYR 148  -0.790   8.301   8.301
   81    HH   TYR  13           HH       TYR 148  -3.601   6.219   6.219
   82    H    ASN  14           H        ASN 149   4.413   3.769   3.769
   83    HA   ASN  14           HA       ASN 149   6.503   2.802   2.802
   84   1HB   ASN  14          1HB       ASN 149   7.911   2.665   2.665
   85   2HB   ASN  14          2HB       ASN 149   7.280   4.275   4.275
   86   1HD2  ASN  14          1HD2      ASN 149   7.475   1.835   1.835
   87   2HD2  ASN  14          2HD2      ASN 149   6.587   2.582   2.582
   88    H    CYS  15           H        CYS 150   4.489   1.169   1.169
   89    HA   CYS  15           HA       CYS 150   4.904  -1.311  -1.311
   90   1HB   CYS  15          1HB       CYS 150   2.769  -0.519  -0.519
   91   2HB   CYS  15          2HB       CYS 150   2.834  -2.039  -2.039
   92    H    CYS  16           H        CYS 151   5.249  -3.280  -3.280
   93    HA   CYS  16           HA       CYS 151   6.559  -3.182  -3.182
   94   1HB   CYS  16          1HB       CYS 151   5.520  -5.365  -5.365
   95   2HB   CYS  16          2HB       CYS 151   5.661  -5.715  -5.715
   96    H    ARG  17           H        ARG 152   3.209  -4.104  -4.104
   97    HA   ARG  17           HA       ARG 152   2.572  -2.738  -2.738
   98   1HB   ARG  17          1HB       ARG 152   1.341  -5.153  -5.153
   99   2HB   ARG  17          2HB       ARG 152   0.414  -4.038  -4.038
  100   1HG   ARG  17          1HG       ARG 152   3.047  -5.354  -5.354
  101   2HG   ARG  17          2HG       ARG 152   1.448  -5.812  -5.812
  102   1HD   ARG  17          1HD       ARG 152   2.936  -3.223  -3.223
  103   2HD   ARG  17          2HD       ARG 152   2.549  -4.493  -4.493
  104    HE   ARG  17           HE       ARG 152   0.199  -3.865  -3.865
  105   1HH1  ARG  17          1HH2      ARG 152   2.461  -1.364  -1.364
  106   2HH1  ARG  17          2HH2      ARG 152   1.344  -0.168  -0.168
  107   1HH2  ARG  17          1HH1      ARG 152  -1.229  -2.125  -2.125
  108   2HH2  ARG  17          2HH1      ARG 152  -0.711  -0.593  -0.593
  109    H    SER  18           H        SER 153   0.951  -1.269  -1.269
  110    HA   SER  18           HA       SER 153   1.339   0.705   0.705
  111   1HB   SER  18          1HB       SER 153   0.505   1.054   1.054
  112   2HB   SER  18          2HB       SER 153  -1.077   0.408   0.408
  113    HG   SER  18           HG       SER 153  -1.051   2.792   2.792
  114    H    CYS  19           H        CYS 154   0.308   1.745   1.745
  115    HA   CYS  19           HA       CYS 154  -1.221   0.274   0.274
  116   1HB   CYS  19          1HB       CYS 154   0.406   2.096   2.096
  117   2HB   CYS  19          2HB       CYS 154  -0.739   3.263   3.263
  118    H    ASN  20           H        ASN 155  -3.253   0.135   0.135
  119    HA   ASN  20           HA       ASN 155  -5.157   1.252   1.252
  120   1HB   ASN  20          1HB       ASN 155  -5.073  -1.224  -1.224
  121   2HB   ASN  20          2HB       ASN 155  -5.562  -0.940  -0.940
  122   1HD2  ASN  20          1HD2      ASN 155  -7.642  -1.683  -1.683
  123   2HD2  ASN  20          2HD2      ASN 155  -8.869  -1.257  -1.257
  124    HA   HYP  21           HA       HYP 156  -6.111   4.226   4.226
  125   1HB   HYP  21          1HB       HYP 156  -8.231   4.798   4.798
  126   2HB   HYP  21          2HB       HYP 156  -7.288   5.944   5.944
  127    HG   HYP  21           HG       HYP 156  -6.502   5.542   5.542
  128    HD1  HYP  21           HD1      HYP 156  -4.190   5.534   5.534
  129   1HD2  HYP  21          1HD2      HYP 156  -4.898   3.321   3.321
  130   2HD2  HYP  21          2HD2      HYP 156  -6.615   3.102   3.102
  131    H    TYR  22           H        TYR 157  -8.532   2.173   2.173
  132    HA   TYR  22           HA       TYR 157 -10.677   2.646   2.646
  133   1HB   TYR  22          1HB       TYR 157 -10.220   0.414   0.414
  134   2HB   TYR  22          2HB       TYR 157 -11.698   0.675   0.675
  135    HD1  TYR  22           HD2      TYR 157 -12.701   3.156   3.156
  136    HD2  TYR  22           HD1      TYR 157 -10.032   1.392   1.392
  137    HE1  TYR  22           HE2      TYR 157 -13.216   5.021   5.021
  138    HE2  TYR  22           HE1      TYR 157 -10.550   3.262   3.262
  139    HH   TYR  22           HH       TYR 157 -12.891   5.953   5.953
  140    H    THR  23           H        THR 158  -8.142   0.212   0.212
  141    HA   THR  23           HA       THR 158  -9.301  -0.772  -0.772
  142    HB   THR  23           HB       THR 158  -7.680  -2.686  -2.686
  143    HG1  THR  23           HG1      THR 158  -6.739  -2.998  -2.998
  144   1HG2  THR  23          1HG2      THR 158  -9.674  -2.280  -2.280
  145   2HG2  THR  23          2HG2      THR 158  -8.982  -3.830  -3.830
  146   3HG2  THR  23          3HG2      THR 158 -10.049  -2.937  -2.937
  147    H    LYS  24           H        LYS 159  -6.898   1.242   1.242
  148    HA   LYS  24           HA       LYS 159  -4.942   2.146   2.146
  149   1HB   LYS  24          1HB       LYS 159  -5.776   1.119   1.119
  150   2HB   LYS  24          2HB       LYS 159  -4.448   2.246   2.246
  151   1HG   LYS  24          1HG       LYS 159  -7.230   2.854   2.854
  152   2HG   LYS  24          2HG       LYS 159  -6.785   3.175   3.175
  153   1HD   LYS  24          1HD       LYS 159  -4.994   4.655   4.655
  154   2HD   LYS  24          2HD       LYS 159  -5.319   4.271   4.271
  155   1HE   LYS  24          1HE       LYS 159  -7.575   5.356   5.356
  156   2HE   LYS  24          2HE       LYS 159  -6.284   6.475   6.475
  157   1HZ   LYS  24          1HZ       LYS 159  -7.817   4.869   4.869
  158   2HZ   LYS  24          2HZ       LYS 159  -7.998   6.337   6.337
  159   3HZ   LYS  24          3HZ       LYS 159  -6.730   5.811   5.811
  160    H    ARG  25           H        ARG 160  -5.065  -0.732  -0.732
  161    HA   ARG  25           HA       ARG 160  -2.505  -1.764  -1.764
  162   1HB   ARG  25          1HB       ARG 160  -4.883  -3.234  -3.234
  163   2HB   ARG  25          2HB       ARG 160  -3.294  -3.979  -3.979
  164   1HG   ARG  25          1HG       ARG 160  -3.453  -3.739  -3.739
  165   2HG   ARG  25          2HG       ARG 160  -4.882  -2.700  -2.700
  166   1HD   ARG  25          1HD       ARG 160  -5.653  -4.886  -4.886
  167   2HD   ARG  25          2HD       ARG 160  -6.087  -4.639  -4.639
  168    HE   ARG  25           HE       ARG 160  -3.610  -6.016  -6.016
  169   1HH1  ARG  25          1HH1      ARG 160  -7.023  -6.563  -6.563
  170   2HH1  ARG  25          2HH1      ARG 160  -6.847  -8.146  -8.146
  171   1HH2  ARG  25          1HH2      ARG 160  -3.460  -8.224  -8.224
  172   2HH2  ARG  25          2HH2      ARG 160  -4.835  -9.081  -9.081
  173    H    CYS  26           H        CYS 161  -1.016  -2.551  -2.551
  174    HA   CYS  26           HA       CYS 161  -0.829  -1.595  -1.595
  175   1HB   CYS  26          1HB       CYS 161   0.618  -3.880  -3.880
  176   2HB   CYS  26          2HB       CYS 161   1.092  -3.107  -3.107
  177    H    TYR  27           H        TYR 162  -1.377  -2.522  -2.522
  178    HA   TYR  27           HA       TYR 162  -3.333  -4.444  -4.444
  179   1HB   TYR  27          1HB       TYR 162  -1.301  -3.163  -3.163
  180   2HB   TYR  27          2HB       TYR 162  -2.243  -4.533  -4.533
  181    HD1  TYR  27           HD1      TYR 162  -4.930  -3.662  -3.662
  182    HD2  TYR  27           HD2      TYR 162  -1.983  -1.678  -1.678
  183    HE1  TYR  27           HE1      TYR 162  -6.581  -1.833  -1.833
  184    HE2  TYR  27           HE2      TYR 162  -3.613   0.164   0.164
  185    HH   TYR  27           HH       TYR 162  -5.484   1.135   1.135
  186   1H    NH2  28          1H1       TYR 162  -3.351  -6.536  -6.536
  187   2H    NH2  28          2H1       TYR 162  -2.075  -7.572  -7.572

  Start of MODEL    7
    1   1H    CYS   1          1H        CYS 163  10.617  -3.557  -3.557
    2   2H    CYS   1          2H        CYS 163  10.993  -2.350  -2.350
    3   3H    CYS   1          3H        CYS 163  11.080  -2.324  -2.324
    4    HA   CYS   1           HA       CYS 163   9.121  -1.041  -1.041
    5   1HB   CYS   1          1HB       CYS 163   7.455  -2.045  -2.045
    6   2HB   CYS   1          2HB       CYS 163   9.005  -2.432  -2.432
    7    H    LYS   2           H        LYS 164   7.028  -1.189  -1.189
    8    HA   LYS   2           HA       LYS 164   6.953  -1.943  -1.943
    9   1HB   LYS   2          1HB       LYS 164   4.788  -1.265  -1.265
   10   2HB   LYS   2          2HB       LYS 164   4.385  -1.714  -1.714
   11   1HG   LYS   2          1HG       LYS 164   6.321   0.495   0.495
   12   2HG   LYS   2          2HG       LYS 164   4.575   0.766   0.766
   13   1HD   LYS   2          1HD       LYS 164   6.017  -0.538  -0.538
   14   2HD   LYS   2          2HD       LYS 164   6.221   1.204   1.204
   15   1HE   LYS   2          1HE       LYS 164   4.449   1.027   1.027
   16   2HE   LYS   2          2HE       LYS 164   3.660   1.326   1.326
   17   1HZ   LYS   2          1HZ       LYS 164   3.900  -1.303  -1.303
   18   2HZ   LYS   2          2HZ       LYS 164   2.634  -0.517  -0.517
   19   3HZ   LYS   2          3HZ       LYS 164   3.234  -1.051  -1.051
   20    H    SER   3           H        SER 165   6.723  -4.194  -4.194
   21    HA   SER   3           HA       SER 165   5.712  -6.157  -6.157
   22   1HB   SER   3          1HB       SER 165   5.147  -6.382  -6.382
   23   2HB   SER   3          2HB       SER 165   5.150  -7.700  -7.700
   24    HG   SER   3           HG       SER 165   7.192  -7.619  -7.619
   25    HA   HYP   4           HA       HYP 166   1.486  -5.374  -5.374
   26   1HB   HYP   4          1HB       HYP 166   1.695  -8.319  -8.319
   27   2HB   HYP   4          2HB       HYP 166   0.772  -7.046  -7.046
   28    HG   HYP   4           HG       HYP 166   3.145  -7.623  -7.623
   29    HD1  HYP   4           HD1      HYP 166   3.722  -5.331  -5.331
   30   1HD2  HYP   4          1HD2      HYP 166   4.821  -6.197  -6.197
   31   2HD2  HYP   4          2HD2      HYP 166   4.392  -7.848  -7.848
   32    H    GLY   5           H        GLY 167  -0.409  -5.661  -5.661
   33   1HA   GLY   5          1HA       GLY 167  -2.080  -6.508  -6.508
   34   2HA   GLY   5          2HA       GLY 167  -0.867  -7.547  -7.547
   35    H    SER   6           H        SER 168   0.954  -5.288  -5.288
   36    HA   SER   6           HA       SER 168   0.661  -4.647  -4.647
   37   1HB   SER   6          1HB       SER 168   2.193  -3.134  -3.134
   38   2HB   SER   6          2HB       SER 168   2.484  -3.007  -3.007
   39    HG   SER   6           HG       SER 168   3.980  -4.537  -4.537
   40    H    SER   7           H        SER 169  -0.219  -3.184  -3.184
   41    HA   SER   7           HA       SER 169  -2.051  -1.211  -1.211
   42   1HB   SER   7          1HB       SER 169  -0.595  -1.153  -1.153
   43   2HB   SER   7          2HB       SER 169  -2.242  -0.613  -0.613
   44    HG   SER   7           HG       SER 169  -2.232  -2.690  -2.690
   45    H    CYS   8           H        CYS 170  -1.576   0.577   0.577
   46    HA   CYS   8           HA       CYS 170   0.873   2.126   2.126
   47   1HB   CYS   8          1HB       CYS 170   1.080   2.267   2.267
   48   2HB   CYS   8          2HB       CYS 170   1.413   0.662   0.662
   49    H    SER   9           H        SER 171   0.634   4.278   4.278
   50    HA   SER   9           HA       SER 171  -2.012   5.400   5.400
   51   1HB   SER   9          1HB       SER 171  -1.051   7.494   7.494
   52   2HB   SER   9          2HB       SER 171   0.191   6.456   6.456
   53    HG   SER   9           HG       SER 171   1.133   8.108   8.108
   54    HA   HYP  10           HA       HYP 172  -3.079   5.734   5.734
   55   1HB   HYP  10          1HB       HYP 172  -3.431   8.641   8.641
   56   2HB   HYP  10          2HB       HYP 172  -4.512   7.603   7.603
   57    HG   HYP  10           HG       HYP 172  -4.910   8.158   8.158
   58    HD1  HYP  10           HD1      HYP 172  -6.266   6.216   6.216
   59   1HD2  HYP  10          1HD2      HYP 172  -4.082   5.505   5.505
   60   2HD2  HYP  10          2HD2      HYP 172  -3.359   7.003   7.003
   61    H    THR  11           H        THR 173  -1.223   8.453   8.453
   62    HA   THR  11           HA       THR 173   0.204   9.191   9.191
   63    HB   THR  11           HB       THR 173   1.830   9.999   9.999
   64    HG1  THR  11           HG1      THR 173   0.443  10.583  10.583
   65   1HG2  THR  11          1HG2      THR 173  -0.735  11.328  11.328
   66   2HG2  THR  11          2HG2      THR 173   0.618  12.099  12.099
   67   3HG2  THR  11          3HG2      THR 173   0.842  11.468  11.468
   68    H    SER  12           H        SER 174   1.016   6.715   6.715
   69    HA   SER  12           HA       SER 174   3.715   6.503   6.503
   70   1HB   SER  12          1HB       SER 174   4.154   4.942   4.942
   71   2HB   SER  12          2HB       SER 174   3.607   6.529   6.529
   72    HG   SER  12           HG       SER 174   2.536   4.752   4.752
   73    H    TYR  13           H        TYR 175   2.538   6.070   6.070
   74    HA   TYR  13           HA       TYR 175   1.701   3.522   3.522
   75   1HB   TYR  13          1HB       TYR 175   2.856   5.891   5.891
   76   2HB   TYR  13          2HB       TYR 175   2.297   4.421   4.421
   77    HD1  TYR  13           HD1      TYR 175  -0.171   3.652   3.652
   78    HD2  TYR  13           HD2      TYR 175   1.397   7.629   7.629
   79    HE1  TYR  13           HE1      TYR 175  -2.507   4.553   4.553
   80    HE2  TYR  13           HE2      TYR 175  -0.925   8.527   8.527
   81    HH   TYR  13           HH       TYR 175  -3.022   8.205   8.205
   82    H    ASN  14           H        ASN 176   4.192   3.555   3.555
   83    HA   ASN  14           HA       ASN 176   6.353   2.741   2.741
   84   1HB   ASN  14          1HB       ASN 176   7.789   2.891   2.891
   85   2HB   ASN  14          2HB       ASN 176   6.806   4.358   4.358
   86   1HD2  ASN  14          1HD2      ASN 176   8.286   3.401   3.401
   87   2HD2  ASN  14          2HD2      ASN 176   7.215   3.212   3.212
   88    H    CYS  15           H        CYS 177   4.242   0.998   0.998
   89    HA   CYS  15           HA       CYS 177   5.154  -1.436  -1.436
   90   1HB   CYS  15          1HB       CYS 177   2.582  -1.054  -1.054
   91   2HB   CYS  15          2HB       CYS 177   2.989  -2.330  -2.330
   92    H    CYS  16           H        CYS 178   5.437  -3.330  -3.330
   93    HA   CYS  16           HA       CYS 178   6.417  -2.999  -2.999
   94   1HB   CYS  16          1HB       CYS 178   5.552  -5.436  -5.436
   95   2HB   CYS  16          2HB       CYS 178   6.092  -5.548  -5.548
   96    H    ARG  17           H        ARG 179   3.255  -4.104  -4.104
   97    HA   ARG  17           HA       ARG 179   2.201  -2.938  -2.938
   98   1HB   ARG  17          1HB       ARG 179   0.827  -4.968  -4.968
   99   2HB   ARG  17          2HB       ARG 179   0.238  -4.270  -4.270
  100   1HG   ARG  17          1HG       ARG 179   2.105  -5.341  -5.341
  101   2HG   ARG  17          2HG       ARG 179   2.675  -6.051  -6.051
  102   1HD   ARG  17          1HD       ARG 179   0.506  -7.238  -7.238
  103   2HD   ARG  17          2HD       ARG 179  -0.003  -6.569  -6.569
  104    HE   ARG  17           HE       ARG 179   1.669  -7.887  -7.887
  105   1HH1  ARG  17          1HH2      ARG 179   1.086  -8.945  -8.945
  106   2HH1  ARG  17          2HH2      ARG 179   2.062 -10.263 -10.263
  107   1HH2  ARG  17          1HH1      ARG 179   2.846  -9.807  -9.807
  108   2HH2  ARG  17          2HH1      ARG 179   3.056 -10.752 -10.752
  109    H    SER  18           H        SER 180   1.146  -1.134  -1.134
  110    HA   SER  18           HA       SER 180   1.726   0.454   0.454
  111   1HB   SER  18          1HB       SER 180   0.990   0.913   0.913
  112   2HB   SER  18          2HB       SER 180  -0.554   1.271   1.271
  113    HG   SER  18           HG       SER 180   0.841   3.204   3.204
  114    H    CYS  19           H        CYS 181   0.377   1.786   1.786
  115    HA   CYS  19           HA       CYS 181  -1.261   0.225   0.225
  116   1HB   CYS  19          1HB       CYS 181   0.443   1.971   1.971
  117   2HB   CYS  19          2HB       CYS 181  -0.689   3.200   3.200
  118    H    ASN  20           H        ASN 182  -3.310  -0.156  -0.156
  119    HA   ASN  20           HA       ASN 182  -5.116   1.417   1.417
  120   1HB   ASN  20          1HB       ASN 182  -5.412  -1.005  -1.005
  121   2HB   ASN  20          2HB       ASN 182  -5.747  -0.857  -0.857
  122   1HD2  ASN  20          1HD2      ASN 182  -7.848  -1.750  -1.750
  123   2HD2  ASN  20          2HD2      ASN 182  -9.089  -0.883  -0.883
  124    HA   HYP  21           HA       HYP 183  -5.528   4.317   4.317
  125   1HB   HYP  21          1HB       HYP 183  -7.642   5.446   5.446
  126   2HB   HYP  21          2HB       HYP 183  -6.337   6.292   6.292
  127    HG   HYP  21           HG       HYP 183  -6.038   5.869   5.869
  128    HD1  HYP  21           HD1      HYP 183  -3.715   5.410   5.410
  129   1HD2  HYP  21          1HD2      HYP 183  -4.927   3.369   3.369
  130   2HD2  HYP  21          2HD2      HYP 183  -6.694   3.501   3.501
  131    H    TYR  22           H        TYR 184  -8.326   3.007   3.007
  132    HA   TYR  22           HA       TYR 184 -10.410   3.512   3.512
  133   1HB   TYR  22          1HB       TYR 184 -10.636   2.771   2.771
  134   2HB   TYR  22          2HB       TYR 184  -9.879   1.218   1.218
  135    HD1  TYR  22           HD1      TYR 184 -12.940   3.280   3.280
  136    HD2  TYR  22           HD2      TYR 184 -11.110  -0.573  -0.573
  137    HE1  TYR  22           HE1      TYR 184 -15.205   2.241   2.241
  138    HE2  TYR  22           HE2      TYR 184 -13.370  -1.621  -1.621
  139    HH   TYR  22           HH       TYR 184 -15.543  -1.387  -1.387
  140    H    THR  23           H        THR 185  -8.269   0.685   0.685
  141    HA   THR  23           HA       THR 185  -9.470  -0.362  -0.362
  142    HB   THR  23           HB       THR 185  -8.108  -2.369  -2.369
  143    HG1  THR  23           HG1      THR 185  -6.995  -2.652  -2.652
  144   1HG2  THR  23          1HG2      THR 185  -9.830  -1.656  -1.656
  145   2HG2  THR  23          2HG2      THR 185  -9.281  -3.280  -3.280
  146   3HG2  THR  23          3HG2      THR 185 -10.343  -2.369  -2.369
  147    H    LYS  24           H        LYS 186  -6.932   1.612   1.612
  148    HA   LYS  24           HA       LYS 186  -4.874   2.237   2.237
  149   1HB   LYS  24          1HB       LYS 186  -6.301   1.769   1.769
  150   2HB   LYS  24          2HB       LYS 186  -4.564   2.121   2.121
  151   1HG   LYS  24          1HG       LYS 186  -5.053   4.067   4.067
  152   2HG   LYS  24          2HG       LYS 186  -6.775   3.772   3.772
  153   1HD   LYS  24          1HD       LYS 186  -6.252   5.477   5.477
  154   2HD   LYS  24          2HD       LYS 186  -6.199   4.014   4.014
  155   1HE   LYS  24          1HE       LYS 186  -3.794   5.475   5.475
  156   2HE   LYS  24          2HE       LYS 186  -4.406   5.597   5.597
  157   1HZ   LYS  24          1HZ       LYS 186  -3.314   3.161   3.161
  158   2HZ   LYS  24          2HZ       LYS 186  -2.602   4.012   4.012
  159   3HZ   LYS  24          3HZ       LYS 186  -3.829   3.265   3.265
  160    H    ARG  25           H        ARG 187  -4.931  -0.335  -0.335
  161    HA   ARG  25           HA       ARG 187  -2.646  -1.666  -1.666
  162   1HB   ARG  25          1HB       ARG 187  -5.113  -2.952  -2.952
  163   2HB   ARG  25          2HB       ARG 187  -3.613  -3.829  -3.829
  164   1HG   ARG  25          1HG       ARG 187  -3.856  -3.306  -3.306
  165   2HG   ARG  25          2HG       ARG 187  -5.344  -2.406  -2.406
  166   1HD   ARG  25          1HD       ARG 187  -5.332  -5.106  -5.106
  167   2HD   ARG  25          2HD       ARG 187  -5.201  -5.116  -5.116
  168    HE   ARG  25           HE       ARG 187  -7.189  -3.469  -3.469
  169   1HH1  ARG  25          1HH1      ARG 187  -6.920  -6.197  -6.197
  170   2HH1  ARG  25          2HH1      ARG 187  -8.551  -6.403  -6.403
  171   1HH2  ARG  25          1HH2      ARG 187  -9.316  -4.104  -4.104
  172   2HH2  ARG  25          2HH2      ARG 187  -9.920  -5.212  -5.212
  173    H    CYS  26           H        CYS 188  -1.146  -2.428  -2.428
  174    HA   CYS  26           HA       CYS 188  -0.728  -1.518  -1.518
  175   1HB   CYS  26          1HB       CYS 188   0.546  -3.775  -3.775
  176   2HB   CYS  26          2HB       CYS 188   1.133  -3.161  -3.161
  177    H    TYR  27           H        TYR 189  -1.463  -2.391  -2.391
  178    HA   TYR  27           HA       TYR 189  -3.220  -4.539  -4.539
  179   1HB   TYR  27          1HB       TYR 189  -1.669  -2.938  -2.938
  180   2HB   TYR  27          2HB       TYR 189  -2.587  -4.365  -4.365
  181    HD1  TYR  27           HD1      TYR 189  -5.058  -4.317  -4.317
  182    HD2  TYR  27           HD2      TYR 189  -2.755  -1.014  -1.014
  183    HE1  TYR  27           HE1      TYR 189  -7.182  -3.195  -3.195
  184    HE2  TYR  27           HE2      TYR 189  -4.871   0.127   0.127
  185    HH   TYR  27           HH       TYR 189  -7.054   0.110   0.110
  186   1H    NH2  28          1H1       TYR 189  -2.969  -6.598  -6.598
  187   2H    NH2  28          2H1       TYR 189  -1.539  -7.409  -7.409

  Start of MODEL    8
    1   1H    CYS   1          1H        CYS 190  11.044  -2.154  -2.154
    2   2H    CYS   1          2H        CYS 190  10.848  -2.674  -2.674
    3   3H    CYS   1          3H        CYS 190  10.684  -3.586  -3.586
    4    HA   CYS   1           HA       CYS 190   8.891  -1.346  -1.346
    5   1HB   CYS   1          1HB       CYS 190   7.507  -2.087  -2.087
    6   2HB   CYS   1          2HB       CYS 190   9.156  -1.806  -1.806
    7    H    LYS   2           H        LYS 191   7.027  -1.567  -1.567
    8    HA   LYS   2           HA       LYS 191   6.586  -3.599  -3.599
    9   1HB   LYS   2          1HB       LYS 191   4.881  -1.365  -1.365
   10   2HB   LYS   2          2HB       LYS 191   4.217  -2.643  -2.643
   11   1HG   LYS   2          1HG       LYS 191   5.982  -2.218  -2.218
   12   2HG   LYS   2          2HG       LYS 191   6.646  -0.941  -0.941
   13   1HD   LYS   2          1HD       LYS 191   4.611   0.357   0.357
   14   2HD   LYS   2          2HD       LYS 191   3.791  -0.966  -0.966
   15   1HE   LYS   2          1HE       LYS 191   5.172  -0.699  -0.699
   16   2HE   LYS   2          2HE       LYS 191   6.287   0.376   0.376
   17   1HZ   LYS   2          1HZ       LYS 191   3.503   1.038   1.038
   18   2HZ   LYS   2          2HZ       LYS 191   4.665   1.634   1.634
   19   3HZ   LYS   2          3HZ       LYS 191   4.442   1.943   1.943
   20    H    SER   3           H        SER 192   6.188  -5.486  -5.486
   21    HA   SER   3           HA       SER 192   5.090  -7.068  -7.068
   22   1HB   SER   3          1HB       SER 192   5.990  -7.912  -7.912
   23   2HB   SER   3          2HB       SER 192   4.694  -7.128  -7.128
   24    HG   SER   3           HG       SER 192   4.309  -9.460  -9.460
   25    HA   HYP   4           HA       HYP 193   0.657  -6.305  -6.305
   26   1HB   HYP   4          1HB       HYP 193   0.703  -9.306  -9.306
   27   2HB   HYP   4          2HB       HYP 193  -0.120  -8.297  -8.297
   28    HG   HYP   4           HG       HYP 193   2.248  -9.587  -9.587
   29    HD1  HYP   4           HD1      HYP 193   2.622  -8.036  -8.036
   30   1HD2  HYP   4          1HD2      HYP 193   3.663  -7.151  -7.151
   31   2HD2  HYP   4          2HD2      HYP 193   3.867  -8.573  -8.573
   32    H    GLY   5           H        GLY 194  -0.970  -6.127  -6.127
   33   1HA   GLY   5          1HA       GLY 194  -2.394  -6.494  -6.494
   34   2HA   GLY   5          2HA       GLY 194  -1.290  -7.754  -7.754
   35    H    SER   6           H        SER 195   0.937  -5.633  -5.633
   36    HA   SER   6           HA       SER 195   0.867  -4.689  -4.689
   37   1HB   SER   6          1HB       SER 195   2.980  -5.011  -5.011
   38   2HB   SER   6          2HB       SER 195   2.561  -3.577  -3.577
   39    HG   SER   6           HG       SER 195   4.032  -3.048  -3.048
   40    H    SER   7           H        SER 196   0.720  -2.551  -2.551
   41    HA   SER   7           HA       SER 196  -1.406  -1.017  -1.017
   42   1HB   SER   7          1HB       SER 196  -1.413  -1.485  -1.485
   43   2HB   SER   7          2HB       SER 196   0.014  -0.450  -0.450
   44    HG   SER   7           HG       SER 196  -2.003   0.736   0.736
   45    H    CYS   8           H        CYS 197  -1.295   0.934   0.934
   46    HA   CYS   8           HA       CYS 197   1.122   2.510   2.510
   47   1HB   CYS   8          1HB       CYS 197   0.874   2.533   2.533
   48   2HB   CYS   8          2HB       CYS 197   1.277   0.930   0.930
   49    H    SER   9           H        SER 198   0.733   4.505   4.505
   50    HA   SER   9           HA       SER 198  -1.777   5.748   5.748
   51   1HB   SER   9          1HB       SER 198   0.084   6.787   6.787
   52   2HB   SER   9          2HB       SER 198   1.000   6.777   6.777
   53    HG   SER   9           HG       SER 198   0.167   8.952   8.952
   54    HA   HYP  10           HA       HYP 199  -3.061   6.829   6.829
   55   1HB   HYP  10          1HB       HYP 199  -3.945   9.356   9.356
   56   2HB   HYP  10          2HB       HYP 199  -4.846   8.375   8.375
   57    HG   HYP  10           HG       HYP 199  -5.401   8.187   8.187
   58    HD1  HYP  10           HD1      HYP 199  -5.981   5.907   5.907
   59   1HD2  HYP  10          1HD2      HYP 199  -3.805   5.974   5.974
   60   2HD2  HYP  10          2HD2      HYP 199  -3.299   7.613   7.613
   61    H    THR  11           H        THR 200  -1.009   8.799   8.799
   62    HA   THR  11           HA       THR 200   0.155  10.033  10.033
   63    HB   THR  11           HB       THR 200   1.210  11.661  11.661
   64    HG1  THR  11           HG1      THR 200   0.062  12.026  12.026
   65   1HG2  THR  11          1HG2      THR 200  -1.800  11.713  11.713
   66   2HG2  THR  11          2HG2      THR 200  -0.782  13.107  13.107
   67   3HG2  THR  11          3HG2      THR 200  -0.592  12.291  12.291
   68    H    SER  12           H        SER 201   0.743   7.370   7.370
   69    HA   SER  12           HA       SER 201   3.625   7.453   7.453
   70   1HB   SER  12          1HB       SER 201   2.577   5.972   5.972
   71   2HB   SER  12          2HB       SER 201   4.256   6.278   6.278
   72    HG   SER  12           HG       SER 201   3.572   7.673   7.673
   73    H    TYR  13           H        TYR 202   2.954   6.453   6.453
   74    HA   TYR  13           HA       TYR 202   1.701   3.841   3.841
   75   1HB   TYR  13          1HB       TYR 202   2.941   5.604   5.604
   76   2HB   TYR  13          2HB       TYR 202   2.143   4.053   4.053
   77    HD1  TYR  13           HD2      TYR 202   1.597   7.611   7.611
   78    HD2  TYR  13           HD1      TYR 202  -0.233   3.829   3.829
   79    HE1  TYR  13           HE2      TYR 202  -0.682   8.640   8.640
   80    HE2  TYR  13           HE1      TYR 202  -2.511   4.858   4.858
   81    HH   TYR  13           HH       TYR 202  -2.894   8.260   8.260
   82    H    ASN  14           H        ASN 203   3.583   3.512   3.512
   83    HA   ASN  14           HA       ASN 203   6.194   2.926   2.926
   84   1HB   ASN  14          1HB       ASN 203   6.873   2.700   2.700
   85   2HB   ASN  14          2HB       ASN 203   5.960   4.196   4.196
   86   1HD2  ASN  14          1HD2      ASN 203   6.524   2.963   2.963
   87   2HD2  ASN  14          2HD2      ASN 203   5.110   2.566   2.566
   88    H    CYS  15           H        CYS 204   4.071   1.203   1.203
   89    HA   CYS  15           HA       CYS 204   4.575  -1.409  -1.409
   90   1HB   CYS  15          1HB       CYS 204   2.279  -0.468  -0.468
   91   2HB   CYS  15          2HB       CYS 204   2.442  -2.070  -2.070
   92    H    CYS  16           H        CYS 205   4.812  -3.170  -3.170
   93    HA   CYS  16           HA       CYS 205   6.359  -3.089  -3.089
   94   1HB   CYS  16          1HB       CYS 205   4.687  -5.330  -5.330
   95   2HB   CYS  16          2HB       CYS 205   5.953  -5.431  -5.431
   96    H    ARG  17           H        ARG 206   2.808  -3.789  -3.789
   97    HA   ARG  17           HA       ARG 206   2.690  -2.824  -2.824
   98   1HB   ARG  17          1HB       ARG 206   0.898  -4.850  -4.850
   99   2HB   ARG  17          2HB       ARG 206   0.581  -4.159  -4.159
  100   1HG   ARG  17          1HG       ARG 206   1.609  -6.084  -6.084
  101   2HG   ARG  17          2HG       ARG 206   3.053  -5.079  -5.079
  102   1HD   ARG  17          1HD       ARG 206   3.175  -5.978  -5.978
  103   2HD   ARG  17          2HD       ARG 206   1.935  -7.152  -7.152
  104    HE   ARG  17           HE       ARG 206   4.127  -7.057  -7.057
  105   1HH1  ARG  17          1HH2      ARG 206   3.253  -8.597  -8.597
  106   2HH1  ARG  17          2HH2      ARG 206   4.284  -9.855  -9.855
  107   1HH2  ARG  17          1HH1      ARG 206   5.533  -8.759  -8.759
  108   2HH2  ARG  17          2HH1      ARG 206   5.585  -9.945  -9.945
  109    H    SER  18           H        SER 207   2.791  -0.995  -0.995
  110    HA   SER  18           HA       SER 207   1.968   1.028   1.028
  111   1HB   SER  18          1HB       SER 207   1.241   1.108   1.108
  112   2HB   SER  18          2HB       SER 207  -0.344   0.529   0.529
  113    HG   SER  18           HG       SER 207  -0.290   2.901   2.901
  114    H    CYS  19           H        CYS 208   0.249   2.139   2.139
  115    HA   CYS  19           HA       CYS 208  -0.916   0.478   0.478
  116   1HB   CYS  19          1HB       CYS 208   0.212   2.685   2.685
  117   2HB   CYS  19          2HB       CYS 208  -1.161   3.475   3.475
  118    H    ASN  20           H        ASN 209  -3.058   0.189   0.189
  119    HA   ASN  20           HA       ASN 209  -5.051   1.395   1.395
  120   1HB   ASN  20          1HB       ASN 209  -5.017  -1.127  -1.127
  121   2HB   ASN  20          2HB       ASN 209  -5.482  -0.959  -0.959
  122   1HD2  ASN  20          1HD2      ASN 209  -7.365  -2.207  -2.207
  123   2HD2  ASN  20          2HD2      ASN 209  -8.668  -1.426  -1.426
  124    HA   HYP  21           HA       HYP 210  -5.780   4.181   4.181
  125   1HB   HYP  21          1HB       HYP 210  -7.817   5.034   5.034
  126   2HB   HYP  21          2HB       HYP 210  -6.770   6.047   6.047
  127    HG   HYP  21           HG       HYP 210  -6.008   5.671   5.671
  128    HD1  HYP  21           HD1      HYP 210  -3.707   5.315   5.315
  129   1HD2  HYP  21          1HD2      HYP 210  -4.786   3.292   3.292
  130   2HD2  HYP  21          2HD2      HYP 210  -6.546   3.313   3.313
  131    H    TYR  22           H        TYR 211  -8.239   2.455   2.455
  132    HA   TYR  22           HA       TYR 211 -10.409   2.837   2.837
  133   1HB   TYR  22          1HB       TYR 211  -9.971   0.772   0.772
  134   2HB   TYR  22          2HB       TYR 211 -11.517   1.115   1.115
  135    HD1  TYR  22           HD1      TYR 211 -12.358   3.605   3.605
  136    HD2  TYR  22           HD2      TYR 211  -9.370   1.935   1.935
  137    HE1  TYR  22           HE1      TYR 211 -12.541   5.626   5.626
  138    HE2  TYR  22           HE2      TYR 211  -9.532   3.965   3.965
  139    HH   TYR  22           HH       TYR 211 -10.456   5.915   5.915
  140    H    THR  23           H        THR 212  -7.909   0.477   0.477
  141    HA   THR  23           HA       THR 212  -9.145  -0.840  -0.840
  142    HB   THR  23           HB       THR 212  -7.564  -2.717  -2.717
  143    HG1  THR  23           HG1      THR 212  -6.510  -2.811  -2.811
  144   1HG2  THR  23          1HG2      THR 212  -9.417  -2.025  -2.025
  145   2HG2  THR  23          2HG2      THR 212  -8.752  -3.629  -3.629
  146   3HG2  THR  23          3HG2      THR 212  -9.885  -2.871  -2.871
  147    H    LYS  24           H        LYS 213  -6.782   1.355   1.355
  148    HA   LYS  24           HA       LYS 213  -4.833   2.108   2.108
  149   1HB   LYS  24          1HB       LYS 213  -5.958   0.780   0.780
  150   2HB   LYS  24          2HB       LYS 213  -4.496   1.781   1.781
  151   1HG   LYS  24          1HG       LYS 213  -7.080   2.836   2.836
  152   2HG   LYS  24          2HG       LYS 213  -6.775   2.864   2.864
  153   1HD   LYS  24          1HD       LYS 213  -4.812   4.237   4.237
  154   2HD   LYS  24          2HD       LYS 213  -4.930   4.088   4.088
  155   1HE   LYS  24          1HE       LYS 213  -7.206   5.260   5.260
  156   2HE   LYS  24          2HE       LYS 213  -5.849   6.266   6.266
  157   1HZ   LYS  24          1HZ       LYS 213  -7.561   4.742   4.742
  158   2HZ   LYS  24          2HZ       LYS 213  -7.624   6.224   6.224
  159   3HZ   LYS  24          3HZ       LYS 213  -6.419   5.589   5.589
  160    H    ARG  25           H        ARG 214  -4.787  -0.570  -0.570
  161    HA   ARG  25           HA       ARG 214  -2.400  -1.756  -1.756
  162   1HB   ARG  25          1HB       ARG 214  -4.891  -3.196  -3.196
  163   2HB   ARG  25          2HB       ARG 214  -3.313  -4.003  -4.003
  164   1HG   ARG  25          1HG       ARG 214  -2.975  -3.475  -3.475
  165   2HG   ARG  25          2HG       ARG 214  -4.427  -2.459  -2.459
  166   1HD   ARG  25          1HD       ARG 214  -4.436  -5.452  -5.452
  167   2HD   ARG  25          2HD       ARG 214  -4.765  -4.700  -4.700
  168    HE   ARG  25           HE       ARG 214  -6.554  -3.460  -3.460
  169   1HH1  ARG  25          1HH2      ARG 214  -5.920  -6.864  -6.864
  170   2HH1  ARG  25          2HH2      ARG 214  -7.423  -7.169  -7.169
  171   1HH2  ARG  25          1HH1      ARG 214  -8.543  -3.969  -3.969
  172   2HH2  ARG  25          2HH1      ARG 214  -8.907  -5.529  -5.529
  173    H    CYS  26           H        CYS 215  -0.983  -2.697  -2.697
  174    HA   CYS  26           HA       CYS 215  -0.499  -1.794  -1.794
  175   1HB   CYS  26          1HB       CYS 215   0.678  -4.111  -4.111
  176   2HB   CYS  26          2HB       CYS 215   1.322  -3.509  -3.509
  177    H    TYR  27           H        TYR 216  -0.847  -2.626  -2.626
  178    HA   TYR  27           HA       TYR 216  -2.414  -4.984  -4.984
  179   1HB   TYR  27          1HB       TYR 216  -0.960  -3.186  -3.186
  180   2HB   TYR  27          2HB       TYR 216  -2.085  -4.486  -4.486
  181    HD1  TYR  27           HD2      TYR 216  -4.538  -4.275  -4.275
  182    HD2  TYR  27           HD1      TYR 216  -1.698  -1.009  -1.009
  183    HE1  TYR  27           HE2      TYR 216  -6.380  -2.716  -2.716
  184    HE2  TYR  27           HE1      TYR 216  -3.527   0.559   0.559
  185    HH   TYR  27           HH       TYR 216  -7.012  -0.656  -0.656
  186   1H    NH2  28          1H1       TYR 216  -1.682  -6.801  -6.801
  187   2H    NH2  28          2H1       TYR 216  -0.111  -7.291  -7.291

  Start of MODEL    9
    1   1H    CYS   1          1H        CYS 217  10.684  -0.413  -0.413
    2   2H    CYS   1          2H        CYS 217  10.628  -0.935  -0.935
    3   3H    CYS   1          3H        CYS 217  10.842  -1.874  -1.874
    4    HA   CYS   1           HA       CYS 217   8.358  -0.397  -0.397
    5   1HB   CYS   1          1HB       CYS 217   7.410  -1.494  -1.494
    6   2HB   CYS   1          2HB       CYS 217   8.977  -0.858  -0.858
    7    H    LYS   2           H        LYS 218   6.654  -1.198  -1.198
    8    HA   LYS   2           HA       LYS 218   6.852  -3.272  -3.272
    9   1HB   LYS   2          1HB       LYS 218   4.576  -1.514  -1.514
   10   2HB   LYS   2          2HB       LYS 218   4.419  -2.799  -2.799
   11   1HG   LYS   2          1HG       LYS 218   6.113  -1.711  -1.711
   12   2HG   LYS   2          2HG       LYS 218   6.319  -0.442  -0.442
   13   1HD   LYS   2          1HD       LYS 218   4.031   0.291   0.291
   14   2HD   LYS   2          2HD       LYS 218   3.672  -1.086  -1.086
   15   1HE   LYS   2          1HE       LYS 218   5.006  -0.206  -0.206
   16   2HE   LYS   2          2HE       LYS 218   5.788   0.970   0.970
   17   1HZ   LYS   2          1HZ       LYS 218   2.949   1.035   1.035
   18   2HZ   LYS   2          2HZ       LYS 218   3.961   1.984   1.984
   19   3HZ   LYS   2          3HZ       LYS 218   3.608   2.024   2.024
   20    H    SER   3           H        SER 219   6.364  -5.272  -5.272
   21    HA   SER   3           HA       SER 219   5.650  -6.815  -6.815
   22   1HB   SER   3          1HB       SER 219   6.458  -7.693  -7.693
   23   2HB   SER   3          2HB       SER 219   4.856  -7.384  -7.384
   24    HG   SER   3           HG       SER 219   5.078  -9.643  -9.643
   25    HA   HYP   4           HA       HYP 220   1.343  -6.062  -6.062
   26   1HB   HYP   4          1HB       HYP 220   1.760  -9.002  -9.002
   27   2HB   HYP   4          2HB       HYP 220   0.832  -7.785  -7.785
   28    HG   HYP   4           HG       HYP 220   3.215  -8.255  -8.255
   29    HD1  HYP   4           HD1      HYP 220   3.769  -5.980  -5.980
   30   1HD2  HYP   4          1HD2      HYP 220   4.754  -6.649  -6.649
   31   2HD2  HYP   4          2HD2      HYP 220   4.473  -8.339  -8.339
   32    H    GLY   5           H        GLY 221  -0.386  -6.089  -6.089
   33   1HA   GLY   5          1HA       GLY 221  -2.094  -7.002  -7.002
   34   2HA   GLY   5          2HA       GLY 221  -0.842  -7.974  -7.974
   35    H    SER   6           H        SER 222   0.954  -5.725  -5.725
   36    HA   SER   6           HA       SER 222   0.505  -5.169  -5.169
   37   1HB   SER   6          1HB       SER 222   2.206  -3.517  -3.517
   38   2HB   SER   6          2HB       SER 222   2.335  -3.575  -3.575
   39    HG   SER   6           HG       SER 222   4.002  -4.883  -4.883
   40    H    SER   7           H        SER 223   0.178  -3.374  -3.374
   41    HA   SER   7           HA       SER 223  -1.632  -1.333  -1.333
   42   1HB   SER   7          1HB       SER 223  -1.233  -0.391  -0.391
   43   2HB   SER   7          2HB       SER 223  -1.833  -2.058  -2.058
   44    HG   SER   7           HG       SER 223  -0.077  -1.787  -1.787
   45    H    CYS   8           H        CYS 224  -1.224   0.436   0.436
   46    HA   CYS   8           HA       CYS 224   1.307   1.881   1.881
   47   1HB   CYS   8          1HB       CYS 224   1.147   2.016   2.016
   48   2HB   CYS   8          2HB       CYS 224   1.583   0.425   0.425
   49    H    SER   9           H        SER 225   1.143   3.958   3.958
   50    HA   SER   9           HA       SER 225  -1.356   5.354   5.354
   51   1HB   SER   9          1HB       SER 225   0.603   6.368   6.368
   52   2HB   SER   9          2HB       SER 225   1.440   6.298   6.298
   53    HG   SER   9           HG       SER 225   0.617   8.481   8.481
   54    HA   HYP  10           HA       HYP 226  -2.612   5.516   5.516
   55   1HB   HYP  10          1HB       HYP 226  -3.656   8.212   8.212
   56   2HB   HYP  10          2HB       HYP 226  -4.466   7.001   7.001
   57    HG   HYP  10           HG       HYP 226  -5.106   7.122   7.122
   58    HD1  HYP  10           HD1      HYP 226  -5.350   4.762   4.762
   59   1HD2  HYP  10          1HD2      HYP 226  -3.273   5.302   5.302
   60   2HD2  HYP  10          2HD2      HYP 226  -2.962   7.044   7.044
   61    H    THR  11           H        THR 227  -1.387   8.590   8.590
   62    HA   THR  11           HA       THR 227  -0.715   9.828   9.828
   63    HB   THR  11           HB       THR 227  -1.091  11.166  11.166
   64    HG1  THR  11           HG1      THR 227   0.763  12.632  12.632
   65   1HG2  THR  11          1HG2      THR 227   1.451  10.114  10.114
   66   2HG2  THR  11          2HG2      THR 227   0.506  11.499  11.499
   67   3HG2  THR  11          3HG2      THR 227  -0.198   9.875   9.875
   68    H    SER  12           H        SER 228   1.232   7.705   7.705
   69    HA   SER  12           HA       SER 228   3.695   8.207   8.207
   70   1HB   SER  12          1HB       SER 228   4.462   6.250   6.250
   71   2HB   SER  12          2HB       SER 228   3.991   7.767   7.767
   72    HG   SER  12           HG       SER 228   3.043   5.872   5.872
   73    H    TYR  13           H        TYR 229   1.178   5.824   5.824
   74    HA   TYR  13           HA       TYR 229   1.066   3.708   3.708
   75   1HB   TYR  13          1HB       TYR 229   2.262   5.520   5.520
   76   2HB   TYR  13          2HB       TYR 229   1.681   3.880   3.880
   77    HD1  TYR  13           HD2      TYR 229  -0.795   3.363   3.363
   78    HD2  TYR  13           HD1      TYR 229   0.794   7.322   7.322
   79    HE1  TYR  13           HE2      TYR 229  -3.113   4.216   4.216
   80    HE2  TYR  13           HE1      TYR 229  -1.538   8.186   8.186
   81    HH   TYR  13           HH       TYR 229  -4.425   5.894   5.894
   82    H    ASN  14           H        ASN 230   3.010   3.550   3.550
   83    HA   ASN  14           HA       ASN 230   5.602   3.105   3.105
   84   1HB   ASN  14          1HB       ASN 230   6.335   3.026   3.026
   85   2HB   ASN  14          2HB       ASN 230   5.424   4.480   4.480
   86   1HD2  ASN  14          1HD2      ASN 230   5.957   2.723   2.723
   87   2HD2  ASN  14          2HD2      ASN 230   4.504   2.660   2.660
   88    H    CYS  15           H        CYS 231   3.872   1.098   1.098
   89    HA   CYS  15           HA       CYS 231   4.785  -1.381  -1.381
   90   1HB   CYS  15          1HB       CYS 231   2.260  -0.831  -0.831
   91   2HB   CYS  15          2HB       CYS 231   2.706  -2.368  -2.368
   92    H    CYS  16           H        CYS 232   5.178  -3.101  -3.101
   93    HA   CYS  16           HA       CYS 232   6.603  -2.871  -2.871
   94   1HB   CYS  16          1HB       CYS 232   5.448  -5.333  -5.333
   95   2HB   CYS  16          2HB       CYS 232   6.703  -5.274  -5.274
   96    H    ARG  17           H        ARG 233   3.320  -4.243  -4.243
   97    HA   ARG  17           HA       ARG 233   2.620  -2.831  -2.831
   98   1HB   ARG  17          1HB       ARG 233   1.094  -5.150  -5.150
   99   2HB   ARG  17          2HB       ARG 233   0.621  -4.220  -4.220
  100   1HG   ARG  17          1HG       ARG 233   2.607  -5.010  -5.010
  101   2HG   ARG  17          2HG       ARG 233   3.131  -5.901  -5.901
  102   1HD   ARG  17          1HD       ARG 233   0.472  -6.341  -6.341
  103   2HD   ARG  17          2HD       ARG 233   1.921  -7.316  -7.316
  104    HE   ARG  17           HE       ARG 233   1.623  -7.399  -7.399
  105   1HH1  ARG  17          1HH1      ARG 233  -0.653  -8.173  -8.173
  106   2HH1  ARG  17          2HH1      ARG 233  -1.404  -9.337  -9.337
  107   1HH2  ARG  17          1HH2      ARG 233   1.014  -9.401  -9.401
  108   2HH2  ARG  17          2HH2      ARG 233  -0.413 -10.066 -10.066
  109    H    SER  18           H        SER 234   2.629  -1.108  -1.108
  110    HA   SER  18           HA       SER 234   1.706   0.716   0.716
  111   1HB   SER  18          1HB       SER 234   1.385   0.743   0.743
  112   2HB   SER  18          2HB       SER 234  -0.210   0.013   0.013
  113    HG   SER  18           HG       SER 234  -0.346   2.378   2.378
  114    H    CYS  19           H        CYS 235   0.185   1.784   1.784
  115    HA   CYS  19           HA       CYS 235  -1.297   0.059   0.059
  116   1HB   CYS  19          1HB       CYS 235   0.194   2.014   2.014
  117   2HB   CYS  19          2HB       CYS 235  -1.138   3.056   3.056
  118    H    ASN  20           H        ASN 236  -3.428   0.195   0.195
  119    HA   ASN  20           HA       ASN 236  -5.308   1.304   1.304
  120   1HB   ASN  20          1HB       ASN 236  -5.527  -1.023  -1.023
  121   2HB   ASN  20          2HB       ASN 236  -5.963  -0.168  -0.168
  122   1HD2  ASN  20          1HD2      ASN 236  -8.009  -1.566  -1.566
  123   2HD2  ASN  20          2HD2      ASN 236  -9.193  -0.842  -0.842
  124    HA   HYP  21           HA       HYP 237  -5.786   5.025   5.025
  125   1HB   HYP  21          1HB       HYP 237  -7.531   6.224   6.224
  126   2HB   HYP  21          2HB       HYP 237  -5.771   6.316   6.316
  127    HG   HYP  21           HG       HYP 237  -7.723   4.383   4.383
  128    HD1  HYP  21           HD1      HYP 237  -6.428   4.807   4.807
  129   1HD2  HYP  21          1HD2      HYP 237  -4.691   3.954   3.954
  130   2HD2  HYP  21          2HD2      HYP 237  -5.945   2.739   2.739
  131    H    TYR  22           H        TYR 238  -8.177   2.789   2.789
  132    HA   TYR  22           HA       TYR 238 -10.204   3.706   3.706
  133   1HB   TYR  22          1HB       TYR 238 -10.460   2.481   2.481
  134   2HB   TYR  22          2HB       TYR 238 -10.212   1.020   1.020
  135    HD1  TYR  22           HD1      TYR 238 -12.284   4.170   4.170
  136    HD2  TYR  22           HD2      TYR 238 -12.047  -0.015  -0.015
  137    HE1  TYR  22           HE1      TYR 238 -14.646   4.262   4.262
  138    HE2  TYR  22           HE2      TYR 238 -14.412   0.074   0.074
  139    HH   TYR  22           HH       TYR 238 -16.154   1.286   1.286
  140    H    THR  23           H        THR 239  -8.274   0.659   0.659
  141    HA   THR  23           HA       THR 239  -8.956   0.527   0.527
  142    HB   THR  23           HB       THR 239  -8.544  -1.930  -1.930
  143    HG1  THR  23           HG1      THR 239  -8.468  -2.978  -2.978
  144   1HG2  THR  23          1HG2      THR 239 -10.680  -0.896  -0.896
  145   2HG2  THR  23          2HG2      THR 239 -10.640  -2.508  -2.508
  146   3HG2  THR  23          3HG2      THR 239 -10.859  -1.075  -1.075
  147    H    LYS  24           H        LYS 240  -6.513   1.740   1.740
  148    HA   LYS  24           HA       LYS 240  -4.437   2.271   2.271
  149   1HB   LYS  24          1HB       LYS 240  -5.119   1.178   1.178
  150   2HB   LYS  24          2HB       LYS 240  -4.187   2.614   2.614
  151   1HG   LYS  24          1HG       LYS 240  -7.187   2.301   2.301
  152   2HG   LYS  24          2HG       LYS 240  -6.254   3.248   3.248
  153   1HD   LYS  24          1HD       LYS 240  -5.582   4.810   4.810
  154   2HD   LYS  24          2HD       LYS 240  -6.297   3.805   3.805
  155   1HE   LYS  24          1HE       LYS 240  -8.535   4.156   4.156
  156   2HE   LYS  24          2HE       LYS 240  -7.779   5.262   5.262
  157   1HZ   LYS  24          1HZ       LYS 240  -7.752   5.665   5.665
  158   2HZ   LYS  24          2HZ       LYS 240  -8.600   6.451   6.451
  159   3HZ   LYS  24          3HZ       LYS 240  -7.117   6.596   6.596
  160    H    ARG  25           H        ARG 241  -4.622  -0.245  -0.245
  161    HA   ARG  25           HA       ARG 241  -2.567  -1.906  -1.906
  162   1HB   ARG  25          1HB       ARG 241  -5.176  -2.879  -2.879
  163   2HB   ARG  25          2HB       ARG 241  -3.758  -3.923  -3.923
  164   1HG   ARG  25          1HG       ARG 241  -3.743  -3.277  -3.277
  165   2HG   ARG  25          2HG       ARG 241  -5.305  -2.486  -2.486
  166   1HD   ARG  25          1HD       ARG 241  -4.881  -5.365  -5.365
  167   2HD   ARG  25          2HD       ARG 241  -5.260  -4.922  -4.922
  168    HE   ARG  25           HE       ARG 241  -7.366  -4.108  -4.108
  169   1HH1  ARG  25          1HH1      ARG 241  -5.777  -6.021  -6.021
  170   2HH1  ARG  25          2HH1      ARG 241  -7.169  -6.291  -6.291
  171   1HH2  ARG  25          1HH2      ARG 241  -9.216  -4.847  -4.847
  172   2HH2  ARG  25          2HH2      ARG 241  -9.145  -5.625  -5.625
  173    H    CYS  26           H        CYS 242  -1.130  -2.805  -2.805
  174    HA   CYS  26           HA       CYS 242  -0.667  -1.939  -1.939
  175   1HB   CYS  26          1HB       CYS 242   0.362  -4.439  -4.439
  176   2HB   CYS  26          2HB       CYS 242   1.051  -3.680  -3.680
  177    H    TYR  27           H        TYR 243  -1.279  -2.771  -2.771
  178    HA   TYR  27           HA       TYR 243  -3.105  -4.918  -4.918
  179   1HB   TYR  27          1HB       TYR 243  -1.415  -3.389  -3.389
  180   2HB   TYR  27          2HB       TYR 243  -2.633  -4.600  -4.600
  181    HD1  TYR  27           HD1      TYR 243  -4.779  -3.763  -3.763
  182    HD2  TYR  27           HD2      TYR 243  -2.299  -1.541  -1.541
  183    HE1  TYR  27           HE1      TYR 243  -6.599  -2.055  -2.055
  184    HE2  TYR  27           HE2      TYR 243  -4.102   0.189   0.189
  185    HH   TYR  27           HH       TYR 243  -6.092   0.863   0.863
  186   1H    NH2  28          1H1       TYR 243  -2.658  -6.956  -6.956
  187   2H    NH2  28          2H1       TYR 243  -1.165  -7.648  -7.648

  Start of MODEL   10
    1   1H    CYS   1          1H        CYS 244  10.935  -3.855  -3.855
    2   2H    CYS   1          2H        CYS 244  11.383  -2.467  -2.467
    3   3H    CYS   1          3H        CYS 244  11.215  -2.895  -2.895
    4    HA   CYS   1           HA       CYS 244   9.357  -1.460  -1.460
    5   1HB   CYS   1          1HB       CYS 244   7.840  -2.145  -2.145
    6   2HB   CYS   1          2HB       CYS 244   9.482  -1.860  -1.860
    7    H    LYS   2           H        LYS 245   7.353  -1.648  -1.648
    8    HA   LYS   2           HA       LYS 245   6.706  -3.672  -3.672
    9   1HB   LYS   2          1HB       LYS 245   5.278  -1.253  -1.253
   10   2HB   LYS   2          2HB       LYS 245   4.363  -2.487  -2.487
   11   1HG   LYS   2          1HG       LYS 245   5.939  -2.227  -2.227
   12   2HG   LYS   2          2HG       LYS 245   6.743  -0.915  -0.915
   13   1HD   LYS   2          1HD       LYS 245   4.594   0.290   0.290
   14   2HD   LYS   2          2HD       LYS 245   3.796  -1.019  -1.019
   15   1HE   LYS   2          1HE       LYS 245   4.878  -0.463  -0.463
   16   2HE   LYS   2          2HE       LYS 245   6.134   0.478   0.478
   17   1HZ   LYS   2          1HZ       LYS 245   3.306   1.250   1.250
   18   2HZ   LYS   2          2HZ       LYS 245   4.370   1.929   1.929
   19   3HZ   LYS   2          3HZ       LYS 245   4.364   2.042   2.042
   20    H    SER   3           H        SER 246   6.445  -5.549  -5.549
   21    HA   SER   3           HA       SER 246   5.252  -6.970  -6.970
   22   1HB   SER   3          1HB       SER 246   5.972  -7.846  -7.846
   23   2HB   SER   3          2HB       SER 246   4.443  -7.251  -7.251
   24    HG   SER   3           HG       SER 246   4.313  -9.561  -9.561
   25    HA   HYP   4           HA       HYP 247   0.986  -5.885  -5.885
   26   1HB   HYP   4          1HB       HYP 247   0.993  -8.901  -8.901
   27   2HB   HYP   4          2HB       HYP 247   0.174  -7.645  -7.645
   28    HG   HYP   4           HG       HYP 247   2.503  -8.574  -8.574
   29    HD1  HYP   4           HD1      HYP 247   3.221  -6.432  -6.432
   30   1HD2  HYP   4          1HD2      HYP 247   4.246  -6.937  -6.937
   31   2HD2  HYP   4          2HD2      HYP 247   3.835  -8.522  -8.522
   32    H    GLY   5           H        GLY 248  -0.525  -5.699  -5.699
   33   1HA   GLY   5          1HA       GLY 248  -2.123  -6.569  -6.569
   34   2HA   GLY   5          2HA       GLY 248  -0.829  -7.621  -7.621
   35    H    SER   6           H        SER 249   1.074  -5.302  -5.302
   36    HA   SER   6           HA       SER 249   0.968  -4.641  -4.641
   37   1HB   SER   6          1HB       SER 249   2.483  -3.039  -3.039
   38   2HB   SER   6          2HB       SER 249   2.873  -3.242  -3.242
   39    HG   SER   6           HG       SER 249   4.305  -4.520  -4.520
   40    H    SER   7           H        SER 250   0.149  -2.995  -2.995
   41    HA   SER   7           HA       SER 250  -1.494  -0.936  -0.936
   42   1HB   SER   7          1HB       SER 250   0.299  -0.981  -0.981
   43   2HB   SER   7          2HB       SER 250  -1.048   0.138   0.138
   44    HG   SER   7           HG       SER 250  -1.696  -1.712  -1.712
   45    H    CYS   8           H        CYS 251  -1.277   0.929   0.929
   46    HA   CYS   8           HA       CYS 251   1.172   2.439   2.439
   47   1HB   CYS   8          1HB       CYS 251   0.878   2.548   2.548
   48   2HB   CYS   8          2HB       CYS 251   1.245   0.913   0.913
   49    H    SER   9           H        SER 252   0.676   4.559   4.559
   50    HA   SER   9           HA       SER 252  -2.026   5.518   5.518
   51   1HB   SER   9          1HB       SER 252  -1.190   7.579   7.579
   52   2HB   SER   9          2HB       SER 252   0.176   6.549   6.549
   53    HG   SER   9           HG       SER 252   0.884   8.488   8.488
   54    HA   HYP  10           HA       HYP 253  -3.102   6.512   6.512
   55   1HB   HYP  10          1HB       HYP 253  -4.092   9.060   9.060
   56   2HB   HYP  10          2HB       HYP 253  -4.901   8.059   8.059
   57    HG   HYP  10           HG       HYP 253  -5.631   7.751   7.751
   58    HD1  HYP  10           HD1      HYP 253  -5.809   5.371   5.371
   59   1HD2  HYP  10          1HD2      HYP 253  -3.840   5.915   5.915
   60   2HD2  HYP  10          2HD2      HYP 253  -3.518   7.645   7.645
   61    H    THR  11           H        THR 254  -1.235   8.891   8.891
   62    HA   THR  11           HA       THR 254  -0.163  10.073  10.073
   63    HB   THR  11           HB       THR 254   1.536  11.058  11.058
   64    HG1  THR  11           HG1      THR 254   0.727  11.186  11.186
   65   1HG2  THR  11          1HG2      THR 254  -1.377  11.801  11.801
   66   2HG2  THR  11          2HG2      THR 254  -0.013  12.810  12.810
   67   3HG2  THR  11          3HG2      THR 254  -0.204  12.372  12.372
   68    H    SER  12           H        SER 255   0.680   7.302   7.302
   69    HA   SER  12           HA       SER 255   3.386   7.288   7.288
   70   1HB   SER  12          1HB       SER 255   4.196   6.127   6.127
   71   2HB   SER  12          2HB       SER 255   3.419   7.641   7.641
   72    HG   SER  12           HG       SER 255   2.831   5.841   5.841
   73    H    TYR  13           H        TYR 256   2.920   6.327   6.327
   74    HA   TYR  13           HA       TYR 256   1.868   3.666   3.666
   75   1HB   TYR  13          1HB       TYR 256   3.196   5.557   5.557
   76   2HB   TYR  13          2HB       TYR 256   2.571   3.957   3.957
   77    HD1  TYR  13           HD1      TYR 256   0.175   3.415   3.415
   78    HD2  TYR  13           HD2      TYR 256   1.659   7.464   7.464
   79    HE1  TYR  13           HE1      TYR 256  -2.160   4.210   4.210
   80    HE2  TYR  13           HE2      TYR 256  -0.679   8.256   8.256
   81    HH   TYR  13           HH       TYR 256  -2.816   7.689   7.689
   82    H    ASN  14           H        ASN 257   3.729   3.521   3.521
   83    HA   ASN  14           HA       ASN 257   6.414   2.867   2.867
   84   1HB   ASN  14          1HB       ASN 257   6.990   2.972   2.972
   85   2HB   ASN  14          2HB       ASN 257   6.055   4.408   4.408
   86   1HD2  ASN  14          1HD2      ASN 257   6.514   2.245   2.245
   87   2HD2  ASN  14          2HD2      ASN 257   5.068   2.255   2.255
   88    H    CYS  15           H        CYS 258   4.568   1.180   1.180
   89    HA   CYS  15           HA       CYS 258   4.870  -1.377  -1.377
   90   1HB   CYS  15          1HB       CYS 258   2.706  -0.398  -0.398
   91   2HB   CYS  15          2HB       CYS 258   2.771  -2.000  -2.000
   92    H    CYS  16           H        CYS 259   5.111  -3.199  -3.199
   93    HA   CYS  16           HA       CYS 259   6.532  -3.253  -3.253
   94   1HB   CYS  16          1HB       CYS 259   5.007  -5.472  -5.472
   95   2HB   CYS  16          2HB       CYS 259   6.203  -5.685  -5.685
   96    H    ARG  17           H        ARG 260   3.123  -4.201  -4.201
   97    HA   ARG  17           HA       ARG 260   2.580  -2.863  -2.863
   98   1HB   ARG  17          1HB       ARG 260   0.843  -4.913  -4.913
   99   2HB   ARG  17          2HB       ARG 260   0.510  -4.061  -4.061
  100   1HG   ARG  17          1HG       ARG 260   2.414  -5.145  -5.145
  101   2HG   ARG  17          2HG       ARG 260   2.842  -5.939  -5.939
  102   1HD   ARG  17          1HD       ARG 260   0.172  -6.330  -6.330
  103   2HD   ARG  17          2HD       ARG 260   1.574  -7.376  -7.376
  104    HE   ARG  17           HE       ARG 260   1.282  -7.374  -7.374
  105   1HH1  ARG  17          1HH2      ARG 260  -0.893  -8.292  -8.292
  106   2HH1  ARG  17          2HH2      ARG 260  -1.724  -9.345  -9.345
  107   1HH2  ARG  17          1HH1      ARG 260   0.107  -8.860  -8.860
  108   2HH2  ARG  17          2HH1      ARG 260  -1.158  -9.670  -9.670
  109    H    SER  18           H        SER 261   2.053  -0.946  -0.946
  110    HA   SER  18           HA       SER 261   1.776   0.851   0.851
  111   1HB   SER  18          1HB       SER 261  -0.442   0.486   0.486
  112   2HB   SER  18          2HB       SER 261   0.019   2.003   2.003
  113    HG   SER  18           HG       SER 261   1.035   1.782   1.782
  114    H    CYS  19           H        CYS 262   0.415   2.033   2.033
  115    HA   CYS  19           HA       CYS 262  -1.070   0.537   0.537
  116   1HB   CYS  19          1HB       CYS 262   0.286   2.631   2.631
  117   2HB   CYS  19          2HB       CYS 262  -1.003   3.551   3.551
  118    H    ASN  20           H        ASN 263  -3.219   0.268   0.268
  119    HA   ASN  20           HA       ASN 263  -5.034   1.425   1.425
  120   1HB   ASN  20          1HB       ASN 263  -5.024  -1.025  -1.025
  121   2HB   ASN  20          2HB       ASN 263  -5.580  -0.786  -0.786
  122   1HD2  ASN  20          1HD2      ASN 263  -7.191  -2.297  -2.297
  123   2HD2  ASN  20          2HD2      ASN 263  -8.554  -1.504  -1.504
  124    HA   HYP  21           HA       HYP 264  -6.216   4.530   4.530
  125   1HB   HYP  21          1HB       HYP 264  -8.231   4.720   4.720
  126   2HB   HYP  21          2HB       HYP 264  -7.674   6.011   6.011
  127    HG   HYP  21           HG       HYP 264  -6.397   5.808   5.808
  128    HD1  HYP  21           HD1      HYP 264  -4.281   6.126   6.126
  129   1HD2  HYP  21          1HD2      HYP 264  -4.571   3.799   3.799
  130   2HD2  HYP  21          2HD2      HYP 264  -6.125   3.378   3.378
  131    H    TYR  22           H        TYR 265  -8.495   2.388   2.388
  132    HA   TYR  22           HA       TYR 265 -10.711   2.565   2.565
  133   1HB   TYR  22          1HB       TYR 265 -10.677   1.620   1.620
  134   2HB   TYR  22          2HB       TYR 265  -9.653   0.283   0.283
  135    HD1  TYR  22           HD2      TYR 265 -12.852   1.883   1.883
  136    HD2  TYR  22           HD1      TYR 265 -10.748  -1.718  -1.718
  137    HE1  TYR  22           HE2      TYR 265 -14.782   0.498   0.498
  138    HE2  TYR  22           HE1      TYR 265 -12.700  -3.107  -3.107
  139    HH   TYR  22           HH       TYR 265 -15.740  -1.463  -1.463
  140    H    THR  23           H        THR 266  -7.973   0.361   0.361
  141    HA   THR  23           HA       THR 266  -9.063  -0.802  -0.802
  142    HB   THR  23           HB       THR 266  -7.314  -2.602  -2.602
  143    HG1  THR  23           HG1      THR 266  -6.357  -2.676  -2.676
  144   1HG2  THR  23          1HG2      THR 266  -9.331  -2.165  -2.165
  145   2HG2  THR  23          2HG2      THR 266  -8.523  -3.693  -3.693
  146   3HG2  THR  23          3HG2      THR 266  -9.656  -2.976  -2.976
  147    H    LYS  24           H        LYS 267  -6.871   1.481   1.481
  148    HA   LYS  24           HA       LYS 267  -4.737   2.167   2.167
  149   1HB   LYS  24          1HB       LYS 267  -6.034   1.984   1.984
  150   2HB   LYS  24          2HB       LYS 267  -4.344   2.498   2.498
  151   1HG   LYS  24          1HG       LYS 267  -4.872   4.291   4.291
  152   2HG   LYS  24          2HG       LYS 267  -6.416   3.573   3.573
  153   1HD   LYS  24          1HD       LYS 267  -5.954   4.560   4.560
  154   2HD   LYS  24          2HD       LYS 267  -6.467   5.649   5.649
  155   1HE   LYS  24          1HE       LYS 267  -7.980   3.108   3.108
  156   2HE   LYS  24          2HE       LYS 267  -8.329   4.659   4.659
  157   1HZ   LYS  24          1HZ       LYS 267  -8.496   4.216   4.216
  158   2HZ   LYS  24          2HZ       LYS 267  -9.684   4.351   4.351
  159   3HZ   LYS  24          3HZ       LYS 267  -8.790   5.521   5.521
  160    H    ARG  25           H        ARG 268  -4.779  -0.449  -0.449
  161    HA   ARG  25           HA       ARG 268  -2.376  -1.637  -1.637
  162   1HB   ARG  25          1HB       ARG 268  -5.042  -2.968  -2.968
  163   2HB   ARG  25          2HB       ARG 268  -3.534  -3.898  -3.898
  164   1HG   ARG  25          1HG       ARG 268  -3.091  -3.326  -3.326
  165   2HG   ARG  25          2HG       ARG 268  -4.394  -2.124  -2.124
  166   1HD   ARG  25          1HD       ARG 268  -4.923  -5.053  -5.053
  167   2HD   ARG  25          2HD       ARG 268  -4.848  -4.358  -4.358
  168    HE   ARG  25           HE       ARG 268  -6.608  -2.762  -2.762
  169   1HH1  ARG  25          1HH2      ARG 268  -6.505  -5.734  -5.734
  170   2HH1  ARG  25          2HH2      ARG 268  -8.123  -6.020  -6.020
  171   1HH2  ARG  25          1HH1      ARG 268  -8.860  -3.041  -3.041
  172   2HH2  ARG  25          2HH1      ARG 268  -9.478  -4.467  -4.467
  173    H    CYS  26           H        CYS 269  -1.008  -2.422  -2.422
  174    HA   CYS  26           HA       CYS 269  -0.831  -1.557  -1.557
  175   1HB   CYS  26          1HB       CYS 269   0.501  -3.980  -3.980
  176   2HB   CYS  26          2HB       CYS 269   1.002  -3.137  -3.137
  177    H    TYR  27           H        TYR 270  -1.317  -2.395  -2.395
  178    HA   TYR  27           HA       TYR 270  -3.248  -4.394  -4.394
  179   1HB   TYR  27          1HB       TYR 270  -1.365  -2.796  -2.796
  180   2HB   TYR  27          2HB       TYR 270  -2.286  -4.137  -4.137
  181    HD1  TYR  27           HD1      TYR 270  -4.942  -4.037  -4.037
  182    HD2  TYR  27           HD2      TYR 270  -2.194  -0.720  -0.720
  183    HE1  TYR  27           HE1      TYR 270  -6.869  -2.500  -2.500
  184    HE2  TYR  27           HE2      TYR 270  -4.121   0.817   0.817
  185    HH   TYR  27           HH       TYR 270  -6.271   1.113   1.113
  186   1H    NH2  28          1H1       TYR 270  -2.824  -6.255  -6.255
  187   2H    NH2  28          2H1       TYR 270  -1.486  -7.185  -7.185

  Start of MODEL   11
    1   1H    CYS   1          1H        CYS 271  10.690  -2.592  -2.592
    2   2H    CYS   1          2H        CYS 271  10.803  -1.235  -1.235
    3   3H    CYS   1          3H        CYS 271  10.561  -1.380  -1.380
    4    HA   CYS   1           HA       CYS 271   8.488  -0.690  -0.690
    5   1HB   CYS   1          1HB       CYS 271   7.569  -1.779  -1.779
    6   2HB   CYS   1          2HB       CYS 271   9.301  -1.881  -1.881
    7    H    LYS   2           H        LYS 272   6.483  -1.357  -1.357
    8    HA   LYS   2           HA       LYS 272   6.404  -3.512  -3.512
    9   1HB   LYS   2          1HB       LYS 272   4.547  -1.298  -1.298
   10   2HB   LYS   2          2HB       LYS 272   3.912  -2.695  -2.695
   11   1HG   LYS   2          1HG       LYS 272   5.446  -2.306  -2.306
   12   2HG   LYS   2          2HG       LYS 272   6.273  -1.028  -1.028
   13   1HD   LYS   2          1HD       LYS 272   4.092   0.213   0.213
   14   2HD   LYS   2          2HD       LYS 272   3.420  -1.012  -1.012
   15   1HE   LYS   2          1HE       LYS 272   4.830  -0.349  -0.349
   16   2HE   LYS   2          2HE       LYS 272   5.908   0.558   0.558
   17   1HZ   LYS   2          1HZ       LYS 272   3.120   1.278   1.278
   18   2HZ   LYS   2          2HZ       LYS 272   4.283   2.023   2.023
   19   3HZ   LYS   2          3HZ       LYS 272   4.028   2.041   2.041
   20    H    SER   3           H        SER 273   6.036  -5.369  -5.369
   21    HA   SER   3           HA       SER 273   5.453  -6.830  -6.830
   22   1HB   SER   3          1HB       SER 273   4.569  -7.478  -7.478
   23   2HB   SER   3          2HB       SER 273   4.744  -8.640  -8.640
   24    HG   SER   3           HG       SER 273   6.643  -8.653  -8.653
   25    HA   HYP   4           HA       HYP 274   1.232  -5.908  -5.908
   26   1HB   HYP   4          1HB       HYP 274   1.461  -8.825  -8.825
   27   2HB   HYP   4          2HB       HYP 274   0.676  -7.487  -7.487
   28    HG   HYP   4           HG       HYP 274   3.139  -8.142  -8.142
   29    HD1  HYP   4           HD1      HYP 274   3.786  -5.867  -5.867
   30   1HD2  HYP   4          1HD2      HYP 274   4.633  -6.683  -6.683
   31   2HD2  HYP   4          2HD2      HYP 274   4.216  -8.364  -8.364
   32    H    GLY   5           H        GLY 275  -0.569  -5.994  -5.994
   33   1HA   GLY   5          1HA       GLY 275  -2.211  -6.952  -6.952
   34   2HA   GLY   5          2HA       GLY 275  -0.924  -7.980  -7.980
   35    H    SER   6           H        SER 276   0.977  -5.821  -5.821
   36    HA   SER   6           HA       SER 276   0.531  -5.254  -5.254
   37   1HB   SER   6          1HB       SER 276   2.532  -3.970  -3.970
   38   2HB   SER   6          2HB       SER 276   2.535  -3.820  -3.820
   39    HG   SER   6           HG       SER 276   4.101  -5.435  -5.435
   40    H    SER   7           H        SER 277   0.273  -3.451  -3.451
   41    HA   SER   7           HA       SER 277  -1.451  -1.371  -1.371
   42   1HB   SER   7          1HB       SER 277   0.423  -1.337  -1.337
   43   2HB   SER   7          2HB       SER 277  -1.117  -0.479  -0.479
   44    HG   SER   7           HG       SER 277  -1.339  -2.412  -2.412
   45    H    CYS   8           H        CYS 278  -1.088   0.399   0.399
   46    HA   CYS   8           HA       CYS 278   1.517   1.665   1.665
   47   1HB   CYS   8          1HB       CYS 278   1.288   1.675   1.675
   48   2HB   CYS   8          2HB       CYS 278   1.345   0.026   0.026
   49    H    SER   9           H        SER 279   1.388   3.585   3.585
   50    HA   SER   9           HA       SER 279  -0.818   5.322   5.322
   51   1HB   SER   9          1HB       SER 279   1.408   6.012   6.012
   52   2HB   SER   9          2HB       SER 279   2.005   5.899   5.899
   53    HG   SER   9           HG       SER 279   1.479   8.145   8.145
   54    HA   HYP  10           HA       HYP 280  -2.673   5.277   5.277
   55   1HB   HYP  10          1HB       HYP 280  -3.800   7.776   7.776
   56   2HB   HYP  10          2HB       HYP 280  -4.643   6.576   6.576
   57    HG   HYP  10           HG       HYP 280  -4.861   6.418   6.418
   58    HD1  HYP  10           HD1      HYP 280  -4.853   4.033   4.033
   59   1HD2  HYP  10          1HD2      HYP 280  -2.761   4.764   4.764
   60   2HD2  HYP  10          2HD2      HYP 280  -2.642   6.519   6.519
   61    H    THR  11           H        THR 281  -1.461   8.265   8.265
   62    HA   THR  11           HA       THR 281  -1.074   9.629   9.629
   63    HB   THR  11           HB       THR 281   0.073  11.294  11.294
   64    HG1  THR  11           HG1      THR 281  -0.393  10.861  10.861
   65   1HG2  THR  11          1HG2      THR 281  -2.791  10.542  10.542
   66   2HG2  THR  11          2HG2      THR 281  -2.009  12.073  12.073
   67   3HG2  THR  11          3HG2      THR 281  -2.205  11.621  11.621
   68    H    SER  12           H        SER 282   0.868   7.433   7.433
   69    HA   SER  12           HA       SER 282   3.382   8.501   8.501
   70   1HB   SER  12          1HB       SER 282   3.108   6.298   6.298
   71   2HB   SER  12          2HB       SER 282   4.540   7.272   7.272
   72    HG   SER  12           HG       SER 282   3.506   7.965   7.965
   73    H    TYR  13           H        TYR 283   1.298   5.815   5.815
   74    HA   TYR  13           HA       TYR 283   1.293   3.808   3.808
   75   1HB   TYR  13          1HB       TYR 283   2.772   5.500   5.500
   76   2HB   TYR  13          2HB       TYR 283   2.154   3.874   3.874
   77    HD1  TYR  13           HD2      TYR 283  -0.407   3.585   3.585
   78    HD2  TYR  13           HD1      TYR 283   1.398   7.213   7.213
   79    HE1  TYR  13           HE2      TYR 283  -2.681   4.547   4.547
   80    HE2  TYR  13           HE1      TYR 283  -0.875   8.186   8.186
   81    HH   TYR  13           HH       TYR 283  -3.882   6.310   6.310
   82    H    ASN  14           H        ASN 284   3.058   3.571   3.571
   83    HA   ASN  14           HA       ASN 284   5.759   3.012   3.012
   84   1HB   ASN  14          1HB       ASN 284   6.367   3.063   3.063
   85   2HB   ASN  14          2HB       ASN 284   5.309   4.432   4.432
   86   1HD2  ASN  14          1HD2      ASN 284   6.044   2.417   2.417
   87   2HD2  ASN  14          2HD2      ASN 284   4.627   2.248   2.248
   88    H    CYS  15           H        CYS 285   4.015   1.116   1.116
   89    HA   CYS  15           HA       CYS 285   4.639  -1.435  -1.435
   90   1HB   CYS  15          1HB       CYS 285   2.449  -0.837  -0.837
   91   2HB   CYS  15          2HB       CYS 285   2.697  -2.337  -2.337
   92    H    CYS  16           H        CYS 286   5.286  -3.090  -3.090
   93    HA   CYS  16           HA       CYS 286   6.577  -2.374  -2.374
   94   1HB   CYS  16          1HB       CYS 286   5.861  -4.953  -4.953
   95   2HB   CYS  16          2HB       CYS 286   6.210  -4.989  -4.989
   96    H    ARG  17           H        ARG 287   3.304  -3.563  -3.563
   97    HA   ARG  17           HA       ARG 287   2.818  -2.817  -2.817
   98   1HB   ARG  17          1HB       ARG 287   1.247  -4.657  -4.657
   99   2HB   ARG  17          2HB       ARG 287   0.806  -4.205  -4.205
  100   1HG   ARG  17          1HG       ARG 287   2.767  -5.331  -5.331
  101   2HG   ARG  17          2HG       ARG 287   3.342  -5.681  -5.681
  102   1HD   ARG  17          1HD       ARG 287   2.220  -7.646  -7.646
  103   2HD   ARG  17          2HD       ARG 287   1.331  -7.043  -7.043
  104    HE   ARG  17           HE       ARG 287   0.272  -5.826  -5.826
  105   1HH1  ARG  17          1HH1      ARG 287   0.356  -9.089  -9.089
  106   2HH1  ARG  17          2HH1      ARG 287  -1.074  -9.487  -9.487
  107   1HH2  ARG  17          1HH2      ARG 287  -1.956  -6.308  -6.308
  108   2HH2  ARG  17          2HH2      ARG 287  -2.407  -7.887  -7.887
  109    H    SER  18           H        SER 288   2.839  -0.821  -0.821
  110    HA   SER  18           HA       SER 288   1.800   1.139   1.139
  111   1HB   SER  18          1HB       SER 288   1.222   1.275   1.275
  112   2HB   SER  18          2HB       SER 288  -0.233   0.301   0.301
  113    HG   SER  18           HG       SER 288  -0.724   2.612   2.612
  114    H    CYS  19           H        CYS 289  -0.229   2.033   2.033
  115    HA   CYS  19           HA       CYS 289  -1.319   0.252   0.252
  116   1HB   CYS  19          1HB       CYS 289   0.340   2.081   2.081
  117   2HB   CYS  19          2HB       CYS 289  -0.861   3.259   3.259
  118    H    ASN  20           H        ASN 290  -3.380  -0.115  -0.115
  119    HA   ASN  20           HA       ASN 290  -5.301   1.281   1.281
  120   1HB   ASN  20          1HB       ASN 290  -5.476  -1.187  -1.187
  121   2HB   ASN  20          2HB       ASN 290  -5.882  -0.761  -0.761
  122   1HD2  ASN  20          1HD2      ASN 290  -8.049  -0.766  -0.766
  123   2HD2  ASN  20          2HD2      ASN 290  -9.229  -0.372  -0.372
  124    HA   HYP  21           HA       HYP 291  -5.663   4.648   4.648
  125   1HB   HYP  21          1HB       HYP 291  -8.021   5.285   5.285
  126   2HB   HYP  21          2HB       HYP 291  -6.665   6.315   6.315
  127    HG   HYP  21           HG       HYP 291  -6.657   5.317   5.317
  128    HD1  HYP  21           HD1      HYP 291  -4.295   5.014   5.014
  129   1HD2  HYP  21          1HD2      HYP 291  -5.409   2.925   2.925
  130   2HD2  HYP  21          2HD2      HYP 291  -7.173   2.994   2.994
  131    H    TYR  22           H        TYR 292  -8.659   2.981   2.981
  132    HA   TYR  22           HA       TYR 292 -10.313   3.716   3.716
  133   1HB   TYR  22          1HB       TYR 292 -10.331   1.061   1.061
  134   2HB   TYR  22          2HB       TYR 292 -11.671   1.802   1.802
  135    HD1  TYR  22           HD1      TYR 292 -12.163   4.382   4.382
  136    HD2  TYR  22           HD2      TYR 292 -10.459   1.133   1.133
  137    HE1  TYR  22           HE1      TYR 292 -12.858   5.534   5.534
  138    HE2  TYR  22           HE2      TYR 292 -11.130   2.289   2.289
  139    HH   TYR  22           HH       TYR 292 -12.181   3.939   3.939
  140    H    THR  23           H        THR 293  -8.098   0.947   0.947
  141    HA   THR  23           HA       THR 293  -9.007  -0.016  -0.016
  142    HB   THR  23           HB       THR 293  -7.547  -1.992  -1.992
  143    HG1  THR  23           HG1      THR 293  -6.954  -2.348  -2.348
  144   1HG2  THR  23          1HG2      THR 293  -9.792  -1.394  -1.394
  145   2HG2  THR  23          2HG2      THR 293  -9.159  -3.001  -3.001
  146   3HG2  THR  23          3HG2      THR 293  -9.991  -2.048  -2.048
  147    H    LYS  24           H        LYS 294  -6.348   1.789   1.789
  148    HA   LYS  24           HA       LYS 294  -4.207   2.268   2.268
  149   1HB   LYS  24          1HB       LYS 294  -5.392   1.413   1.413
  150   2HB   LYS  24          2HB       LYS 294  -3.678   1.837   1.837
  151   1HG   LYS  24          1HG       LYS 294  -4.845   3.719   3.719
  152   2HG   LYS  24          2HG       LYS 294  -4.349   4.090   4.090
  153   1HD   LYS  24          1HD       LYS 294  -6.548   4.989   4.989
  154   2HD   LYS  24          2HD       LYS 294  -6.662   3.659   3.659
  155   1HE   LYS  24          1HE       LYS 294  -7.408   2.152   2.152
  156   2HE   LYS  24          2HE       LYS 294  -7.363   3.527   3.527
  157   1HZ   LYS  24          1HZ       LYS 294  -9.079   3.393   3.393
  158   2HZ   LYS  24          2HZ       LYS 294  -9.569   3.234   3.234
  159   3HZ   LYS  24          3HZ       LYS 294  -9.041   4.551   4.551
  160    H    ARG  25           H        ARG 295  -4.723  -0.288  -0.288
  161    HA   ARG  25           HA       ARG 295  -2.514  -1.879  -1.879
  162   1HB   ARG  25          1HB       ARG 295  -5.162  -2.992  -2.992
  163   2HB   ARG  25          2HB       ARG 295  -3.732  -3.954  -3.954
  164   1HG   ARG  25          1HG       ARG 295  -5.271  -2.180  -2.180
  165   2HG   ARG  25          2HG       ARG 295  -5.388  -3.946  -3.946
  166   1HD   ARG  25          1HD       ARG 295  -3.007  -4.123  -4.123
  167   2HD   ARG  25          2HD       ARG 295  -2.918  -2.358  -2.358
  168    HE   ARG  25           HE       ARG 295  -3.858  -4.153  -4.153
  169   1HH1  ARG  25          1HH1      ARG 295  -4.611  -0.919  -0.919
  170   2HH1  ARG  25          2HH1      ARG 295  -5.124  -0.460  -0.460
  171   1HH2  ARG  25          1HH2      ARG 295  -4.323  -3.311  -3.311
  172   2HH2  ARG  25          2HH2      ARG 295  -4.959  -1.799  -1.799
  173    H    CYS  26           H        CYS 296  -1.183  -2.808  -2.808
  174    HA   CYS  26           HA       CYS 296  -0.722  -1.908  -1.908
  175   1HB   CYS  26          1HB       CYS 296   0.401  -4.290  -4.290
  176   2HB   CYS  26          2HB       CYS 296   1.045  -3.634  -3.634
  177    H    TYR  27           H        TYR 297  -1.167  -2.708  -2.708
  178    HA   TYR  27           HA       TYR 297  -3.129  -4.726  -4.726
  179   1HB   TYR  27          1HB       TYR 297  -1.318  -3.354  -3.354
  180   2HB   TYR  27          2HB       TYR 297  -2.665  -4.431  -4.431
  181    HD1  TYR  27           HD2      TYR 297  -5.061  -3.663  -3.663
  182    HD2  TYR  27           HD1      TYR 297  -1.608  -1.117  -1.117
  183    HE1  TYR  27           HE2      TYR 297  -6.579  -1.705  -1.705
  184    HE2  TYR  27           HE1      TYR 297  -3.125   0.836   0.836
  185    HH   TYR  27           HH       TYR 297  -6.767   0.468   0.468
  186   1H    NH2  28          1H1       TYR 297  -2.829  -6.735  -6.735
  187   2H    NH2  28          2H1       TYR 297  -1.399  -7.549  -7.549

  Start of MODEL   12
    1   1H    CYS   1          1H        CYS 298  10.682  -1.096  -1.096
    2   2H    CYS   1          2H        CYS 298  10.585  -1.468  -1.468
    3   3H    CYS   1          3H        CYS 298  10.722  -2.531  -2.531
    4    HA   CYS   1           HA       CYS 298   8.359  -0.825  -0.825
    5   1HB   CYS   1          1HB       CYS 298   7.378  -2.073  -2.073
    6   2HB   CYS   1          2HB       CYS 298   8.980  -1.541  -1.541
    7    H    LYS   2           H        LYS 299   6.780  -1.282  -1.282
    8    HA   LYS   2           HA       LYS 299   6.663  -3.375  -3.375
    9   1HB   LYS   2          1HB       LYS 299   4.687  -1.320  -1.320
   10   2HB   LYS   2          2HB       LYS 299   4.239  -2.606  -2.606
   11   1HG   LYS   2          1HG       LYS 299   6.044  -1.911  -1.911
   12   2HG   LYS   2          2HG       LYS 299   6.524  -0.642  -0.642
   13   1HD   LYS   2          1HD       LYS 299   4.331   0.427   0.427
   14   2HD   LYS   2          2HD       LYS 299   3.808  -0.862  -0.862
   15   1HE   LYS   2          1HE       LYS 299   5.372  -0.193  -0.193
   16   2HE   LYS   2          2HE       LYS 299   6.243   0.862   0.862
   17   1HZ   LYS   2          1HZ       LYS 299   3.488   1.311   1.311
   18   2HZ   LYS   2          2HZ       LYS 299   4.649   2.116   2.116
   19   3HZ   LYS   2          3HZ       LYS 299   4.220   2.198   2.198
   20    H    SER   3           H        SER 300   6.400  -5.315  -5.315
   21    HA   SER   3           HA       SER 300   5.442  -6.881  -6.881
   22   1HB   SER   3          1HB       SER 300   4.679  -8.466  -8.466
   23   2HB   SER   3          2HB       SER 300   6.284  -7.789  -7.789
   24    HG   SER   3           HG       SER 300   4.929  -7.825  -7.825
   25    HA   HYP   4           HA       HYP 301   1.223  -5.831  -5.831
   26   1HB   HYP   4          1HB       HYP 301   1.343  -8.795  -8.795
   27   2HB   HYP   4          2HB       HYP 301   0.586  -7.490  -7.490
   28    HG   HYP   4           HG       HYP 301   2.917  -8.298  -8.298
   29    HD1  HYP   4           HD1      HYP 301   3.709  -6.110  -6.110
   30   1HD2  HYP   4          1HD2      HYP 301   4.572  -6.732  -6.732
   31   2HD2  HYP   4          2HD2      HYP 301   4.162  -8.380  -8.380
   32    H    GLY   5           H        GLY 302  -0.409  -5.678  -5.678
   33   1HA   GLY   5          1HA       GLY 302  -2.166  -6.534  -6.534
   34   2HA   GLY   5          2HA       GLY 302  -0.957  -7.627  -7.627
   35    H    SER   6           H        SER 303   1.090  -5.635  -5.635
   36    HA   SER   6           HA       SER 303   0.720  -4.780  -4.780
   37   1HB   SER   6          1HB       SER 303   2.718  -3.942  -3.942
   38   2HB   SER   6          2HB       SER 303   2.728  -3.304  -3.304
   39    HG   SER   6           HG       SER 303   4.117  -5.234  -5.234
   40    H    SER   7           H        SER 304   0.152  -3.070  -3.070
   41    HA   SER   7           HA       SER 304  -1.495  -1.043  -1.043
   42   1HB   SER   7          1HB       SER 304   0.229  -1.086  -1.086
   43   2HB   SER   7          2HB       SER 304  -1.085   0.058   0.058
   44    HG   SER   7           HG       SER 304  -1.820  -1.776  -1.776
   45    H    CYS   8           H        CYS 305  -1.157   0.478   0.478
   46    HA   CYS   8           HA       CYS 305   1.232   2.164   2.164
   47   1HB   CYS   8          1HB       CYS 305   0.830   2.352   2.352
   48   2HB   CYS   8          2HB       CYS 305   1.145   0.677   0.677
   49    H    SER   9           H        SER 306   0.494   4.174   4.174
   50    HA   SER   9           HA       SER 306  -2.041   5.239   5.239
   51   1HB   SER   9          1HB       SER 306  -0.214   6.225   6.225
   52   2HB   SER   9          2HB       SER 306   0.690   6.549   6.549
   53    HG   SER   9           HG       SER 306  -0.412   8.502   8.502
   54    HA   HYP  10           HA       HYP 307  -2.858   6.750   6.750
   55   1HB   HYP  10          1HB       HYP 307  -4.288   9.048   9.048
   56   2HB   HYP  10          2HB       HYP 307  -5.002   7.487   7.487
   57    HG   HYP  10           HG       HYP 307  -4.406   8.604   8.604
   58    HD1  HYP  10           HD1      HYP 307  -6.329   7.274   7.274
   59   1HD2  HYP  10          1HD2      HYP 307  -4.368   5.584   5.584
   60   2HD2  HYP  10          2HD2      HYP 307  -3.580   6.531   6.531
   61    H    THR  11           H        THR 308  -1.073   8.389   8.389
   62    HA   THR  11           HA       THR 308  -0.066  10.359  10.359
   63    HB   THR  11           HB       THR 308   1.359  11.111  11.111
   64    HG1  THR  11           HG1      THR 308   0.880  10.279  10.279
   65   1HG2  THR  11          1HG2      THR 308  -1.605  10.946  10.946
   66   2HG2  THR  11          2HG2      THR 308  -0.444  12.078  12.078
   67   3HG2  THR  11          3HG2      THR 308  -0.839  12.184  12.184
   68    H    SER  12           H        SER 309   0.753   7.213   7.213
   69    HA   SER  12           HA       SER 309   3.460   7.395   7.395
   70   1HB   SER  12          1HB       SER 309   4.440   6.133   6.133
   71   2HB   SER  12          2HB       SER 309   3.712   7.621   7.621
   72    HG   SER  12           HG       SER 309   3.284   5.758   5.758
   73    H    TYR  13           H        TYR 310   2.913   6.328   6.328
   74    HA   TYR  13           HA       TYR 310   1.697   3.693   3.693
   75   1HB   TYR  13          1HB       TYR 310   2.980   5.456   5.456
   76   2HB   TYR  13          2HB       TYR 310   2.186   3.907   3.907
   77    HD1  TYR  13           HD1      TYR 310   1.663   7.471   7.471
   78    HD2  TYR  13           HD2      TYR 310  -0.229   3.652   3.652
   79    HE1  TYR  13           HE1      TYR 310  -0.591   8.505   8.505
   80    HE2  TYR  13           HE2      TYR 310  -2.480   4.701   4.701
   81    HH   TYR  13           HH       TYR 310  -3.626   6.376   6.376
   82    H    ASN  14           H        ASN 311   3.550   3.425   3.425
   83    HA   ASN  14           HA       ASN 311   6.183   2.823   2.823
   84   1HB   ASN  14          1HB       ASN 311   6.871   2.839   2.839
   85   2HB   ASN  14          2HB       ASN 311   5.945   4.295   4.295
   86   1HD2  ASN  14          1HD2      ASN 311   6.534   2.993   2.993
   87   2HD2  ASN  14          2HD2      ASN 311   5.093   2.741   2.741
   88    H    CYS  15           H        CYS 312   4.512   1.055   1.055
   89    HA   CYS  15           HA       CYS 312   4.651  -1.453  -1.453
   90   1HB   CYS  15          1HB       CYS 312   2.561  -0.444  -0.444
   91   2HB   CYS  15          2HB       CYS 312   2.570  -2.048  -2.048
   92    H    CYS  16           H        CYS 313   5.052  -3.274  -3.274
   93    HA   CYS  16           HA       CYS 313   6.638  -3.273  -3.273
   94   1HB   CYS  16          1HB       CYS 313   5.160  -5.572  -5.572
   95   2HB   CYS  16          2HB       CYS 313   6.491  -5.638  -5.638
   96    H    ARG  17           H        ARG 314   3.208  -4.245  -4.245
   97    HA   ARG  17           HA       ARG 314   2.721  -2.968  -2.968
   98   1HB   ARG  17          1HB       ARG 314   1.047  -5.041  -5.041
   99   2HB   ARG  17          2HB       ARG 314   0.546  -4.156  -4.156
  100   1HG   ARG  17          1HG       ARG 314   1.831  -5.411  -5.411
  101   2HG   ARG  17          2HG       ARG 314   3.142  -5.559  -5.559
  102   1HD   ARG  17          1HD       ARG 314   2.158  -7.745  -7.745
  103   2HD   ARG  17          2HD       ARG 314   1.795  -7.221  -7.221
  104    HE   ARG  17           HE       ARG 314  -0.317  -6.608  -6.608
  105   1HH1  ARG  17          1HH2      ARG 314   0.784  -8.955  -8.955
  106   2HH1  ARG  17          2HH2      ARG 314  -0.561  -9.895  -9.895
  107   1HH2  ARG  17          1HH1      ARG 314  -2.198  -7.862  -7.862
  108   2HH2  ARG  17          2HH1      ARG 314  -2.279  -9.263  -9.263
  109    H    SER  18           H        SER 315   1.843  -1.160  -1.160
  110    HA   SER  18           HA       SER 315   1.569   0.773   0.773
  111   1HB   SER  18          1HB       SER 315  -0.441   1.624   1.624
  112   2HB   SER  18          2HB       SER 315   0.845   1.034   1.034
  113    HG   SER  18           HG       SER 315  -1.305   0.230   0.230
  114    H    CYS  19           H        CYS 316   0.298   1.813   1.813
  115    HA   CYS  19           HA       CYS 316  -1.127   0.268   0.268
  116   1HB   CYS  19          1HB       CYS 316   0.171   2.407   2.407
  117   2HB   CYS  19          2HB       CYS 316  -1.134   3.289   3.289
  118    H    ASN  20           H        ASN 317  -3.255  -0.133  -0.133
  119    HA   ASN  20           HA       ASN 317  -5.258   1.241   1.241
  120   1HB   ASN  20          1HB       ASN 317  -5.583  -1.182  -1.182
  121   2HB   ASN  20          2HB       ASN 317  -5.680  -0.828  -0.828
  122   1HD2  ASN  20          1HD2      ASN 317  -7.875  -1.513  -1.513
  123   2HD2  ASN  20          2HD2      ASN 317  -9.139  -0.683  -0.683
  124    HA   HYP  21           HA       HYP 318  -5.361   4.235   4.235
  125   1HB   HYP  21          1HB       HYP 318  -7.424   5.369   5.369
  126   2HB   HYP  21          2HB       HYP 318  -6.155   6.220   6.220
  127    HG   HYP  21           HG       HYP 318  -5.674   5.723   5.723
  128    HD1  HYP  21           HD1      HYP 318  -3.413   5.031   5.031
  129   1HD2  HYP  21          1HD2      HYP 318  -4.798   3.207   3.207
  130   2HD2  HYP  21          2HD2      HYP 318  -6.552   3.461   3.461
  131    H    TYR  22           H        TYR 319  -8.171   2.853   2.853
  132    HA   TYR  22           HA       TYR 319 -10.153   3.528   3.528
  133   1HB   TYR  22          1HB       TYR 319 -10.057   1.152   1.152
  134   2HB   TYR  22          2HB       TYR 319 -11.497   1.740   1.740
  135    HD1  TYR  22           HD1      TYR 319 -12.086   4.304   4.304
  136    HD2  TYR  22           HD2      TYR 319  -9.601   1.899   1.899
  137    HE1  TYR  22           HE1      TYR 319 -12.387   5.994   5.994
  138    HE2  TYR  22           HE2      TYR 319  -9.903   3.591   3.591
  139    HH   TYR  22           HH       TYR 319 -10.748   5.477   5.477
  140    H    THR  23           H        THR 320  -8.234   0.558   0.558
  141    HA   THR  23           HA       THR 320  -9.260  -0.076  -0.076
  142    HB   THR  23           HB       THR 320  -8.740  -2.400  -2.400
  143    HG1  THR  23           HG1      THR 320  -7.824  -3.168  -3.168
  144   1HG2  THR  23          1HG2      THR 320 -10.205  -1.389  -1.389
  145   2HG2  THR  23          2HG2      THR 320 -10.174  -3.058  -3.058
  146   3HG2  THR  23          3HG2      THR 320 -10.897  -1.777  -1.777
  147    H    LYS  24           H        LYS 321  -6.736   1.413   1.413
  148    HA   LYS  24           HA       LYS 321  -4.780   2.149   2.149
  149   1HB   LYS  24          1HB       LYS 321  -5.839   0.935   0.935
  150   2HB   LYS  24          2HB       LYS 321  -4.476   2.059   2.059
  151   1HG   LYS  24          1HG       LYS 321  -7.127   2.846   2.846
  152   2HG   LYS  24          2HG       LYS 321  -6.884   2.911   2.911
  153   1HD   LYS  24          1HD       LYS 321  -4.827   4.324   4.324
  154   2HD   LYS  24          2HD       LYS 321  -5.348   4.409   4.409
  155   1HE   LYS  24          1HE       LYS 321  -7.238   5.176   5.176
  156   2HE   LYS  24          2HE       LYS 321  -6.032   6.331   6.331
  157   1HZ   LYS  24          1HZ       LYS 321  -8.062   5.088   5.088
  158   2HZ   LYS  24          2HZ       LYS 321  -8.104   6.508   6.508
  159   3HZ   LYS  24          3HZ       LYS 321  -7.047   6.059   6.059
  160    H    ARG  25           H        ARG 322  -4.755  -0.386  -0.386
  161    HA   ARG  25           HA       ARG 322  -2.499  -1.831  -1.831
  162   1HB   ARG  25          1HB       ARG 322  -4.868  -3.021  -3.021
  163   2HB   ARG  25          2HB       ARG 322  -3.409  -3.912  -3.912
  164   1HG   ARG  25          1HG       ARG 322  -3.951  -3.249  -3.249
  165   2HG   ARG  25          2HG       ARG 322  -5.533  -2.731  -2.731
  166   1HD   ARG  25          1HD       ARG 322  -4.329  -5.517  -5.517
  167   2HD   ARG  25          2HD       ARG 322  -5.766  -4.999  -4.999
  168    HE   ARG  25           HE       ARG 322  -5.584  -5.413  -5.413
  169   1HH1  ARG  25          1HH2      ARG 322  -7.703  -4.696  -4.696
  170   2HH1  ARG  25          2HH2      ARG 322  -9.064  -4.948  -4.948
  171   1HH2  ARG  25          1HH1      ARG 322  -7.481  -5.811  -5.811
  172   2HH2  ARG  25          2HH1      ARG 322  -8.936  -5.584  -5.584
  173    H    CYS  26           H        CYS 323  -1.004  -2.644  -2.644
  174    HA   CYS  26           HA       CYS 323  -0.629  -1.700  -1.700
  175   1HB   CYS  26          1HB       CYS 323   0.650  -4.040  -4.040
  176   2HB   CYS  26          2HB       CYS 323   1.207  -3.352  -3.352
  177    H    TYR  27           H        TYR 324  -1.227  -2.615  -2.615
  178    HA   TYR  27           HA       TYR 324  -3.033  -4.808  -4.808
  179   1HB   TYR  27          1HB       TYR 324  -1.664  -3.056  -3.056
  180   2HB   TYR  27          2HB       TYR 324  -2.571  -4.495  -4.495
  181    HD1  TYR  27           HD2      TYR 324  -4.924  -4.564  -4.564
  182    HD2  TYR  27           HD1      TYR 324  -2.887  -1.154  -1.154
  183    HE1  TYR  27           HE2      TYR 324  -7.104  -3.359  -3.359
  184    HE2  TYR  27           HE1      TYR 324  -5.069   0.050   0.050
  185    HH   TYR  27           HH       TYR 324  -8.167  -1.533  -1.533
  186   1H    NH2  28          1H1       TYR 324  -2.659  -6.822  -6.822
  187   2H    NH2  28          2H1       TYR 324  -1.171  -7.519  -7.519

  Start of MODEL   13
    1   1H    CYS   1          1H        CYS 325  10.783  -2.635  -2.635
    2   2H    CYS   1          2H        CYS 325  10.807  -1.228  -1.228
    3   3H    CYS   1          3H        CYS 325  10.763  -1.503  -1.503
    4    HA   CYS   1           HA       CYS 325   8.570  -0.758  -0.758
    5   1HB   CYS   1          1HB       CYS 325   7.317  -1.906  -1.906
    6   2HB   CYS   1          2HB       CYS 325   8.874  -1.409  -1.409
    7    H    LYS   2           H        LYS 326   6.791  -1.349  -1.349
    8    HA   LYS   2           HA       LYS 326   6.866  -3.327  -3.327
    9   1HB   LYS   2          1HB       LYS 326   4.544  -1.656  -1.656
   10   2HB   LYS   2          2HB       LYS 326   4.556  -2.635  -2.635
   11   1HG   LYS   2          1HG       LYS 326   6.271  -1.199  -1.199
   12   2HG   LYS   2          2HG       LYS 326   6.325  -0.242  -0.242
   13   1HD   LYS   2          1HD       LYS 326   3.945   0.366   0.366
   14   2HD   LYS   2          2HD       LYS 326   3.908  -0.575  -0.575
   15   1HE   LYS   2          1HE       LYS 326   5.540   0.888   0.888
   16   2HE   LYS   2          2HE       LYS 326   5.810   1.743   1.743
   17   1HZ   LYS   2          1HZ       LYS 326   3.297   1.788   1.788
   18   2HZ   LYS   2          2HZ       LYS 326   4.254   2.930   2.930
   19   3HZ   LYS   2          3HZ       LYS 326   3.524   2.508   2.508
   20    H    SER   3           H        SER 327   6.091  -5.271  -5.271
   21    HA   SER   3           HA       SER 327   5.331  -6.803  -6.803
   22   1HB   SER   3          1HB       SER 327   4.636  -8.461  -8.461
   23   2HB   SER   3          2HB       SER 327   6.341  -7.990  -7.990
   24    HG   SER   3           HG       SER 327   5.541  -7.936  -7.936
   25    HA   HYP   4           HA       HYP 328   1.136  -5.721  -5.721
   26   1HB   HYP   4          1HB       HYP 328   1.137  -8.649  -8.649
   27   2HB   HYP   4          2HB       HYP 328   0.334  -7.278  -7.278
   28    HG   HYP   4           HG       HYP 328   2.688  -8.014  -8.014
   29    HD1  HYP   4           HD1      HYP 328   3.402  -5.755  -5.755
   30   1HD2  HYP   4          1HD2      HYP 328   4.408  -6.689  -6.689
   31   2HD2  HYP   4          2HD2      HYP 328   3.919  -8.344  -8.344
   32    H    GLY   5           H        GLY 329  -0.650  -5.723  -5.723
   33   1HA   GLY   5          1HA       GLY 329  -2.229  -6.516  -6.516
   34   2HA   GLY   5          2HA       GLY 329  -0.983  -7.632  -7.632
   35    H    SER   6           H        SER 330   1.143  -5.749  -5.749
   36    HA   SER   6           HA       SER 330   0.888  -4.826  -4.826
   37   1HB   SER   6          1HB       SER 330   2.787  -3.879  -3.879
   38   2HB   SER   6          2HB       SER 330   2.880  -3.386  -3.386
   39    HG   SER   6           HG       SER 330   4.360  -5.184  -5.184
   40    H    SER   7           H        SER 331   0.729  -2.846  -2.846
   41    HA   SER   7           HA       SER 331  -1.361  -1.151  -1.151
   42   1HB   SER   7          1HB       SER 331  -1.145  -0.079  -0.079
   43   2HB   SER   7          2HB       SER 331  -1.338  -1.838  -1.838
   44    HG   SER   7           HG       SER 331   0.422  -1.056  -1.056
   45    H    CYS   8           H        CYS 332  -1.378   0.832   0.832
   46    HA   CYS   8           HA       CYS 332   0.916   2.553   2.553
   47   1HB   CYS   8          1HB       CYS 332   0.831   2.669   2.669
   48   2HB   CYS   8          2HB       CYS 332   1.275   1.056   1.056
   49    H    SER   9           H        SER 333   0.463   4.542   4.542
   50    HA   SER   9           HA       SER 333  -2.218   5.688   5.688
   51   1HB   SER   9          1HB       SER 333  -0.458   6.693   6.693
   52   2HB   SER   9          2HB       SER 333   0.639   6.743   6.743
   53    HG   SER   9           HG       SER 333  -0.284   8.871   8.871
   54    HA   HYP  10           HA       HYP 334  -2.481   6.359   6.359
   55   1HB   HYP  10          1HB       HYP 334  -3.237   9.187   9.187
   56   2HB   HYP  10          2HB       HYP 334  -3.989   8.118   8.118
   57    HG   HYP  10           HG       HYP 334  -5.136   8.383   8.383
   58    HD1  HYP  10           HD1      HYP 334  -5.767   6.050   6.050
   59   1HD2  HYP  10          1HD2      HYP 334  -3.943   6.333   6.333
   60   2HD2  HYP  10          2HD2      HYP 334  -3.338   7.992   7.992
   61    H    THR  11           H        THR 335  -1.090   9.035   9.035
   62    HA   THR  11           HA       THR 335   0.614  10.024  10.024
   63    HB   THR  11           HB       THR 335   1.731  11.233  11.233
   64    HG1  THR  11           HG1      THR 335   0.674  11.050  11.050
   65   1HG2  THR  11          1HG2      THR 335  -1.259  11.497  11.497
   66   2HG2  THR  11          2HG2      THR 335  -0.131  12.679  12.679
   67   3HG2  THR  11          3HG2      THR 335  -0.070  12.295  12.295
   68    H    SER  12           H        SER 336   0.915   7.280   7.280
   69    HA   SER  12           HA       SER 336   3.724   6.931   6.931
   70   1HB   SER  12          1HB       SER 336   4.079   5.559   5.559
   71   2HB   SER  12          2HB       SER 336   3.250   7.011   7.011
   72    HG   SER  12           HG       SER 336   2.395   5.040   5.040
   73    H    TYR  13           H        TYR 337   2.655   6.473   6.473
   74    HA   TYR  13           HA       TYR 337   1.583   3.905   3.905
   75   1HB   TYR  13          1HB       TYR 337   2.795   6.042   6.042
   76   2HB   TYR  13          2HB       TYR 337   2.312   4.469   4.469
   77    HD1  TYR  13           HD2      TYR 337  -0.179   3.730   3.730
   78    HD2  TYR  13           HD1      TYR 337   1.299   7.732   7.732
   79    HE1  TYR  13           HE2      TYR 337  -2.520   4.614   4.614
   80    HE2  TYR  13           HE1      TYR 337  -1.048   8.617   8.617
   81    HH   TYR  13           HH       TYR 337  -3.829   6.414   6.414
   82    H    ASN  14           H        ASN 338   3.780   3.564   3.564
   83    HA   ASN  14           HA       ASN 338   6.141   2.856   2.856
   84   1HB   ASN  14          1HB       ASN 338   7.324   3.012   3.012
   85   2HB   ASN  14          2HB       ASN 338   6.391   4.477   4.477
   86   1HD2  ASN  14          1HD2      ASN 338   7.436   3.851   3.851
   87   2HD2  ASN  14          2HD2      ASN 338   6.225   3.630   3.630
   88    H    CYS  15           H        CYS 339   3.979   1.126   1.126
   89    HA   CYS  15           HA       CYS 339   4.809  -1.348  -1.348
   90   1HB   CYS  15          1HB       CYS 339   2.314  -0.638  -0.638
   91   2HB   CYS  15          2HB       CYS 339   2.626  -2.186  -2.186
   92    H    CYS  16           H        CYS 340   4.814  -3.270  -3.270
   93    HA   CYS  16           HA       CYS 340   6.288  -3.026  -3.026
   94   1HB   CYS  16          1HB       CYS 340   4.927  -5.453  -5.453
   95   2HB   CYS  16          2HB       CYS 340   6.160  -5.483  -5.483
   96    H    ARG  17           H        ARG 341   2.923  -3.850  -3.850
   97    HA   ARG  17           HA       ARG 341   2.582  -3.284  -3.284
   98   1HB   ARG  17          1HB       ARG 341   0.723  -4.692  -4.692
   99   2HB   ARG  17          2HB       ARG 341   0.406  -4.378  -4.378
  100   1HG   ARG  17          1HG       ARG 341   2.237  -5.892  -5.892
  101   2HG   ARG  17          2HG       ARG 341   2.575  -6.197  -6.197
  102   1HD   ARG  17          1HD       ARG 341   0.295  -7.054  -7.054
  103   2HD   ARG  17          2HD       ARG 341  -0.085  -6.707  -6.707
  104    HE   ARG  17           HE       ARG 341   1.795  -8.350  -8.350
  105   1HH1  ARG  17          1HH2      ARG 341  -0.236  -8.879  -8.879
  106   2HH1  ARG  17          2HH2      ARG 341   0.019 -10.504 -10.504
  107   1HH2  ARG  17          1HH1      ARG 341   2.023 -10.525 -10.525
  108   2HH2  ARG  17          2HH1      ARG 341   1.296 -11.435 -11.435
  109    H    SER  18           H        SER 342   2.842  -1.298  -1.298
  110    HA   SER  18           HA       SER 342   2.172   0.732   0.732
  111   1HB   SER  18          1HB       SER 342   1.458   0.952   0.952
  112   2HB   SER  18          2HB       SER 342  -0.189   0.765   0.765
  113    HG   SER  18           HG       SER 342   0.499   3.056   3.056
  114    H    CYS  19           H        CYS 343   0.039   1.868   1.868
  115    HA   CYS  19           HA       CYS 343  -0.967   0.220   0.220
  116   1HB   CYS  19          1HB       CYS 343   0.443   2.196   2.196
  117   2HB   CYS  19          2HB       CYS 343  -0.700   3.223   3.223
  118    H    ASN  20           H        ASN 344  -3.206  -0.053  -0.053
  119    HA   ASN  20           HA       ASN 344  -4.981   1.257   1.257
  120   1HB   ASN  20          1HB       ASN 344  -5.046  -1.205  -1.205
  121   2HB   ASN  20          2HB       ASN 344  -5.741  -0.948  -0.948
  122   1HD2  ASN  20          1HD2      ASN 344  -7.578  -2.122  -2.122
  123   2HD2  ASN  20          2HD2      ASN 344  -8.739  -1.351  -1.351
  124    HA   HYP  21           HA       HYP 345  -5.956   4.237   4.237
  125   1HB   HYP  21          1HB       HYP 345  -7.879   4.991   4.991
  126   2HB   HYP  21          2HB       HYP 345  -6.897   6.047   6.047
  127    HG   HYP  21           HG       HYP 345  -6.007   5.610   5.610
  128    HD1  HYP  21           HD1      HYP 345  -3.742   5.375   5.375
  129   1HD2  HYP  21          1HD2      HYP 345  -4.649   3.233   3.233
  130   2HD2  HYP  21          2HD2      HYP 345  -6.372   3.169   3.169
  131    H    TYR  22           H        TYR 346  -8.351   2.417   2.417
  132    HA   TYR  22           HA       TYR 346 -10.607   2.697   2.697
  133   1HB   TYR  22          1HB       TYR 346  -9.768   0.538   0.538
  134   2HB   TYR  22          2HB       TYR 346 -11.323   0.531   0.531
  135    HD1  TYR  22           HD2      TYR 346 -13.008   2.266   2.266
  136    HD2  TYR  22           HD1      TYR 346  -9.299   2.167   2.167
  137    HE1  TYR  22           HE2      TYR 346 -13.918   3.990   3.990
  138    HE2  TYR  22           HE1      TYR 346 -10.204   3.902   3.902
  139    HH   TYR  22           HH       TYR 346 -13.604   5.272   5.272
  140    H    THR  23           H        THR 347  -7.897   0.492   0.492
  141    HA   THR  23           HA       THR 347  -9.216  -0.796  -0.796
  142    HB   THR  23           HB       THR 347  -7.608  -2.676  -2.676
  143    HG1  THR  23           HG1      THR 347  -6.453  -2.712  -2.712
  144   1HG2  THR  23          1HG2      THR 347  -9.356  -2.005  -2.005
  145   2HG2  THR  23          2HG2      THR 347  -8.691  -3.598  -3.598
  146   3HG2  THR  23          3HG2      THR 347  -9.856  -2.830  -2.830
  147    H    LYS  24           H        LYS 348  -6.917   1.510   1.510
  148    HA   LYS  24           HA       LYS 348  -4.836   2.162   2.162
  149   1HB   LYS  24          1HB       LYS 348  -6.173   1.233   1.233
  150   2HB   LYS  24          2HB       LYS 348  -4.616   2.080   2.080
  151   1HG   LYS  24          1HG       LYS 348  -7.157   3.209   3.209
  152   2HG   LYS  24          2HG       LYS 348  -6.638   3.537   3.537
  153   1HD   LYS  24          1HD       LYS 348  -4.591   4.572   4.572
  154   2HD   LYS  24          2HD       LYS 348  -5.008   4.159   4.159
  155   1HE   LYS  24          1HE       LYS 348  -6.875   5.828   5.828
  156   2HE   LYS  24          2HE       LYS 348  -5.494   6.571   6.571
  157   1HZ   LYS  24          1HZ       LYS 348  -7.592   5.069   5.069
  158   2HZ   LYS  24          2HZ       LYS 348  -7.462   6.554   6.554
  159   3HZ   LYS  24          3HZ       LYS 348  -6.430   5.695   5.695
  160    H    ARG  25           H        ARG 349  -4.900  -0.398  -0.398
  161    HA   ARG  25           HA       ARG 349  -2.491  -1.568  -1.568
  162   1HB   ARG  25          1HB       ARG 349  -5.080  -3.028  -3.028
  163   2HB   ARG  25          2HB       ARG 349  -3.520  -3.864  -3.864
  164   1HG   ARG  25          1HG       ARG 349  -3.182  -3.160  -3.160
  165   2HG   ARG  25          2HG       ARG 349  -4.571  -2.062  -2.062
  166   1HD   ARG  25          1HD       ARG 349  -6.062  -4.039  -4.039
  167   2HD   ARG  25          2HD       ARG 349  -4.652  -5.092  -5.092
  168    HE   ARG  25           HE       ARG 349  -4.560  -4.449  -4.449
  169   1HH1  ARG  25          1HH2      ARG 349  -7.234  -2.785  -2.785
  170   2HH1  ARG  25          2HH2      ARG 349  -7.948  -2.446  -2.446
  171   1HH2  ARG  25          1HH1      ARG 349  -5.672  -3.984  -3.984
  172   2HH2  ARG  25          2HH1      ARG 349  -7.071  -3.119  -3.119
  173    H    CYS  26           H        CYS 350  -1.143  -2.574  -2.574
  174    HA   CYS  26           HA       CYS 350  -0.729  -1.670  -1.670
  175   1HB   CYS  26          1HB       CYS 350   0.413  -4.148  -4.148
  176   2HB   CYS  26          2HB       CYS 350   1.002  -3.381  -3.381
  177    H    TYR  27           H        TYR 351  -1.263  -2.424  -2.424
  178    HA   TYR  27           HA       TYR 351  -3.337  -4.211  -4.211
  179   1HB   TYR  27          1HB       TYR 351  -1.250  -2.947  -2.947
  180   2HB   TYR  27          2HB       TYR 351  -2.427  -4.106  -4.106
  181    HD1  TYR  27           HD1      TYR 351  -4.947  -3.591  -3.591
  182    HD2  TYR  27           HD2      TYR 351  -1.747  -0.680  -0.680
  183    HE1  TYR  27           HE1      TYR 351  -6.560  -1.773  -1.773
  184    HE2  TYR  27           HE2      TYR 351  -3.350   1.130   1.130
  185    HH   TYR  27           HH       TYR 351  -5.415   1.742   1.742
  186   1H    NH2  28          1H1       TYR 351  -3.336  -6.344  -6.344
  187   2H    NH2  28          2H1       TYR 351  -2.023  -7.337  -7.337

  Start of MODEL   14
    1   1H    CYS   1          1H        CYS 352  10.988  -2.903  -2.903
    2   2H    CYS   1          2H        CYS 352  11.066  -1.577  -1.577
    3   3H    CYS   1          3H        CYS 352  11.145  -1.660  -1.660
    4    HA   CYS   1           HA       CYS 352   8.949  -0.827  -0.827
    5   1HB   CYS   1          1HB       CYS 352   7.600  -1.945  -1.945
    6   2HB   CYS   1          2HB       CYS 352   9.217  -2.181  -2.181
    7    H    LYS   2           H        LYS 353   6.974  -1.439  -1.439
    8    HA   LYS   2           HA       LYS 353   6.943  -3.631  -3.631
    9   1HB   LYS   2          1HB       LYS 353   4.862  -1.566  -1.566
   10   2HB   LYS   2          2HB       LYS 353   4.592  -2.893  -2.893
   11   1HG   LYS   2          1HG       LYS 353   6.634  -1.940  -1.940
   12   2HG   LYS   2          2HG       LYS 353   6.387  -0.484  -0.484
   13   1HD   LYS   2          1HD       LYS 353   3.943  -0.591  -0.591
   14   2HD   LYS   2          2HD       LYS 353   4.395  -1.851  -1.851
   15   1HE   LYS   2          1HE       LYS 353   4.901  -0.259  -0.259
   16   2HE   LYS   2          2HE       LYS 353   6.157   0.354   0.354
   17   1HZ   LYS   2          1HZ       LYS 353   3.335   1.121   1.121
   18   2HZ   LYS   2          2HZ       LYS 353   4.406   2.017   2.017
   19   3HZ   LYS   2          3HZ       LYS 353   4.392   1.636   1.636
   20    H    SER   3           H        SER 354   6.578  -5.476  -5.476
   21    HA   SER   3           HA       SER 354   5.592  -6.602  -6.602
   22   1HB   SER   3          1HB       SER 354   5.222  -7.579  -7.579
   23   2HB   SER   3          2HB       SER 354   5.122  -8.583  -8.583
   24    HG   SER   3           HG       SER 354   7.274  -8.736  -8.736
   25    HA   HYP   4           HA       HYP 355   1.326  -5.802  -5.802
   26   1HB   HYP   4          1HB       HYP 355   1.198  -8.830  -8.830
   27   2HB   HYP   4          2HB       HYP 355   0.418  -7.571  -7.571
   28    HG   HYP   4           HG       HYP 355   2.684  -8.601  -8.601
   29    HD1  HYP   4           HD1      HYP 355   3.501  -6.467  -6.467
   30   1HD2  HYP   4          1HD2      HYP 355   4.525  -7.094  -7.094
   31   2HD2  HYP   4          2HD2      HYP 355   3.976  -8.613  -8.613
   32    H    GLY   5           H        GLY 356  -0.486  -5.734  -5.734
   33   1HA   GLY   5          1HA       GLY 356  -2.186  -6.310  -6.310
   34   2HA   GLY   5          2HA       GLY 356  -1.179  -7.647  -7.647
   35    H    SER   6           H        SER 357   0.979  -5.408  -5.408
   36    HA   SER   6           HA       SER 357   0.539  -4.899  -4.899
   37   1HB   SER   6          1HB       SER 357   2.713  -3.865  -3.865
   38   2HB   SER   6          2HB       SER 357   2.777  -5.407  -5.407
   39    HG   SER   6           HG       SER 357   3.946  -3.693  -3.693
   40    H    SER   7           H        SER 358   0.549  -2.831  -2.831
   41    HA   SER   7           HA       SER 358  -1.405  -1.120  -1.120
   42   1HB   SER   7          1HB       SER 358  -1.400  -1.862  -1.862
   43   2HB   SER   7          2HB       SER 358  -0.111  -0.667  -0.667
   44    HG   SER   7           HG       SER 358  -2.261   0.240   0.240
   45    H    CYS   8           H        CYS 359  -1.372   0.520   0.520
   46    HA   CYS   8           HA       CYS 359   0.937   2.328   2.328
   47   1HB   CYS   8          1HB       CYS 359   0.833   2.442   2.442
   48   2HB   CYS   8          2HB       CYS 359   1.224   0.814   0.814
   49    H    SER   9           H        SER 360   0.515   4.334   4.334
   50    HA   SER   9           HA       SER 360  -2.073   5.495   5.495
   51   1HB   SER   9          1HB       SER 360  -0.110   6.539   6.539
   52   2HB   SER   9          2HB       SER 360   0.682   6.637   6.637
   53    HG   SER   9           HG       SER 360  -0.257   8.728   8.728
   54    HA   HYP  10           HA       HYP 361  -3.177   6.510   6.510
   55   1HB   HYP  10          1HB       HYP 361  -4.469   8.897   8.897
   56   2HB   HYP  10          2HB       HYP 361  -5.224   7.457   7.457
   57    HG   HYP  10           HG       HYP 361  -4.978   8.209   8.209
   58    HD1  HYP  10           HD1      HYP 361  -6.578   6.419   6.419
   59   1HD2  HYP  10          1HD2      HYP 361  -4.344   5.328   5.328
   60   2HD2  HYP  10          2HD2      HYP 361  -3.676   6.513   6.513
   61    H    THR  11           H        THR 362  -1.113   8.216   8.216
   62    HA   THR  11           HA       THR 362  -0.191   9.682   9.682
   63    HB   THR  11           HB       THR 362  -0.863  11.339  11.339
   64    HG1  THR  11           HG1      THR 362   1.165  12.515  12.515
   65   1HG2  THR  11          1HG2      THR 362   1.150  10.087  10.087
   66   2HG2  THR  11          2HG2      THR 362   0.287  11.613  11.613
   67   3HG2  THR  11          3HG2      THR 362  -0.608  10.084  10.084
   68    H    SER  12           H        SER 363   0.763   7.106   7.106
   69    HA   SER  12           HA       SER 363   3.596   7.715   7.715
   70   1HB   SER  12          1HB       SER 363   4.044   5.749   5.749
   71   2HB   SER  12          2HB       SER 363   2.906   6.829   6.829
   72    HG   SER  12           HG       SER 363   2.248   4.549   4.549
   73    H    TYR  13           H        TYR 364   1.558   5.013   5.013
   74    HA   TYR  13           HA       TYR 364   1.581   3.517   3.517
   75   1HB   TYR  13          1HB       TYR 364   3.056   5.760   5.760
   76   2HB   TYR  13          2HB       TYR 364   2.379   4.335   4.335
   77    HD1  TYR  13           HD1      TYR 364  -0.041   3.957   3.957
   78    HD2  TYR  13           HD2      TYR 364   1.660   7.625   7.625
   79    HE1  TYR  13           HE1      TYR 364  -2.294   5.052   5.052
   80    HE2  TYR  13           HE2      TYR 364  -0.594   8.725   8.725
   81    HH   TYR  13           HH       TYR 364  -2.811   8.398   8.398
   82    H    ASN  14           H        ASN 365   3.701   3.350   3.350
   83    HA   ASN  14           HA       ASN 365   6.224   2.655   2.655
   84   1HB   ASN  14          1HB       ASN 365   6.947   2.495   2.495
   85   2HB   ASN  14          2HB       ASN 365   6.086   4.018   4.018
   86   1HD2  ASN  14          1HD2      ASN 365   6.528   1.865   1.865
   87   2HD2  ASN  14          2HD2      ASN 365   5.080   1.803   1.803
   88    H    CYS  15           H        CYS 366   4.378   0.994   0.994
   89    HA   CYS  15           HA       CYS 366   4.853  -1.620  -1.620
   90   1HB   CYS  15          1HB       CYS 366   2.517  -0.708  -0.708
   91   2HB   CYS  15          2HB       CYS 366   2.703  -2.293  -2.293
   92    H    CYS  16           H        CYS 367   5.347  -3.307  -3.307
   93    HA   CYS  16           HA       CYS 367   6.509  -2.891  -2.891
   94   1HB   CYS  16          1HB       CYS 367   5.803  -5.311  -5.311
   95   2HB   CYS  16          2HB       CYS 367   6.201  -5.500  -5.500
   96    H    ARG  17           H        ARG 368   3.297  -4.250  -4.250
   97    HA   ARG  17           HA       ARG 368   2.537  -3.082  -3.082
   98   1HB   ARG  17          1HB       ARG 368   0.873  -5.016  -5.016
   99   2HB   ARG  17          2HB       ARG 368   0.544  -4.353  -4.353
  100   1HG   ARG  17          1HG       ARG 368   2.598  -5.540  -5.540
  101   2HG   ARG  17          2HG       ARG 368   2.700  -6.326  -6.326
  102   1HD   ARG  17          1HD       ARG 368   0.394  -6.540  -6.540
  103   2HD   ARG  17          2HD       ARG 368   1.629  -7.776  -7.776
  104    HE   ARG  17           HE       ARG 368  -0.538  -7.060  -7.060
  105   1HH1  ARG  17          1HH2      ARG 368   2.149  -9.215  -9.215
  106   2HH1  ARG  17          2HH2      ARG 368   1.542 -10.358 -10.358
  107   1HH2  ARG  17          1HH1      ARG 368  -1.411  -8.856  -8.856
  108   2HH2  ARG  17          2HH1      ARG 368  -0.446 -10.156 -10.156
  109    H    SER  18           H        SER 369   1.552  -1.297  -1.297
  110    HA   SER  18           HA       SER 369   1.291   0.720   0.720
  111   1HB   SER  18          1HB       SER 369   0.175   0.479   0.479
  112   2HB   SER  18          2HB       SER 369  -1.133  -0.447  -0.447
  113    HG   SER  18           HG       SER 369  -1.758   1.802   1.802
  114    H    CYS  19           H        CYS 370   0.091   1.871   1.871
  115    HA   CYS  19           HA       CYS 370  -1.172   0.359   0.359
  116   1HB   CYS  19          1HB       CYS 370   0.019   2.607   2.607
  117   2HB   CYS  19          2HB       CYS 370  -1.441   3.344   3.344
  118    H    ASN  20           H        ASN 371  -3.325   0.098   0.098
  119    HA   ASN  20           HA       ASN 371  -5.310   1.365   1.365
  120   1HB   ASN  20          1HB       ASN 371  -5.600  -1.019  -1.019
  121   2HB   ASN  20          2HB       ASN 371  -5.808  -0.841  -0.841
  122   1HD2  ASN  20          1HD2      ASN 371  -7.612  -1.248  -1.248
  123   2HD2  ASN  20          2HD2      ASN 371  -8.977  -0.417  -0.417
  124    HA   HYP  21           HA       HYP 372  -5.295   4.451   4.451
  125   1HB   HYP  21          1HB       HYP 372  -7.536   5.295   5.295
  126   2HB   HYP  21          2HB       HYP 372  -6.366   6.319   6.319
  127    HG   HYP  21           HG       HYP 372  -5.722   5.876   5.876
  128    HD1  HYP  21           HD1      HYP 372  -3.488   5.203   5.203
  129   1HD2  HYP  21          1HD2      HYP 372  -4.762   3.276   3.276
  130   2HD2  HYP  21          2HD2      HYP 372  -6.523   3.448   3.448
  131    H    TYR  22           H        TYR 373  -8.270   2.995   2.995
  132    HA   TYR  22           HA       TYR 373 -10.029   3.815   3.815
  133   1HB   TYR  22          1HB       TYR 373 -10.615   2.935   2.935
  134   2HB   TYR  22          2HB       TYR 373 -10.326   1.308   1.308
  135    HD1  TYR  22           HD1      TYR 373 -12.119   4.485   4.485
  136    HD2  TYR  22           HD2      TYR 373 -12.192   0.145   0.145
  137    HE1  TYR  22           HE1      TYR 373 -14.195   4.491   4.491
  138    HE2  TYR  22           HE2      TYR 373 -14.296   0.153   0.153
  139    HH   TYR  22           HH       TYR 373 -15.812   1.331   1.331
  140    H    THR  23           H        THR 374  -8.322   0.767   0.767
  141    HA   THR  23           HA       THR 374  -9.296  -0.279  -0.279
  142    HB   THR  23           HB       THR 374  -9.540  -1.606  -1.606
  143    HG1  THR  23           HG1      THR 374  -8.791  -3.612  -3.612
  144   1HG2  THR  23          1HG2      THR 374  -6.567  -1.909  -1.909
  145   2HG2  THR  23          2HG2      THR 374  -7.728  -2.866  -2.866
  146   3HG2  THR  23          3HG2      THR 374  -7.562  -1.129  -1.129
  147    H    LYS  24           H        LYS 375  -6.712   1.561   1.561
  148    HA   LYS  24           HA       LYS 375  -4.680   2.137   2.137
  149   1HB   LYS  24          1HB       LYS 375  -5.866   0.787   0.787
  150   2HB   LYS  24          2HB       LYS 375  -4.503   1.919   1.919
  151   1HG   LYS  24          1HG       LYS 375  -7.181   2.773   2.773
  152   2HG   LYS  24          2HG       LYS 375  -6.875   2.741   2.741
  153   1HD   LYS  24          1HD       LYS 375  -5.005   4.301   4.301
  154   2HD   LYS  24          2HD       LYS 375  -5.243   4.298   4.298
  155   1HE   LYS  24          1HE       LYS 375  -7.485   5.073   5.073
  156   2HE   LYS  24          2HE       LYS 375  -6.264   6.255   6.255
  157   1HZ   LYS  24          1HZ       LYS 375  -7.965   4.785   4.785
  158   2HZ   LYS  24          2HZ       LYS 375  -8.143   6.227   6.227
  159   3HZ   LYS  24          3HZ       LYS 375  -6.937   5.781   5.781
  160    H    ARG  25           H        ARG 376  -4.471  -0.083  -0.083
  161    HA   ARG  25           HA       ARG 376  -2.422  -1.751  -1.751
  162   1HB   ARG  25          1HB       ARG 376  -5.004  -2.880  -2.880
  163   2HB   ARG  25          2HB       ARG 376  -3.552  -3.839  -3.839
  164   1HG   ARG  25          1HG       ARG 376  -5.149  -2.286  -2.286
  165   2HG   ARG  25          2HG       ARG 376  -5.240  -4.035  -4.035
  166   1HD   ARG  25          1HD       ARG 376  -2.998  -4.354  -4.354
  167   2HD   ARG  25          2HD       ARG 376  -2.685  -2.609  -2.609
  168    HE   ARG  25           HE       ARG 376  -4.625  -2.718  -2.718
  169   1HH1  ARG  25          1HH2      ARG 376  -2.453  -5.382  -5.382
  170   2HH1  ARG  25          2HH2      ARG 376  -2.260  -5.518  -5.518
  171   1HH2  ARG  25          1HH1      ARG 376  -4.403  -3.001  -3.001
  172   2HH2  ARG  25          2HH1      ARG 376  -3.387  -4.154  -4.154
  173    H    CYS  26           H        CYS 377  -1.102  -2.741  -2.741
  174    HA   CYS  26           HA       CYS 377  -0.733  -1.749  -1.749
  175   1HB   CYS  26          1HB       CYS 377   0.436  -4.231  -4.231
  176   2HB   CYS  26          2HB       CYS 377   1.031  -3.419  -3.419
  177    H    TYR  27           H        TYR 378  -1.352  -2.627  -2.627
  178    HA   TYR  27           HA       TYR 378  -3.165  -4.780  -4.780
  179   1HB   TYR  27          1HB       TYR 378  -1.552  -3.097  -3.097
  180   2HB   TYR  27          2HB       TYR 378  -2.473  -4.500  -4.500
  181    HD1  TYR  27           HD2      TYR 378  -4.982  -4.530  -4.530
  182    HD2  TYR  27           HD1      TYR 378  -2.607  -1.082  -1.082
  183    HE1  TYR  27           HE2      TYR 378  -7.075  -3.272  -3.272
  184    HE2  TYR  27           HE1      TYR 378  -4.714   0.184   0.184
  185    HH   TYR  27           HH       TYR 378  -7.994  -1.537  -1.537
  186   1H    NH2  28          1H1       TYR 378  -2.745  -6.813  -6.813
  187   2H    NH2  28          2H1       TYR 378  -1.262  -7.526  -7.526

  Start of MODEL   15
    1   1H    CYS   1          1H        CYS 379  10.919  -3.047  -3.047
    2   2H    CYS   1          2H        CYS 379  11.090  -1.598  -1.598
    3   3H    CYS   1          3H        CYS 379  11.008  -2.053  -2.053
    4    HA   CYS   1           HA       CYS 379   8.910  -1.004  -1.004
    5   1HB   CYS   1          1HB       CYS 379   7.589  -1.929  -1.929
    6   2HB   CYS   1          2HB       CYS 379   9.176  -1.391  -1.391
    7    H    LYS   2           H        LYS 380   7.227  -1.474  -1.474
    8    HA   LYS   2           HA       LYS 380   6.851  -3.572  -3.572
    9   1HB   LYS   2          1HB       LYS 380   4.900  -1.608  -1.608
   10   2HB   LYS   2          2HB       LYS 380   4.419  -2.827  -2.827
   11   1HG   LYS   2          1HG       LYS 380   5.968  -1.842  -1.842
   12   2HG   LYS   2          2HG       LYS 380   6.443  -0.619  -0.619
   13   1HD   LYS   2          1HD       LYS 380   4.075   0.147   0.147
   14   2HD   LYS   2          2HD       LYS 380   3.630  -1.050  -1.050
   15   1HE   LYS   2          1HE       LYS 380   4.777   0.075   0.075
   16   2HE   LYS   2          2HE       LYS 380   5.844   0.914   0.914
   17   1HZ   LYS   2          1HZ       LYS 380   3.001   1.517   1.517
   18   2HZ   LYS   2          2HZ       LYS 380   4.099   2.387   2.387
   19   3HZ   LYS   2          3HZ       LYS 380   3.899   2.224   2.224
   20    H    SER   3           H        SER 381   5.840  -5.448  -5.448
   21    HA   SER   3           HA       SER 381   5.130  -6.792  -6.792
   22   1HB   SER   3          1HB       SER 381   4.553  -8.664  -8.664
   23   2HB   SER   3          2HB       SER 381   5.974  -7.910  -7.910
   24    HG   SER   3           HG       SER 381   4.322  -8.467  -8.467
   25    HA   HYP   4           HA       HYP 382   0.859  -5.847  -5.847
   26   1HB   HYP   4          1HB       HYP 382   0.949  -8.809  -8.809
   27   2HB   HYP   4          2HB       HYP 382   0.120  -7.493  -7.493
   28    HG   HYP   4           HG       HYP 382   2.479  -8.256  -8.256
   29    HD1  HYP   4           HD1      HYP 382   3.252  -6.028  -6.028
   30   1HD2  HYP   4          1HD2      HYP 382   4.196  -6.867  -6.867
   31   2HD2  HYP   4          2HD2      HYP 382   3.669  -8.477  -8.477
   32    H    GLY   5           H        GLY 383  -0.722  -5.791  -5.791
   33   1HA   GLY   5          1HA       GLY 383  -2.267  -6.728  -6.728
   34   2HA   GLY   5          2HA       GLY 383  -0.899  -7.659  -7.659
   35    H    SER   6           H        SER 384   0.951  -5.444  -5.444
   36    HA   SER   6           HA       SER 384   0.737  -4.657  -4.657
   37   1HB   SER   6          1HB       SER 384   2.850  -4.919  -4.919
   38   2HB   SER   6          2HB       SER 384   2.494  -3.496  -3.496
   39    HG   SER   6           HG       SER 384   3.930  -2.962  -2.962
   40    H    SER   7           H        SER 385   0.384  -2.847  -2.847
   41    HA   SER   7           HA       SER 385  -1.645  -1.053  -1.053
   42   1HB   SER   7          1HB       SER 385  -1.372  -0.071  -0.071
   43   2HB   SER   7          2HB       SER 385  -1.583  -1.830  -1.830
   44    HG   SER   7           HG       SER 385   0.168  -1.111  -1.111
   45    H    CYS   8           H        CYS 386  -1.492   0.891   0.891
   46    HA   CYS   8           HA       CYS 386   0.870   2.532   2.532
   47   1HB   CYS   8          1HB       CYS 386   0.979   2.505   2.505
   48   2HB   CYS   8          2HB       CYS 386   1.341   0.923   0.923
   49    H    SER   9           H        SER 387   0.589   4.446   4.446
   50    HA   SER   9           HA       SER 387  -2.022   5.685   5.685
   51   1HB   SER   9          1HB       SER 387  -0.111   6.838   6.838
   52   2HB   SER   9          2HB       SER 387   0.734   6.874   6.874
   53    HG   SER   9           HG       SER 387  -0.379   8.942   8.942
   54    HA   HYP  10           HA       HYP 388  -2.806   6.039   6.039
   55   1HB   HYP  10          1HB       HYP 388  -4.458   8.262   8.262
   56   2HB   HYP  10          2HB       HYP 388  -5.021   6.601   6.601
   57    HG   HYP  10           HG       HYP 388  -4.230   8.678   8.678
   58    HD1  HYP  10           HD1      HYP 388  -6.021   7.692   7.692
   59   1HD2  HYP  10          1HD2      HYP 388  -4.237   5.676   5.676
   60   2HD2  HYP  10          2HD2      HYP 388  -3.352   6.958   6.958
   61    H    THR  11           H        THR 389  -1.150   8.299   8.299
   62    HA   THR  11           HA       THR 389  -0.166   9.680   9.680
   63    HB   THR  11           HB       THR 389   1.041  11.182  11.182
   64    HG1  THR  11           HG1      THR 389   0.293  11.225  11.225
   65   1HG2  THR  11          1HG2      THR 389  -1.952  11.114  11.114
   66   2HG2  THR  11          2HG2      THR 389  -0.902  12.494  12.494
   67   3HG2  THR  11          3HG2      THR 389  -1.001  11.867  11.867
   68    H    SER  12           H        SER 390   0.676   7.047   7.047
   69    HA   SER  12           HA       SER 390   3.496   7.216   7.216
   70   1HB   SER  12          1HB       SER 390   4.201   6.195   6.195
   71   2HB   SER  12          2HB       SER 390   2.978   7.359   7.359
   72    HG   SER  12           HG       SER 390   2.763   5.275   5.275
   73    H    TYR  13           H        TYR 391   2.620   6.374   6.374
   74    HA   TYR  13           HA       TYR 391   1.705   3.697   3.697
   75   1HB   TYR  13          1HB       TYR 391   3.030   5.469   5.469
   76   2HB   TYR  13          2HB       TYR 391   2.315   3.884   3.884
   77    HD1  TYR  13           HD2      TYR 391  -0.145   3.524   3.524
   78    HD2  TYR  13           HD1      TYR 391   1.678   7.411   7.411
   79    HE1  TYR  13           HE2      TYR 391  -2.410   4.564   4.564
   80    HE2  TYR  13           HE1      TYR 391  -0.602   8.463   8.463
   81    HH   TYR  13           HH       TYR 391  -3.585   6.306   6.306
   82    H    ASN  14           H        ASN 392   3.810   3.622   3.622
   83    HA   ASN  14           HA       ASN 392   6.351   2.943   2.943
   84   1HB   ASN  14          1HB       ASN 392   7.097   2.773   2.773
   85   2HB   ASN  14          2HB       ASN 392   6.345   4.319   4.319
   86   1HD2  ASN  14          1HD2      ASN 392   6.865   3.264   3.264
   87   2HD2  ASN  14          2HD2      ASN 392   5.434   3.159   3.159
   88    H    CYS  15           H        CYS 393   4.368   1.145   1.145
   89    HA   CYS  15           HA       CYS 393   4.958  -1.406  -1.406
   90   1HB   CYS  15          1HB       CYS 393   2.505  -0.709  -0.709
   91   2HB   CYS  15          2HB       CYS 393   2.786  -2.167  -2.167
   92    H    CYS  16           H        CYS 394   5.130  -3.190  -3.190
   93    HA   CYS  16           HA       CYS 394   6.452  -2.791  -2.791
   94   1HB   CYS  16          1HB       CYS 394   5.183  -5.342  -5.342
   95   2HB   CYS  16          2HB       CYS 394   6.465  -5.202  -5.202
   96    H    ARG  17           H        ARG 395   3.125  -3.833  -3.833
   97    HA   ARG  17           HA       ARG 395   2.593  -3.214  -3.214
   98   1HB   ARG  17          1HB       ARG 395   1.157  -4.938  -4.938
   99   2HB   ARG  17          2HB       ARG 395   0.414  -4.402  -4.402
  100   1HG   ARG  17          1HG       ARG 395   2.158  -5.494  -5.494
  101   2HG   ARG  17          2HG       ARG 395   3.021  -5.937  -5.937
  102   1HD   ARG  17          1HD       ARG 395   1.794  -7.874  -7.874
  103   2HD   ARG  17          2HD       ARG 395   1.029  -7.288  -7.288
  104    HE   ARG  17           HE       ARG 395  -0.073  -6.319  -6.319
  105   1HH1  ARG  17          1HH2      ARG 395  -0.353  -9.251  -9.251
  106   2HH1  ARG  17          2HH2      ARG 395  -2.000  -9.254  -9.254
  107   1HH2  ARG  17          1HH1      ARG 395  -2.268  -6.529  -6.529
  108   2HH2  ARG  17          2HH1      ARG 395  -3.100  -7.689  -7.689
  109    H    SER  18           H        SER 396   2.840  -1.152  -1.152
  110    HA   SER  18           HA       SER 396   2.093   0.881   0.881
  111   1HB   SER  18          1HB       SER 396   1.126   0.890   0.890
  112   2HB   SER  18          2HB       SER 396  -0.411   0.394   0.394
  113    HG   SER  18           HG       SER 396  -0.275   2.751   2.751
  114    H    CYS  19           H        CYS 397   0.306   1.937   1.937
  115    HA   CYS  19           HA       CYS 397  -0.830   0.213   0.213
  116   1HB   CYS  19          1HB       CYS 397   0.506   2.222   2.222
  117   2HB   CYS  19          2HB       CYS 397  -0.689   3.238   3.238
  118    H    ASN  20           H        ASN 398  -3.011  -0.112  -0.112
  119    HA   ASN  20           HA       ASN 398  -4.932   1.086   1.086
  120   1HB   ASN  20          1HB       ASN 398  -5.085  -1.352  -1.352
  121   2HB   ASN  20          2HB       ASN 398  -5.470  -0.825  -0.825
  122   1HD2  ASN  20          1HD2      ASN 398  -7.601  -1.496  -1.496
  123   2HD2  ASN  20          2HD2      ASN 398  -8.815  -0.940  -0.940
  124    HA   HYP  21           HA       HYP 399  -5.753   4.446   4.446
  125   1HB   HYP  21          1HB       HYP 399  -7.915   4.764   4.764
  126   2HB   HYP  21          2HB       HYP 399  -6.944   6.025   6.025
  127    HG   HYP  21           HG       HYP 399  -6.242   5.209   5.209
  128    HD1  HYP  21           HD1      HYP 399  -3.934   5.466   5.466
  129   1HD2  HYP  21          1HD2      HYP 399  -4.566   3.178   3.178
  130   2HD2  HYP  21          2HD2      HYP 399  -6.278   2.861   2.861
  131    H    TYR  22           H        TYR 400  -8.240   2.417   2.417
  132    HA   TYR  22           HA       TYR 400 -10.401   2.993   2.993
  133   1HB   TYR  22          1HB       TYR 400 -10.417   1.797   1.797
  134   2HB   TYR  22          2HB       TYR 400 -10.054   0.326   0.326
  135    HD1  TYR  22           HD1      TYR 400 -12.518   2.989   2.989
  136    HD2  TYR  22           HD2      TYR 400 -11.718  -0.669  -0.669
  137    HE1  TYR  22           HE1      TYR 400 -14.977   2.710   2.710
  138    HE2  TYR  22           HE2      TYR 400 -14.178  -0.948  -0.948
  139    HH   TYR  22           HH       TYR 400 -16.185  -0.132  -0.132
  140    H    THR  23           H        THR 401  -8.195   0.206   0.206
  141    HA   THR  23           HA       THR 401  -9.374  -0.404  -0.404
  142    HB   THR  23           HB       THR 401  -8.087  -2.514  -2.514
  143    HG1  THR  23           HG1      THR 401  -7.122  -3.191  -3.191
  144   1HG2  THR  23          1HG2      THR 401  -9.890  -2.052  -2.052
  145   2HG2  THR  23          2HG2      THR 401  -9.452  -3.626  -3.626
  146   3HG2  THR  23          3HG2      THR 401 -10.427  -2.489  -2.489
  147    H    LYS  24           H        LYS 402  -6.862   1.455   1.455
  148    HA   LYS  24           HA       LYS 402  -4.939   2.299   2.299
  149   1HB   LYS  24          1HB       LYS 402  -5.903   1.092   1.092
  150   2HB   LYS  24          2HB       LYS 402  -4.589   2.265   2.265
  151   1HG   LYS  24          1HG       LYS 402  -7.495   2.723   2.723
  152   2HG   LYS  24          2HG       LYS 402  -6.658   3.359   3.359
  153   1HD   LYS  24          1HD       LYS 402  -5.135   4.641   4.641
  154   2HD   LYS  24          2HD       LYS 402  -5.912   3.969   3.969
  155   1HE   LYS  24          1HE       LYS 402  -7.151   5.873   5.873
  156   2HE   LYS  24          2HE       LYS 402  -8.078   4.963   4.963
  157   1HZ   LYS  24          1HZ       LYS 402  -5.908   6.802   6.802
  158   2HZ   LYS  24          2HZ       LYS 402  -7.352   7.105   7.105
  159   3HZ   LYS  24          3HZ       LYS 402  -6.688   6.037   6.037
  160    H    ARG  25           H        ARG 403  -4.649  -0.242  -0.242
  161    HA   ARG  25           HA       ARG 403  -2.485  -1.586  -1.586
  162   1HB   ARG  25          1HB       ARG 403  -4.878  -2.831  -2.831
  163   2HB   ARG  25          2HB       ARG 403  -3.424  -3.746  -3.746
  164   1HG   ARG  25          1HG       ARG 403  -3.800  -3.296  -3.296
  165   2HG   ARG  25          2HG       ARG 403  -5.180  -2.254  -2.254
  166   1HD   ARG  25          1HD       ARG 403  -6.314  -4.137  -4.137
  167   2HD   ARG  25          2HD       ARG 403  -4.921  -5.184  -5.184
  168    HE   ARG  25           HE       ARG 403  -5.662  -4.183  -4.183
  169   1HH1  ARG  25          1HH1      ARG 403  -7.167  -6.423  -6.423
  170   2HH1  ARG  25          2HH1      ARG 403  -8.179  -7.000  -7.000
  171   1HH2  ARG  25          1HH2      ARG 403  -7.255  -4.749  -4.749
  172   2HH2  ARG  25          2HH2      ARG 403  -8.237  -6.024  -6.024
  173    H    CYS  26           H        CYS 404  -0.924  -2.578  -2.578
  174    HA   CYS  26           HA       CYS 404  -0.591  -1.561  -1.561
  175   1HB   CYS  26          1HB       CYS 404   0.707  -3.962  -3.962
  176   2HB   CYS  26          2HB       CYS 404   1.255  -3.179  -3.179
  177    H    TYR  27           H        TYR 405  -1.212  -2.270  -2.270
  178    HA   TYR  27           HA       TYR 405  -3.167  -4.260  -4.260
  179   1HB   TYR  27          1HB       TYR 405  -1.286  -2.831  -2.831
  180   2HB   TYR  27          2HB       TYR 405  -2.538  -3.966  -3.966
  181    HD1  TYR  27           HD1      TYR 405  -5.046  -3.316  -3.316
  182    HD2  TYR  27           HD2      TYR 405  -1.661  -0.654  -0.654
  183    HE1  TYR  27           HE1      TYR 405  -6.604  -1.436  -1.436
  184    HE2  TYR  27           HE2      TYR 405  -3.234   1.233   1.233
  185    HH   TYR  27           HH       TYR 405  -5.302   1.985   1.985
  186   1H    NH2  28          1H1       TYR 405  -2.816  -6.153  -6.153
  187   2H    NH2  28          2H1       TYR 405  -1.431  -7.035  -7.035

  Start of MODEL   16
    1   1H    CYS   1          1H        CYS 406  10.926  -0.802  -0.802
    2   2H    CYS   1          2H        CYS 406  10.930  -1.476  -1.476
    3   3H    CYS   1          3H        CYS 406  10.828  -2.288  -2.288
    4    HA   CYS   1           HA       CYS 406   8.728  -0.460  -0.460
    5   1HB   CYS   1          1HB       CYS 406   7.395  -1.399  -1.399
    6   2HB   CYS   1          2HB       CYS 406   8.850  -0.565  -0.565
    7    H    LYS   2           H        LYS 407   7.050  -1.171  -1.171
    8    HA   LYS   2           HA       LYS 407   7.346  -3.481  -3.481
    9   1HB   LYS   2          1HB       LYS 407   4.930  -1.723  -1.723
   10   2HB   LYS   2          2HB       LYS 407   5.053  -3.001  -3.001
   11   1HG   LYS   2          1HG       LYS 407   6.876  -1.767  -1.767
   12   2HG   LYS   2          2HG       LYS 407   6.742  -0.486  -0.486
   13   1HD   LYS   2          1HD       LYS 407   4.373  -0.145  -0.145
   14   2HD   LYS   2          2HD       LYS 407   4.473  -1.457  -1.457
   15   1HE   LYS   2          1HE       LYS 407   5.731  -0.192  -0.192
   16   2HE   LYS   2          2HE       LYS 407   6.394   0.841   0.841
   17   1HZ   LYS   2          1HZ       LYS 407   3.612   0.924   0.924
   18   2HZ   LYS   2          2HZ       LYS 407   4.623   1.969   1.969
   19   3HZ   LYS   2          3HZ       LYS 407   4.170   1.794   1.794
   20    H    SER   3           H        SER 408   6.201  -5.323  -5.323
   21    HA   SER   3           HA       SER 408   5.420  -6.717  -6.717
   22   1HB   SER   3          1HB       SER 408   4.376  -8.326  -8.326
   23   2HB   SER   3          2HB       SER 408   6.115  -8.007  -8.007
   24    HG   SER   3           HG       SER 408   5.044  -7.944  -7.944
   25    HA   HYP   4           HA       HYP 409   1.100  -5.671  -5.671
   26   1HB   HYP   4          1HB       HYP 409   1.416  -8.561  -8.561
   27   2HB   HYP   4          2HB       HYP 409   0.454  -7.271  -7.271
   28    HG   HYP   4           HG       HYP 409   2.740  -7.656  -7.656
   29    HD1  HYP   4           HD1      HYP 409   3.358  -5.365  -5.365
   30   1HD2  HYP   4          1HD2      HYP 409   4.457  -6.305  -6.305
   31   2HD2  HYP   4          2HD2      HYP 409   4.120  -8.015  -8.015
   32    H    GLY   5           H        GLY 410  -0.711  -5.923  -5.923
   33   1HA   GLY   5          1HA       GLY 410  -2.313  -6.787  -6.787
   34   2HA   GLY   5          2HA       GLY 410  -1.096  -7.925  -7.925
   35    H    SER   6           H        SER 411   0.851  -5.724  -5.724
   36    HA   SER   6           HA       SER 411   0.537  -5.118  -5.118
   37   1HB   SER   6          1HB       SER 411   2.410  -3.932  -3.932
   38   2HB   SER   6          2HB       SER 411   2.574  -3.735  -3.735
   39    HG   SER   6           HG       SER 411   3.923  -5.527  -5.527
   40    H    SER   7           H        SER 412   0.468  -3.264  -3.264
   41    HA   SER   7           HA       SER 412  -1.431  -1.293  -1.293
   42   1HB   SER   7          1HB       SER 412  -1.000  -0.334  -0.334
   43   2HB   SER   7          2HB       SER 412  -1.706  -1.957  -1.957
   44    HG   SER   7           HG       SER 412   0.058  -1.850  -1.850
   45    H    CYS   8           H        CYS 413  -1.086   0.532   0.532
   46    HA   CYS   8           HA       CYS 413   1.470   1.943   1.943
   47   1HB   CYS   8          1HB       CYS 413   1.106   2.107   2.107
   48   2HB   CYS   8          2HB       CYS 413   1.525   0.486   0.486
   49    H    SER   9           H        SER 414   1.315   4.023   4.023
   50    HA   SER   9           HA       SER 414  -1.270   5.364   5.364
   51   1HB   SER   9          1HB       SER 414   0.661   6.485   6.485
   52   2HB   SER   9          2HB       SER 414   1.420   6.666   6.666
   53    HG   SER   9           HG       SER 414   0.105   8.587   8.587
   54    HA   HYP  10           HA       HYP 415  -1.845   5.414   5.414
   55   1HB   HYP  10          1HB       HYP 415  -3.659   7.661   7.661
   56   2HB   HYP  10          2HB       HYP 415  -3.944   6.449   6.449
   57    HG   HYP  10           HG       HYP 415  -5.006   6.061   6.061
   58    HD1  HYP  10           HD1      HYP 415  -4.676   3.725   3.725
   59   1HD2  HYP  10          1HD2      HYP 415  -2.962   4.621   4.621
   60   2HD2  HYP  10          2HD2      HYP 415  -3.136   6.360   6.360
   61    H    THR  11           H        THR 416  -1.271   8.356   8.356
   62    HA   THR  11           HA       THR 416  -0.518  10.138  10.138
   63    HB   THR  11           HB       THR 416   0.888  11.290  11.290
   64    HG1  THR  11           HG1      THR 416   0.695  10.603  10.603
   65   1HG2  THR  11          1HG2      THR 416  -1.969  10.629  10.629
   66   2HG2  THR  11          2HG2      THR 416  -1.029  12.020  12.020
   67   3HG2  THR  11          3HG2      THR 416  -1.483  11.893  11.893
   68    H    SER  12           H        SER 417   1.358   7.571   7.571
   69    HA   SER  12           HA       SER 417   3.775   8.333   8.333
   70   1HB   SER  12          1HB       SER 417   4.792   6.477   6.477
   71   2HB   SER  12          2HB       SER 417   4.361   8.025   8.025
   72    HG   SER  12           HG       SER 417   3.654   6.176   6.176
   73    H    TYR  13           H        TYR 418   1.409   5.766   5.766
   74    HA   TYR  13           HA       TYR 418   1.223   3.731   3.731
   75   1HB   TYR  13          1HB       TYR 418   2.544   5.491   5.491
   76   2HB   TYR  13          2HB       TYR 418   1.849   3.896   3.896
   77    HD1  TYR  13           HD1      TYR 418  -0.675   3.752   3.752
   78    HD2  TYR  13           HD2      TYR 418   1.252   7.195   7.195
   79    HE1  TYR  13           HE1      TYR 418  -2.930   4.763   4.763
   80    HE2  TYR  13           HE2      TYR 418  -0.990   8.210   8.210
   81    HH   TYR  13           HH       TYR 418  -3.116   8.139   8.139
   82    H    ASN  14           H        ASN 419   3.101   3.427   3.427
   83    HA   ASN  14           HA       ASN 419   5.708   2.980   2.980
   84   1HB   ASN  14          1HB       ASN 419   6.478   3.028   3.028
   85   2HB   ASN  14          2HB       ASN 419   5.544   4.456   4.456
   86   1HD2  ASN  14          1HD2      ASN 419   6.001   2.195   2.195
   87   2HD2  ASN  14          2HD2      ASN 419   4.612   2.327   2.327
   88    H    CYS  15           H        CYS 420   3.977   1.046   1.046
   89    HA   CYS  15           HA       CYS 420   5.029  -1.439  -1.439
   90   1HB   CYS  15          1HB       CYS 420   2.266  -0.618  -0.618
   91   2HB   CYS  15          2HB       CYS 420   2.665  -2.202  -2.202
   92    H    CYS  16           H        CYS 421   5.256  -3.125  -3.125
   93    HA   CYS  16           HA       CYS 421   6.564  -2.596  -2.596
   94   1HB   CYS  16          1HB       CYS 421   5.569  -5.197  -5.197
   95   2HB   CYS  16          2HB       CYS 421   6.693  -4.968  -4.968
   96    H    ARG  17           H        ARG 422   3.233  -3.768  -3.768
   97    HA   ARG  17           HA       ARG 422   2.637  -2.925  -2.925
   98   1HB   ARG  17          1HB       ARG 422   1.691  -5.182  -5.182
   99   2HB   ARG  17          2HB       ARG 422   0.378  -4.244  -4.244
  100   1HG   ARG  17          1HG       ARG 422   1.626  -4.481  -4.481
  101   2HG   ARG  17          2HG       ARG 422   2.647  -5.676  -5.676
  102   1HD   ARG  17          1HD       ARG 422   0.765  -6.736  -6.736
  103   2HD   ARG  17          2HD       ARG 422   0.688  -7.046  -7.046
  104    HE   ARG  17           HE       ARG 422  -0.872  -4.796  -4.796
  105   1HH1  ARG  17          1HH2      ARG 422  -1.066  -8.237  -8.237
  106   2HH1  ARG  17          2HH2      ARG 422  -2.688  -8.249  -8.249
  107   1HH2  ARG  17          1HH1      ARG 422  -3.116  -4.892  -4.892
  108   2HH2  ARG  17          2HH1      ARG 422  -3.856  -6.346  -6.346
  109    H    SER  18           H        SER 423   2.855  -1.087  -1.087
  110    HA   SER  18           HA       SER 423   1.934   0.782   0.782
  111   1HB   SER  18          1HB       SER 423   1.510   1.132   1.132
  112   2HB   SER  18          2HB       SER 423  -0.146   0.582   0.582
  113    HG   SER  18           HG       SER 423   0.028   2.965   2.965
  114    H    CYS  19           H        CYS 424  -0.112   1.856   1.856
  115    HA   CYS  19           HA       CYS 424  -1.310   0.037   0.037
  116   1HB   CYS  19          1HB       CYS 424   0.328   1.755   1.755
  117   2HB   CYS  19          2HB       CYS 424  -0.727   3.016   3.016
  118    H    ASN  20           H        ASN 425  -3.422  -0.264  -0.264
  119    HA   ASN  20           HA       ASN 425  -5.258   1.059   1.059
  120   1HB   ASN  20          1HB       ASN 425  -5.343  -1.339  -1.339
  121   2HB   ASN  20          2HB       ASN 425  -5.825  -0.725  -0.725
  122   1HD2  ASN  20          1HD2      ASN 425  -7.633  -2.236  -2.236
  123   2HD2  ASN  20          2HD2      ASN 425  -8.955  -1.658  -1.658
  124    HA   HYP  21           HA       HYP 426  -6.265   4.650   4.650
  125   1HB   HYP  21          1HB       HYP 426  -8.348   4.591   4.591
  126   2HB   HYP  21          2HB       HYP 426  -7.552   5.997   5.997
  127    HG   HYP  21           HG       HYP 426  -6.584   5.093   5.093
  128    HD1  HYP  21           HD1      HYP 426  -4.346   5.504   5.504
  129   1HD2  HYP  21          1HD2      HYP 426  -4.862   3.184   3.184
  130   2HD2  HYP  21          2HD2      HYP 426  -6.524   2.757   2.757
  131    H    TYR  22           H        TYR 427  -8.685   2.372   2.372
  132    HA   TYR  22           HA       TYR 427 -10.726   2.999   2.999
  133   1HB   TYR  22          1HB       TYR 427 -10.201   0.379   0.379
  134   2HB   TYR  22          2HB       TYR 427 -11.723   0.844   0.844
  135    HD1  TYR  22           HD2      TYR 427 -13.077   2.789   2.789
  136    HD2  TYR  22           HD1      TYR 427  -9.637   1.101   1.101
  137    HE1  TYR  22           HE2      TYR 427 -13.450   4.350   4.350
  138    HE2  TYR  22           HE1      TYR 427  -9.990   2.677   2.677
  139    HH   TYR  22           HH       TYR 427 -12.735   5.117   5.117
  140    H    THR  23           H        THR 428  -7.993   0.857   0.857
  141    HA   THR  23           HA       THR 428  -9.093   0.243   0.243
  142    HB   THR  23           HB       THR 428  -7.837  -1.929  -1.929
  143    HG1  THR  23           HG1      THR 428  -7.166  -2.837  -2.837
  144   1HG2  THR  23          1HG2      THR 428  -9.941  -1.605  -1.605
  145   2HG2  THR  23          2HG2      THR 428  -9.456  -3.133  -3.133
  146   3HG2  THR  23          3HG2      THR 428 -10.267  -1.890  -1.890
  147    H    LYS  24           H        LYS 429  -6.511   1.824   1.824
  148    HA   LYS  24           HA       LYS 429  -4.389   2.345   2.345
  149   1HB   LYS  24          1HB       LYS 429  -5.585   1.956   1.956
  150   2HB   LYS  24          2HB       LYS 429  -3.889   2.402   2.402
  151   1HG   LYS  24          1HG       LYS 429  -4.818   4.243   4.243
  152   2HG   LYS  24          2HG       LYS 429  -6.376   3.920   3.920
  153   1HD   LYS  24          1HD       LYS 429  -5.471   4.467   4.467
  154   2HD   LYS  24          2HD       LYS 429  -3.830   4.582   4.582
  155   1HE   LYS  24          1HE       LYS 429  -4.494   6.513   6.513
  156   2HE   LYS  24          2HE       LYS 429  -6.159   6.380   6.380
  157   1HZ   LYS  24          1HZ       LYS 429  -3.858   6.923   6.923
  158   2HZ   LYS  24          2HZ       LYS 429  -4.871   7.949   7.949
  159   3HZ   LYS  24          3HZ       LYS 429  -5.260   6.811   6.811
  160    H    ARG  25           H        ARG 430  -5.041  -0.461  -0.461
  161    HA   ARG  25           HA       ARG 430  -2.690  -1.848  -1.848
  162   1HB   ARG  25          1HB       ARG 430  -5.360  -2.976  -2.976
  163   2HB   ARG  25          2HB       ARG 430  -3.889  -3.960  -3.960
  164   1HG   ARG  25          1HG       ARG 430  -3.497  -3.420  -3.420
  165   2HG   ARG  25          2HG       ARG 430  -5.058  -2.584  -2.584
  166   1HD   ARG  25          1HD       ARG 430  -4.729  -5.468  -5.468
  167   2HD   ARG  25          2HD       ARG 430  -5.103  -5.002  -5.002
  168    HE   ARG  25           HE       ARG 430  -7.165  -4.071  -4.071
  169   1HH1  ARG  25          1HH2      ARG 430  -5.629  -5.689  -5.689
  170   2HH1  ARG  25          2HH2      ARG 430  -7.030  -6.239  -6.239
  171   1HH2  ARG  25          1HH1      ARG 430  -9.072  -4.728  -4.728
  172   2HH2  ARG  25          2HH1      ARG 430  -9.024  -5.679  -5.679
  173    H    CYS  26           H        CYS 431  -1.507  -3.025  -3.025
  174    HA   CYS  26           HA       CYS 431  -1.199  -1.894  -1.894
  175   1HB   CYS  26          1HB       CYS 431   0.297  -4.208  -4.208
  176   2HB   CYS  26          2HB       CYS 431   0.777  -3.195  -3.195
  177    H    TYR  27           H        TYR 432  -1.598  -2.604  -2.604
  178    HA   TYR  27           HA       TYR 432  -3.412  -4.615  -4.615
  179   1HB   TYR  27          1HB       TYR 432  -1.290  -3.118  -3.118
  180   2HB   TYR  27          2HB       TYR 432  -2.561  -4.114  -4.114
  181    HD1  TYR  27           HD2      TYR 432  -5.081  -3.365  -3.365
  182    HD2  TYR  27           HD1      TYR 432  -1.525  -0.909  -0.909
  183    HE1  TYR  27           HE2      TYR 432  -6.503  -1.375  -1.375
  184    HE2  TYR  27           HE1      TYR 432  -2.935   1.088   1.088
  185    HH   TYR  27           HH       TYR 432  -6.607   0.762   0.762
  186   1H    NH2  28          1H1       TYR 432  -2.965  -6.591  -6.591
  187   2H    NH2  28          2H1       TYR 432  -1.536  -7.397  -7.397

  Start of MODEL   17
    1   1H    CYS   1          1H        CYS 433  10.772  -2.672  -2.672
    2   2H    CYS   1          2H        CYS 433  10.851  -1.263  -1.263
    3   3H    CYS   1          3H        CYS 433  10.600  -1.545  -1.545
    4    HA   CYS   1           HA       CYS 433   8.521  -0.825  -0.825
    5   1HB   CYS   1          1HB       CYS 433   7.585  -1.925  -1.925
    6   2HB   CYS   1          2HB       CYS 433   9.272  -1.562  -1.562
    7    H    LYS   2           H        LYS 434   6.826  -1.342  -1.342
    8    HA   LYS   2           HA       LYS 434   6.774  -3.497  -3.497
    9   1HB   LYS   2          1HB       LYS 434   4.340  -1.951  -1.951
   10   2HB   LYS   2          2HB       LYS 434   4.571  -2.882  -2.882
   11   1HG   LYS   2          1HG       LYS 434   5.690  -0.200  -0.200
   12   2HG   LYS   2          2HG       LYS 434   4.616  -0.628  -0.628
   13   1HD   LYS   2          1HD       LYS 434   6.441  -1.763  -1.763
   14   2HD   LYS   2          2HD       LYS 434   7.522  -1.435  -1.435
   15   1HE   LYS   2          1HE       LYS 434   6.284   0.571   0.571
   16   2HE   LYS   2          2HE       LYS 434   8.001   0.179   0.179
   17   1HZ   LYS   2          1HZ       LYS 434   6.392   1.500   1.500
   18   2HZ   LYS   2          2HZ       LYS 434   7.413   2.195   2.195
   19   3HZ   LYS   2          3HZ       LYS 434   7.836   1.170   1.170
   20    H    SER   3           H        SER 435   6.033  -5.430  -5.430
   21    HA   SER   3           HA       SER 435   5.236  -6.775  -6.775
   22   1HB   SER   3          1HB       SER 435   4.499  -8.550  -8.550
   23   2HB   SER   3          2HB       SER 435   6.181  -8.011  -8.011
   24    HG   SER   3           HG       SER 435   5.091  -8.112  -8.112
   25    HA   HYP   4           HA       HYP 436   1.001  -5.692  -5.692
   26   1HB   HYP   4          1HB       HYP 436   1.033  -8.567  -8.567
   27   2HB   HYP   4          2HB       HYP 436   0.223  -7.162  -7.162
   28    HG   HYP   4           HG       HYP 436   2.586  -7.899  -7.899
   29    HD1  HYP   4           HD1      HYP 436   3.303  -5.672  -5.672
   30   1HD2  HYP   4          1HD2      HYP 436   4.253  -6.453  -6.453
   31   2HD2  HYP   4          2HD2      HYP 436   3.904  -8.158  -8.158
   32    H    GLY   5           H        GLY 437  -0.713  -5.768  -5.768
   33   1HA   GLY   5          1HA       GLY 437  -2.286  -6.664  -6.664
   34   2HA   GLY   5          2HA       GLY 437  -1.010  -7.757  -7.757
   35    H    SER   6           H        SER 438   0.882  -5.376  -5.376
   36    HA   SER   6           HA       SER 438   0.574  -4.797  -4.797
   37   1HB   SER   6          1HB       SER 438   2.544  -3.588  -3.588
   38   2HB   SER   6          2HB       SER 438   2.671  -3.601  -3.601
   39    HG   SER   6           HG       SER 438   4.012  -5.295  -5.295
   40    H    SER   7           H        SER 439   0.407  -2.906  -2.906
   41    HA   SER   7           HA       SER 439  -1.427  -0.944  -0.944
   42   1HB   SER   7          1HB       SER 439  -1.233   0.007   0.007
   43   2HB   SER   7          2HB       SER 439  -1.673  -1.710  -1.710
   44    HG   SER   7           HG       SER 439  -0.011  -1.230  -1.230
   45    H    CYS   8           H        CYS 440  -1.219   0.597   0.597
   46    HA   CYS   8           HA       CYS 440   1.211   2.215   2.215
   47   1HB   CYS   8          1HB       CYS 440   0.964   2.217   2.217
   48   2HB   CYS   8          2HB       CYS 440   1.219   0.585   0.585
   49    H    SER   9           H        SER 441   0.941   4.243   4.243
   50    HA   SER   9           HA       SER 441  -1.725   5.448   5.448
   51   1HB   SER   9          1HB       SER 441  -0.070   6.689   6.689
   52   2HB   SER   9          2HB       SER 441   0.966   6.853   6.853
   53    HG   SER   9           HG       SER 441  -0.397   8.801   8.801
   54    HA   HYP  10           HA       HYP 442  -1.854   6.073   6.073
   55   1HB   HYP  10          1HB       HYP 442  -3.219   8.579   8.579
   56   2HB   HYP  10          2HB       HYP 442  -3.894   7.049   7.049
   57    HG   HYP  10           HG       HYP 442  -4.085   8.255   8.255
   58    HD1  HYP  10           HD1      HYP 442  -5.813   6.523   6.523
   59   1HD2  HYP  10          1HD2      HYP 442  -3.649   5.320   5.320
   60   2HD2  HYP  10          2HD2      HYP 442  -3.114   6.619   6.619
   61    H    THR  11           H        THR 443  -0.925   8.530   8.530
   62    HA   THR  11           HA       THR 443   0.377  10.259  10.259
   63    HB   THR  11           HB       THR 443   1.110  11.571  11.571
   64    HG1  THR  11           HG1      THR 443   0.440  11.012  11.012
   65   1HG2  THR  11          1HG2      THR 443  -1.784  10.761  10.761
   66   2HG2  THR  11          2HG2      THR 443  -1.072  12.244  12.244
   67   3HG2  THR  11          3HG2      THR 443  -1.083  11.968  11.968
   68    H    SER  12           H        SER 444   1.403   7.407   7.407
   69    HA   SER  12           HA       SER 444   4.197   8.002   8.002
   70   1HB   SER  12          1HB       SER 444   4.768   6.070   6.070
   71   2HB   SER  12          2HB       SER 444   4.097   7.486   7.486
   72    HG   SER  12           HG       SER 444   3.109   5.459   5.459
   73    H    TYR  13           H        TYR 445   1.678   5.931   5.931
   74    HA   TYR  13           HA       TYR 445   1.596   3.934   3.934
   75   1HB   TYR  13          1HB       TYR 445   2.977   5.890   5.890
   76   2HB   TYR  13          2HB       TYR 445   2.548   4.263   4.263
   77    HD1  TYR  13           HD2      TYR 445  -0.086   3.704   3.704
   78    HD2  TYR  13           HD1      TYR 445   1.568   7.445   7.445
   79    HE1  TYR  13           HE2      TYR 445  -2.393   4.506   4.506
   80    HE2  TYR  13           HE1      TYR 445  -0.740   8.243   8.243
   81    HH   TYR  13           HH       TYR 445  -3.665   6.126   6.126
   82    H    ASN  14           H        ASN 446   3.597   3.646   3.646
   83    HA   ASN  14           HA       ASN 446   6.203   2.886   2.886
   84   1HB   ASN  14          1HB       ASN 446   6.506   2.469   2.469
   85   2HB   ASN  14          2HB       ASN 446   5.917   4.098   4.098
   86   1HD2  ASN  14          1HD2      ASN 446   5.576   1.925   1.925
   87   2HD2  ASN  14          2HD2      ASN 446   3.988   2.091   2.091
   88    H    CYS  15           H        CYS 447   4.257   1.280   1.280
   89    HA   CYS  15           HA       CYS 447   4.434  -1.388  -1.388
   90   1HB   CYS  15          1HB       CYS 447   2.519  -0.117  -0.117
   91   2HB   CYS  15          2HB       CYS 447   2.423  -1.787  -1.787
   92    H    CYS  16           H        CYS 448   4.988  -3.045  -3.045
   93    HA   CYS  16           HA       CYS 448   6.575  -2.911  -2.911
   94   1HB   CYS  16          1HB       CYS 448   5.056  -5.262  -5.262
   95   2HB   CYS  16          2HB       CYS 448   6.388  -5.345  -5.345
   96    H    ARG  17           H        ARG 449   3.155  -3.777  -3.777
   97    HA   ARG  17           HA       ARG 449   2.773  -2.426  -2.426
   98   1HB   ARG  17          1HB       ARG 449   1.082  -4.657  -4.657
   99   2HB   ARG  17          2HB       ARG 449   0.680  -3.691  -3.691
  100   1HG   ARG  17          1HG       ARG 449   2.577  -4.585  -4.585
  101   2HG   ARG  17          2HG       ARG 449   3.171  -5.413  -5.413
  102   1HD   ARG  17          1HD       ARG 449   0.493  -5.960  -5.960
  103   2HD   ARG  17          2HD       ARG 449   1.958  -6.921  -6.921
  104    HE   ARG  17           HE       ARG 449   1.707  -6.955  -6.955
  105   1HH1  ARG  17          1HH2      ARG 449  -0.879  -7.552  -7.552
  106   2HH1  ARG  17          2HH2      ARG 449  -1.533  -8.740  -8.740
  107   1HH2  ARG  17          1HH1      ARG 449   0.731  -8.521  -8.521
  108   2HH2  ARG  17          2HH1      ARG 449  -0.617  -9.290  -9.290
  109    H    SER  18           H        SER 450   1.786  -0.652  -0.652
  110    HA   SER  18           HA       SER 450   1.397   1.081   1.081
  111   1HB   SER  18          1HB       SER 450  -0.837   0.587   0.587
  112   2HB   SER  18          2HB       SER 450  -0.360   2.131   2.131
  113    HG   SER  18           HG       SER 450   0.559   1.858   1.858
  114    H    CYS  19           H        CYS 451  -0.112   2.086   2.086
  115    HA   CYS  19           HA       CYS 451  -1.309   0.317   0.317
  116   1HB   CYS  19          1HB       CYS 451   0.148   2.239   2.239
  117   2HB   CYS  19          2HB       CYS 451  -1.063   3.338   3.338
  118    H    ASN  20           H        ASN 452  -3.299  -0.206  -0.206
  119    HA   ASN  20           HA       ASN 452  -5.425   0.943   0.943
  120   1HB   ASN  20          1HB       ASN 452  -5.299  -1.478  -1.478
  121   2HB   ASN  20          2HB       ASN 452  -5.555  -1.014  -1.014
  122   1HD2  ASN  20          1HD2      ASN 452  -7.550  -2.089  -2.089
  123   2HD2  ASN  20          2HD2      ASN 452  -8.925  -1.619  -1.619
  124    HA   HYP  21           HA       HYP 453  -6.117   4.113   4.113
  125   1HB   HYP  21          1HB       HYP 453  -8.428   4.637   4.637
  126   2HB   HYP  21          2HB       HYP 453  -7.364   5.808   5.808
  127    HG   HYP  21           HG       HYP 453  -6.972   5.247   5.247
  128    HD1  HYP  21           HD1      HYP 453  -4.625   5.472   5.472
  129   1HD2  HYP  21          1HD2      HYP 453  -5.160   3.176   3.176
  130   2HD2  HYP  21          2HD2      HYP 453  -6.884   2.842   2.842
  131    H    TYR  22           H        TYR 454  -8.652   2.076   2.076
  132    HA   TYR  22           HA       TYR 454 -10.780   2.611   2.611
  133   1HB   TYR  22          1HB       TYR 454 -11.014   1.407   1.407
  134   2HB   TYR  22          2HB       TYR 454 -10.237  -0.008  -0.008
  135    HD1  TYR  22           HD1      TYR 454 -12.909   2.421   2.421
  136    HD2  TYR  22           HD2      TYR 454 -11.736  -1.707  -1.707
  137    HE1  TYR  22           HE1      TYR 454 -15.073   1.657   1.657
  138    HE2  TYR  22           HE2      TYR 454 -13.912  -2.470  -2.470
  139    HH   TYR  22           HH       TYR 454 -15.942  -1.927  -1.927
  140    H    THR  23           H        THR 455  -8.419  -0.006  -0.006
  141    HA   THR  23           HA       THR 455  -9.271  -0.506  -0.506
  142    HB   THR  23           HB       THR 455  -8.113  -2.657  -2.657
  143    HG1  THR  23           HG1      THR 455  -7.485  -3.510  -3.510
  144   1HG2  THR  23          1HG2      THR 455 -10.250  -2.258  -2.258
  145   2HG2  THR  23          2HG2      THR 455  -9.756  -3.806  -3.806
  146   3HG2  THR  23          3HG2      THR 455 -10.541  -2.582  -2.582
  147    H    LYS  24           H        LYS 456  -6.901   1.265   1.265
  148    HA   LYS  24           HA       LYS 456  -4.780   1.999   1.999
  149   1HB   LYS  24          1HB       LYS 456  -5.826   1.219   1.219
  150   2HB   LYS  24          2HB       LYS 456  -4.364   2.181   2.181
  151   1HG   LYS  24          1HG       LYS 456  -7.017   3.049   3.049
  152   2HG   LYS  24          2HG       LYS 456  -6.589   3.402   3.402
  153   1HD   LYS  24          1HD       LYS 456  -4.606   4.625   4.625
  154   2HD   LYS  24          2HD       LYS 456  -4.962   4.222   4.222
  155   1HE   LYS  24          1HE       LYS 456  -7.059   5.619   5.619
  156   2HE   LYS  24          2HE       LYS 456  -5.670   6.554   6.554
  157   1HZ   LYS  24          1HZ       LYS 456  -7.457   5.047   5.047
  158   2HZ   LYS  24          2HZ       LYS 456  -7.459   6.534   6.534
  159   3HZ   LYS  24          3HZ       LYS 456  -6.287   5.834   5.834
  160    H    ARG  25           H        ARG 457  -4.755  -0.486  -0.486
  161    HA   ARG  25           HA       ARG 457  -2.371  -1.711  -1.711
  162   1HB   ARG  25          1HB       ARG 457  -5.021  -3.041  -3.041
  163   2HB   ARG  25          2HB       ARG 457  -3.512  -3.969  -3.969
  164   1HG   ARG  25          1HG       ARG 457  -3.003  -3.351  -3.351
  165   2HG   ARG  25          2HG       ARG 457  -4.469  -2.358  -2.358
  166   1HD   ARG  25          1HD       ARG 457  -5.869  -4.188  -4.188
  167   2HD   ARG  25          2HD       ARG 457  -4.753  -5.227  -5.227
  168    HE   ARG  25           HE       ARG 457  -3.642  -5.687  -5.687
  169   1HH1  ARG  25          1HH2      ARG 457  -6.394  -3.805  -3.805
  170   2HH1  ARG  25          2HH2      ARG 457  -6.004  -3.777  -3.777
  171   1HH2  ARG  25          1HH1      ARG 457  -3.346  -5.857  -5.857
  172   2HH2  ARG  25          2HH1      ARG 457  -4.260  -4.968  -4.968
  173    H    CYS  26           H        CYS 458  -0.985  -2.745  -2.745
  174    HA   CYS  26           HA       CYS 458  -0.817  -1.703  -1.703
  175   1HB   CYS  26          1HB       CYS 458   0.715  -4.009  -4.009
  176   2HB   CYS  26          2HB       CYS 458   1.125  -3.189  -3.189
  177    H    TYR  27           H        TYR 459  -1.369  -2.481  -2.481
  178    HA   TYR  27           HA       TYR 459  -3.272  -4.561  -4.561
  179   1HB   TYR  27          1HB       TYR 459  -1.761  -2.823  -2.823
  180   2HB   TYR  27          2HB       TYR 459  -2.693  -4.211  -4.211
  181    HD1  TYR  27           HD2      TYR 459  -5.166  -4.178  -4.178
  182    HD2  TYR  27           HD1      TYR 459  -2.824  -0.901  -0.901
  183    HE1  TYR  27           HE2      TYR 459  -7.277  -2.875  -2.875
  184    HE2  TYR  27           HE1      TYR 459  -4.925   0.385   0.385
  185    HH   TYR  27           HH       TYR 459  -8.187  -0.985  -0.985
  186   1H    NH2  28          1H1       TYR 459  -3.058  -6.493  -6.493
  187   2H    NH2  28          2H1       TYR 459  -1.636  -7.314  -7.314

  Start of MODEL   18
    1   1H    CYS   1          1H        CYS 460  10.852  -2.985  -2.985
    2   2H    CYS   1          2H        CYS 460  10.938  -1.611  -1.611
    3   3H    CYS   1          3H        CYS 460  10.942  -1.804  -1.804
    4    HA   CYS   1           HA       CYS 460   8.771  -0.962  -0.962
    5   1HB   CYS   1          1HB       CYS 460   7.446  -2.119  -2.119
    6   2HB   CYS   1          2HB       CYS 460   9.036  -1.776  -1.776
    7    H    LYS   2           H        LYS 461   6.900  -1.454  -1.454
    8    HA   LYS   2           HA       LYS 461   6.882  -3.408  -3.408
    9   1HB   LYS   2          1HB       LYS 461   4.843  -1.337  -1.337
   10   2HB   LYS   2          2HB       LYS 461   4.644  -2.428  -2.428
   11   1HG   LYS   2          1HG       LYS 461   6.817  -1.481  -1.481
   12   2HG   LYS   2          2HG       LYS 461   6.698  -0.247  -0.247
   13   1HD   LYS   2          1HD       LYS 461   4.501  -0.707  -0.707
   14   2HD   LYS   2          2HD       LYS 461   5.879   0.356   0.356
   15   1HE   LYS   2          1HE       LYS 461   4.152   1.786   1.786
   16   2HE   LYS   2          2HE       LYS 461   5.217   1.627   1.627
   17   1HZ   LYS   2          1HZ       LYS 461   2.725   0.162   0.162
   18   2HZ   LYS   2          2HZ       LYS 461   2.904   1.311   1.311
   19   3HZ   LYS   2          3HZ       LYS 461   3.622   0.029   0.029
   20    H    SER   3           H        SER 462   5.829  -5.194  -5.194
   21    HA   SER   3           HA       SER 462   5.172  -6.733  -6.733
   22   1HB   SER   3          1HB       SER 462   5.817  -7.669  -7.669
   23   2HB   SER   3          2HB       SER 462   4.256  -7.141  -7.141
   24    HG   SER   3           HG       SER 462   4.229  -9.437  -9.437
   25    HA   HYP   4           HA       HYP 463   0.878  -5.855  -5.855
   26   1HB   HYP   4          1HB       HYP 463   1.119  -8.765  -8.765
   27   2HB   HYP   4          2HB       HYP 463   0.258  -7.448  -7.448
   28    HG   HYP   4           HG       HYP 463   2.667  -8.050  -8.050
   29    HD1  HYP   4           HD1      HYP 463   3.317  -5.753  -5.753
   30   1HD2  HYP   4          1HD2      HYP 463   4.299  -6.697  -6.697
   31   2HD2  HYP   4          2HD2      HYP 463   3.807  -8.344  -8.344
   32    H    GLY   5           H        GLY 464  -0.643  -5.843  -5.843
   33   1HA   GLY   5          1HA       GLY 464  -2.071  -6.735  -6.735
   34   2HA   GLY   5          2HA       GLY 464  -0.698  -7.737  -7.737
   35    H    SER   6           H        SER 465   1.259  -5.643  -5.643
   36    HA   SER   6           HA       SER 465   1.148  -4.695  -4.695
   37   1HB   SER   6          1HB       SER 465   2.969  -3.950  -3.950
   38   2HB   SER   6          2HB       SER 465   3.059  -3.181  -3.181
   39    HG   SER   6           HG       SER 465   4.544  -5.033  -5.033
   40    H    SER   7           H        SER 466   0.578  -2.921  -2.921
   41    HA   SER   7           HA       SER 466  -1.300  -1.105  -1.105
   42   1HB   SER   7          1HB       SER 466   0.627  -0.913  -0.913
   43   2HB   SER   7          2HB       SER 466  -0.738   0.186   0.186
   44    HG   SER   7           HG       SER 466  -1.308  -1.594  -1.594
   45    H    CYS   8           H        CYS 467  -1.289   0.895   0.895
   46    HA   CYS   8           HA       CYS 467   0.921   2.661   2.661
   47   1HB   CYS   8          1HB       CYS 467   0.691   2.844   2.844
   48   2HB   CYS   8          2HB       CYS 467   1.330   1.273   1.273
   49    H    SER   9           H        SER 468   0.187   4.752   4.752
   50    HA   SER   9           HA       SER 468  -2.655   5.292   5.292
   51   1HB   SER   9          1HB       SER 468  -2.067   7.466   7.466
   52   2HB   SER   9          2HB       SER 468  -0.574   6.637   6.637
   53    HG   SER   9           HG       SER 468  -0.135   8.566   8.566
   54    HA   HYP  10           HA       HYP 469  -3.716   6.350   6.350
   55   1HB   HYP  10          1HB       HYP 469  -4.016   9.151   9.151
   56   2HB   HYP  10          2HB       HYP 469  -5.059   8.303   8.303
   57    HG   HYP  10           HG       HYP 469  -5.742   8.435   8.435
   58    HD1  HYP  10           HD1      HYP 469  -6.849   6.347   6.347
   59   1HD2  HYP  10          1HD2      HYP 469  -4.712   5.961   5.961
   60   2HD2  HYP  10          2HD2      HYP 469  -3.976   7.502   7.502
   61    H    THR  11           H        THR 470  -1.364   8.252   8.252
   62    HA   THR  11           HA       THR 470  -0.178   9.219   9.219
   63    HB   THR  11           HB       THR 470  -0.750  10.960  10.960
   64    HG1  THR  11           HG1      THR 470   1.327  12.071  12.071
   65   1HG2  THR  11          1HG2      THR 470   1.501   9.726   9.726
   66   2HG2  THR  11          2HG2      THR 470   0.706  11.275  11.275
   67   3HG2  THR  11          3HG2      THR 470  -0.207   9.763   9.763
   68    H    SER  12           H        SER 471   0.301   6.713   6.713
   69    HA   SER  12           HA       SER 471   3.234   6.716   6.716
   70   1HB   SER  12          1HB       SER 471   1.469   4.912   4.912
   71   2HB   SER  12          2HB       SER 471   3.225   5.115   5.115
   72    HG   SER  12           HG       SER 471   2.077   6.306   6.306
   73    H    TYR  13           H        TYR 472   2.625   6.282   6.282
   74    HA   TYR  13           HA       TYR 472   1.926   3.658   3.658
   75   1HB   TYR  13          1HB       TYR 472   3.167   6.009   6.009
   76   2HB   TYR  13          2HB       TYR 472   2.634   4.514   4.514
   77    HD1  TYR  13           HD1      TYR 472   0.170   3.795   3.795
   78    HD2  TYR  13           HD2      TYR 472   1.664   7.810   7.810
   79    HE1  TYR  13           HE1      TYR 472  -2.161   4.694   4.694
   80    HE2  TYR  13           HE2      TYR 472  -0.669   8.710   8.710
   81    HH   TYR  13           HH       TYR 472  -2.842   8.261   8.261
   82    H    ASN  14           H        ASN 473   3.820   3.372   3.372
   83    HA   ASN  14           HA       ASN 473   6.502   2.956   2.956
   84   1HB   ASN  14          1HB       ASN 473   6.027   4.314   4.314
   85   2HB   ASN  14          2HB       ASN 473   5.514   2.801   2.801
   86   1HD2  ASN  14          1HD2      ASN 473   7.092   1.796   1.796
   87   2HD2  ASN  14          2HD2      ASN 473   8.716   1.978   1.978
   88    H    CYS  15           H        CYS 474   4.475   1.254   1.254
   89    HA   CYS  15           HA       CYS 474   4.755  -1.275  -1.275
   90   1HB   CYS  15          1HB       CYS 474   2.476  -0.168  -0.168
   91   2HB   CYS  15          2HB       CYS 474   2.557  -1.838  -1.838
   92    H    CYS  16           H        CYS 475   4.938  -3.108  -3.108
   93    HA   CYS  16           HA       CYS 475   6.381  -3.214  -3.214
   94   1HB   CYS  16          1HB       CYS 475   4.825  -5.424  -5.424
   95   2HB   CYS  16          2HB       CYS 475   6.081  -5.640  -5.640
   96    H    ARG  17           H        ARG 476   2.930  -3.910  -3.910
   97    HA   ARG  17           HA       ARG 476   2.729  -3.232  -3.232
   98   1HB   ARG  17          1HB       ARG 476   1.051  -5.127  -5.127
   99   2HB   ARG  17          2HB       ARG 476   0.577  -4.427  -4.427
  100   1HG   ARG  17          1HG       ARG 476   2.733  -5.258  -5.258
  101   2HG   ARG  17          2HG       ARG 476   3.053  -6.075  -6.075
  102   1HD   ARG  17          1HD       ARG 476   0.582  -6.544  -6.544
  103   2HD   ARG  17          2HD       ARG 476   2.045  -7.539  -7.539
  104    HE   ARG  17           HE       ARG 476   1.154  -7.391  -7.391
  105   1HH1  ARG  17          1HH2      ARG 476   0.248  -8.930  -8.930
  106   2HH1  ARG  17          2HH2      ARG 476  -0.493 -10.201 -10.201
  107   1HH2  ARG  17          1HH1      ARG 476   0.061  -9.139  -9.139
  108   2HH2  ARG  17          2HH1      ARG 476  -0.599 -10.320 -10.320
  109    H    SER  18           H        SER 477   2.831  -1.243  -1.243
  110    HA   SER  18           HA       SER 477   2.014   0.817   0.817
  111   1HB   SER  18          1HB       SER 477   1.549   0.916   0.916
  112   2HB   SER  18          2HB       SER 477  -0.087   0.309   0.309
  113    HG   SER  18           HG       SER 477  -0.035   2.688   2.688
  114    H    CYS  19           H        CYS 478   0.216   1.954   1.954
  115    HA   CYS  19           HA       CYS 478  -1.026   0.380   0.380
  116   1HB   CYS  19          1HB       CYS 478   0.185   2.590   2.590
  117   2HB   CYS  19          2HB       CYS 478  -1.202   3.377   3.377
  118    H    ASN  20           H        ASN 479  -3.146  -0.122  -0.122
  119    HA   ASN  20           HA       ASN 479  -5.146   1.097   1.097
  120   1HB   ASN  20          1HB       ASN 479  -5.304  -1.330  -1.330
  121   2HB   ASN  20          2HB       ASN 479  -5.651  -0.740  -0.740
  122   1HD2  ASN  20          1HD2      ASN 479  -7.906  -1.110  -1.110
  123   2HD2  ASN  20          2HD2      ASN 479  -9.048  -0.565  -0.565
  124    HA   HYP  21           HA       HYP 480  -5.222   4.454   4.454
  125   1HB   HYP  21          1HB       HYP 480  -7.388   5.329   5.329
  126   2HB   HYP  21          2HB       HYP 480  -6.124   6.310   6.310
  127    HG   HYP  21           HG       HYP 480  -5.654   5.646   5.646
  128    HD1  HYP  21           HD1      HYP 480  -3.395   5.054   5.054
  129   1HD2  HYP  21          1HD2      HYP 480  -4.709   3.081   3.081
  130   2HD2  HYP  21          2HD2      HYP 480  -6.470   3.272   3.272
  131    H    TYR  22           H        TYR 481  -8.046   2.897   2.897
  132    HA   TYR  22           HA       TYR 481 -10.073   3.758   3.758
  133   1HB   TYR  22          1HB       TYR 481  -9.938   1.115   1.115
  134   2HB   TYR  22          2HB       TYR 481 -11.388   1.947   1.947
  135    HD1  TYR  22           HD2      TYR 481 -12.185   4.057   4.057
  136    HD2  TYR  22           HD1      TYR 481  -8.876   1.692   1.692
  137    HE1  TYR  22           HE2      TYR 481 -12.147   5.431   5.431
  138    HE2  TYR  22           HE1      TYR 481  -8.813   3.079   3.079
  139    HH   TYR  22           HH       TYR 481 -11.188   5.854   5.854
  140    H    THR  23           H        THR 482  -8.137   0.771   0.771
  141    HA   THR  23           HA       THR 482  -9.258   0.239   0.239
  142    HB   THR  23           HB       THR 482  -8.519  -2.069  -2.069
  143    HG1  THR  23           HG1      THR 482  -7.847  -2.853  -2.853
  144   1HG2  THR  23          1HG2      THR 482 -10.303  -1.100  -1.100
  145   2HG2  THR  23          2HG2      THR 482 -10.211  -2.760  -2.760
  146   3HG2  THR  23          3HG2      THR 482 -10.831  -1.466  -1.466
  147    H    LYS  24           H        LYS 483  -6.578   1.519   1.519
  148    HA   LYS  24           HA       LYS 483  -4.545   2.203   2.203
  149   1HB   LYS  24          1HB       LYS 483  -5.960   1.772   1.772
  150   2HB   LYS  24          2HB       LYS 483  -4.297   2.382   2.382
  151   1HG   LYS  24          1HG       LYS 483  -4.910   4.271   4.271
  152   2HG   LYS  24          2HG       LYS 483  -6.438   3.542   3.542
  153   1HD   LYS  24          1HD       LYS 483  -5.955   4.217   4.217
  154   2HD   LYS  24          2HD       LYS 483  -6.499   5.450   5.450
  155   1HE   LYS  24          1HE       LYS 483  -7.951   2.816   2.816
  156   2HE   LYS  24          2HE       LYS 483  -8.343   4.284   4.284
  157   1HZ   LYS  24          1HZ       LYS 483  -8.451   4.100   4.100
  158   2HZ   LYS  24          2HZ       LYS 483  -9.658   4.134   4.134
  159   3HZ   LYS  24          3HZ       LYS 483  -8.780   5.335   5.335
  160    H    ARG  25           H        ARG 484  -4.511  -0.359  -0.359
  161    HA   ARG  25           HA       ARG 484  -2.203  -1.599  -1.599
  162   1HB   ARG  25          1HB       ARG 484  -4.673  -3.046  -3.046
  163   2HB   ARG  25          2HB       ARG 484  -3.154  -3.847  -3.847
  164   1HG   ARG  25          1HG       ARG 484  -3.351  -3.167  -3.167
  165   2HG   ARG  25          2HG       ARG 484  -4.705  -2.087  -2.087
  166   1HD   ARG  25          1HD       ARG 484  -5.997  -4.150  -4.150
  167   2HD   ARG  25          2HD       ARG 484  -4.686  -5.114  -5.114
  168    HE   ARG  25           HE       ARG 484  -6.000  -3.085  -3.085
  169   1HH1  ARG  25          1HH2      ARG 484  -5.041  -6.387  -6.387
  170   2HH1  ARG  25          2HH2      ARG 484  -5.780  -6.824  -6.824
  171   1HH2  ARG  25          1HH1      ARG 484  -6.767  -3.732  -3.732
  172   2HH2  ARG  25          2HH1      ARG 484  -6.751  -5.328  -5.328
  173    H    CYS  26           H        CYS 485  -0.797  -2.658  -2.658
  174    HA   CYS  26           HA       CYS 485  -0.559  -1.780  -1.780
  175   1HB   CYS  26          1HB       CYS 485   0.798  -4.137  -4.137
  176   2HB   CYS  26          2HB       CYS 485   1.306  -3.288  -3.288
  177    H    TYR  27           H        TYR 486  -1.216  -2.687  -2.687
  178    HA   TYR  27           HA       TYR 486  -3.203  -4.691  -4.691
  179   1HB   TYR  27          1HB       TYR 486  -1.474  -3.416  -3.416
  180   2HB   TYR  27          2HB       TYR 486  -2.829  -4.509  -4.509
  181    HD1  TYR  27           HD1      TYR 486  -5.184  -3.755  -3.755
  182    HD2  TYR  27           HD2      TYR 486  -1.796  -1.162  -1.162
  183    HE1  TYR  27           HE1      TYR 486  -6.749  -1.881  -1.881
  184    HE2  TYR  27           HE2      TYR 486  -3.348   0.700   0.700
  185    HH   TYR  27           HH       TYR 486  -5.379   1.489   1.489
  186   1H    NH2  28          1H1       TYR 486  -3.053  -6.843  -6.843
  187   2H    NH2  28          2H1       TYR 486  -1.635  -7.653  -7.653

  Start of MODEL   19
    1   1H    CYS   1          1H        CYS 487  11.192  -1.804  -1.804
    2   2H    CYS   1          2H        CYS 487  10.922  -2.433  -2.433
    3   3H    CYS   1          3H        CYS 487  10.788  -3.237  -3.237
    4    HA   CYS   1           HA       CYS 487   9.026  -1.006  -1.006
    5   1HB   CYS   1          1HB       CYS 487   7.694  -1.728  -1.728
    6   2HB   CYS   1          2HB       CYS 487   9.316  -1.162  -1.162
    7    H    LYS   2           H        LYS 488   6.967  -1.337  -1.337
    8    HA   LYS   2           HA       LYS 488   6.579  -3.451  -3.451
    9   1HB   LYS   2          1HB       LYS 488   4.725  -1.309  -1.309
   10   2HB   LYS   2          2HB       LYS 488   4.224  -2.630  -2.630
   11   1HG   LYS   2          1HG       LYS 488   4.782  -0.943  -0.943
   12   2HG   LYS   2          2HG       LYS 488   6.253  -1.930  -1.930
   13   1HD   LYS   2          1HD       LYS 488   7.332  -0.379  -0.379
   14   2HD   LYS   2          2HD       LYS 488   5.832   0.540   0.540
   15   1HE   LYS   2          1HE       LYS 488   5.905   1.078   1.078
   16   2HE   LYS   2          2HE       LYS 488   7.505   0.321   0.321
   17   1HZ   LYS   2          1HZ       LYS 488   6.832   2.578   2.578
   18   2HZ   LYS   2          2HZ       LYS 488   7.667   2.698   2.698
   19   3HZ   LYS   2          3HZ       LYS 488   8.180   1.942   1.942
   20    H    SER   3           H        SER 489   5.517  -5.248  -5.248
   21    HA   SER   3           HA       SER 489   5.180  -6.587  -6.587
   22   1HB   SER   3          1HB       SER 489   4.226  -8.423  -8.423
   23   2HB   SER   3          2HB       SER 489   5.846  -7.860  -7.860
   24    HG   SER   3           HG       SER 489   4.431  -8.086  -8.086
   25    HA   HYP   4           HA       HYP 490   0.916  -5.805  -5.805
   26   1HB   HYP   4          1HB       HYP 490   1.472  -8.612  -8.612
   27   2HB   HYP   4          2HB       HYP 490   0.624  -7.287  -7.287
   28    HG   HYP   4           HG       HYP 490   3.102  -7.764  -7.764
   29    HD1  HYP   4           HD1      HYP 490   3.701  -5.485  -5.485
   30   1HD2  HYP   4          1HD2      HYP 490   4.400  -6.134  -6.134
   31   2HD2  HYP   4          2HD2      HYP 490   4.220  -7.874  -7.874
   32    H    GLY   5           H        GLY 491  -0.656  -5.917  -5.917
   33   1HA   GLY   5          1HA       GLY 491  -2.256  -7.143  -7.143
   34   2HA   GLY   5          2HA       GLY 491  -0.870  -8.077  -8.077
   35    H    SER   6           H        SER 492   0.847  -5.861  -5.861
   36    HA   SER   6           HA       SER 492   0.233  -5.193  -5.193
   37   1HB   SER   6          1HB       SER 492   2.476  -4.338  -4.338
   38   2HB   SER   6          2HB       SER 492   2.336  -3.810  -3.810
   39    HG   SER   6           HG       SER 492   3.696  -5.744  -5.744
   40    H    SER   7           H        SER 493   0.239  -3.179  -3.179
   41    HA   SER   7           HA       SER 493  -1.433  -1.169  -1.169
   42   1HB   SER   7          1HB       SER 493   0.128  -1.114  -1.114
   43   2HB   SER   7          2HB       SER 493  -1.179  -0.015  -0.015
   44    HG   SER   7           HG       SER 493  -1.974  -1.788  -1.788
   45    H    CYS   8           H        CYS 494  -1.006   0.607   0.607
   46    HA   CYS   8           HA       CYS 494   1.639   1.761   1.761
   47   1HB   CYS   8          1HB       CYS 494   1.112   1.849   1.849
   48   2HB   CYS   8          2HB       CYS 494   1.391   0.219   0.219
   49    H    SER   9           H        SER 495   1.491   3.830   3.830
   50    HA   SER   9           HA       SER 495  -0.905   5.345   5.345
   51   1HB   SER   9          1HB       SER 495   0.641   6.460   6.460
   52   2HB   SER   9          2HB       SER 495   1.962   5.946   5.946
   53    HG   SER   9           HG       SER 495   1.542   8.280   8.280
   54    HA   HYP  10           HA       HYP 496  -1.801   5.943   5.943
   55   1HB   HYP  10          1HB       HYP 496  -3.729   7.758   7.758
   56   2HB   HYP  10          2HB       HYP 496  -3.993   6.887   6.887
   57    HG   HYP  10           HG       HYP 496  -4.867   5.668   5.668
   58    HD1  HYP  10           HD1      HYP 496  -3.955   3.552   3.552
   59   1HD2  HYP  10          1HD2      HYP 496  -2.590   4.534   4.534
   60   2HD2  HYP  10          2HD2      HYP 496  -2.993   6.189   6.189
   61    H    THR  11           H        THR 497  -1.071   8.516   8.516
   62    HA   THR  11           HA       THR 497  -0.460  10.500  10.500
   63    HB   THR  11           HB       THR 497  -1.145  11.155  11.155
   64    HG1  THR  11           HG1      THR 497   0.396  12.968  12.968
   65   1HG2  THR  11          1HG2      THR 497   1.590  10.378  10.378
   66   2HG2  THR  11          2HG2      THR 497   0.419  11.372  11.372
   67   3HG2  THR  11          3HG2      THR 497   0.048   9.678   9.678
   68    H    SER  12           H        SER 498   1.066   7.675   7.675
   69    HA   SER  12           HA       SER 498   3.540   8.640   8.640
   70   1HB   SER  12          1HB       SER 498   4.830   7.005   7.005
   71   2HB   SER  12          2HB       SER 498   4.282   8.537   8.537
   72    HG   SER  12           HG       SER 498   3.850   6.692   6.692
   73    H    TYR  13           H        TYR 499   1.432   5.874   5.874
   74    HA   TYR  13           HA       TYR 499   1.256   3.833   3.833
   75   1HB   TYR  13          1HB       TYR 499   2.401   5.553   5.553
   76   2HB   TYR  13          2HB       TYR 499   1.790   3.908   3.908
   77    HD1  TYR  13           HD2      TYR 499  -0.639   3.475   3.475
   78    HD2  TYR  13           HD1      TYR 499   0.934   7.339   7.339
   79    HE1  TYR  13           HE2      TYR 499  -2.955   4.407   4.407
   80    HE2  TYR  13           HE1      TYR 499  -1.401   8.256   8.256
   81    HH   TYR  13           HH       TYR 499  -4.250   6.101   6.101
   82    H    ASN  14           H        ASN 500   3.056   3.649   3.649
   83    HA   ASN  14           HA       ASN 500   5.665   3.006   3.006
   84   1HB   ASN  14          1HB       ASN 500   6.307   2.949   2.949
   85   2HB   ASN  14          2HB       ASN 500   5.654   4.478   4.478
   86   1HD2  ASN  14          1HD2      ASN 500   5.634   2.570   2.570
   87   2HD2  ASN  14          2HD2      ASN 500   4.171   2.944   2.944
   88    H    CYS  15           H        CYS 501   3.761   1.084   1.084
   89    HA   CYS  15           HA       CYS 501   4.481  -1.355  -1.355
   90   1HB   CYS  15          1HB       CYS 501   2.350  -0.918  -0.918
   91   2HB   CYS  15          2HB       CYS 501   2.640  -2.415  -2.415
   92    H    CYS  16           H        CYS 502   5.131  -3.145  -3.145
   93    HA   CYS  16           HA       CYS 502   6.907  -2.779  -2.779
   94   1HB   CYS  16          1HB       CYS 502   5.443  -5.246  -5.246
   95   2HB   CYS  16          2HB       CYS 502   6.797  -5.178  -5.178
   96    H    ARG  17           H        ARG 503   3.408  -3.406  -3.406
   97    HA   ARG  17           HA       ARG 503   3.567  -2.496  -2.496
   98   1HB   ARG  17          1HB       ARG 503   1.388  -3.953  -3.953
   99   2HB   ARG  17          2HB       ARG 503   1.117  -3.186  -3.186
  100   1HG   ARG  17          1HG       ARG 503   2.658  -4.654  -4.654
  101   2HG   ARG  17          2HG       ARG 503   3.313  -5.231  -5.231
  102   1HD   ARG  17          1HD       ARG 503   1.189  -6.291  -6.291
  103   2HD   ARG  17          2HD       ARG 503   0.441  -5.622  -5.622
  104    HE   ARG  17           HE       ARG 503   2.739  -7.389  -7.389
  105   1HH1  ARG  17          1HH1      ARG 503  -0.646  -6.904  -6.904
  106   2HH1  ARG  17          2HH1      ARG 503  -0.765  -8.242  -8.242
  107   1HH2  ARG  17          1HH2      ARG 503   2.459  -9.246  -9.246
  108   2HH2  ARG  17          2HH2      ARG 503   0.997  -9.574  -9.574
  109    H    SER  18           H        SER 504   0.977  -1.922  -1.922
  110    HA   SER  18           HA       SER 504   1.376   0.922   0.922
  111   1HB   SER  18          1HB       SER 504  -0.813  -0.265  -0.265
  112   2HB   SER  18          2HB       SER 504  -1.085   1.260   1.260
  113    HG   SER  18           HG       SER 504  -0.313   1.620   1.620
  114    H    CYS  19           H        CYS 505  -0.096   1.960   1.960
  115    HA   CYS  19           HA       CYS 505  -1.263   0.244   0.244
  116   1HB   CYS  19          1HB       CYS 505   0.156   2.308   2.308
  117   2HB   CYS  19          2HB       CYS 505  -1.192   3.282   3.282
  118    H    ASN  20           H        ASN 506  -3.391  -0.020  -0.020
  119    HA   ASN  20           HA       ASN 506  -5.314   1.093   1.093
  120   1HB   ASN  20          1HB       ASN 506  -5.498  -1.290  -1.290
  121   2HB   ASN  20          2HB       ASN 506  -5.690  -0.914  -0.914
  122   1HD2  ASN  20          1HD2      ASN 506  -7.706  -1.950  -1.950
  123   2HD2  ASN  20          2HD2      ASN 506  -9.076  -1.319  -1.319
  124    HA   HYP  21           HA       HYP 507  -6.218   4.430   4.430
  125   1HB   HYP  21          1HB       HYP 507  -8.372   4.698   4.698
  126   2HB   HYP  21          2HB       HYP 507  -7.440   5.978   5.978
  127    HG   HYP  21           HG       HYP 507  -6.583   5.241   5.241
  128    HD1  HYP  21           HD1      HYP 507  -4.274   5.186   5.186
  129   1HD2  HYP  21          1HD2      HYP 507  -5.192   3.013   3.013
  130   2HD2  HYP  21          2HD2      HYP 507  -6.947   2.868   2.868
  131    H    TYR  22           H        TYR 508  -8.585   2.122   2.122
  132    HA   TYR  22           HA       TYR 508 -10.600   2.908   2.908
  133   1HB   TYR  22          1HB       TYR 508 -10.512   0.284   0.284
  134   2HB   TYR  22          2HB       TYR 508 -11.928   1.146   1.146
  135    HD1  TYR  22           HD2      TYR 508 -11.227   3.957   3.957
  136    HD2  TYR  22           HD1      TYR 508 -11.231  -0.078  -0.078
  137    HE1  TYR  22           HE2      TYR 508 -11.011   4.875   4.875
  138    HE2  TYR  22           HE1      TYR 508 -11.038   0.825   0.825
  139    HH   TYR  22           HH       TYR 508 -10.803   4.475   4.475
  140    H    THR  23           H        THR 509  -8.035   0.594   0.594
  141    HA   THR  23           HA       THR 509  -9.050  -0.168  -0.168
  142    HB   THR  23           HB       THR 509  -7.903  -2.355  -2.355
  143    HG1  THR  23           HG1      THR 509  -7.165  -3.010  -3.010
  144   1HG2  THR  23          1HG2      THR 509  -9.923  -1.772  -1.772
  145   2HG2  THR  23          2HG2      THR 509  -9.480  -3.378  -3.378
  146   3HG2  THR  23          3HG2      THR 509 -10.312  -2.232  -2.232
  147    H    LYS  24           H        LYS 510  -6.721   1.578   1.578
  148    HA   LYS  24           HA       LYS 510  -4.531   2.142   2.142
  149   1HB   LYS  24          1HB       LYS 510  -5.505   2.049   2.049
  150   2HB   LYS  24          2HB       LYS 510  -3.842   2.504   2.504
  151   1HG   LYS  24          1HG       LYS 510  -4.711   4.114   4.114
  152   2HG   LYS  24          2HG       LYS 510  -6.368   3.677   3.677
  153   1HD   LYS  24          1HD       LYS 510  -6.097   4.639   4.639
  154   2HD   LYS  24          2HD       LYS 510  -4.360   4.878   4.878
  155   1HE   LYS  24          1HE       LYS 510  -5.549   6.997   6.997
  156   2HE   LYS  24          2HE       LYS 510  -4.868   6.474   6.474
  157   1HZ   LYS  24          1HZ       LYS 510  -7.669   6.179   6.179
  158   2HZ   LYS  24          2HZ       LYS 510  -7.157   7.191   7.191
  159   3HZ   LYS  24          3HZ       LYS 510  -7.095   5.739   5.739
  160    H    ARG  25           H        ARG 511  -4.883  -0.508  -0.508
  161    HA   ARG  25           HA       ARG 511  -2.507  -1.835  -1.835
  162   1HB   ARG  25          1HB       ARG 511  -5.231  -2.958  -2.958
  163   2HB   ARG  25          2HB       ARG 511  -3.815  -3.999  -3.999
  164   1HG   ARG  25          1HG       ARG 511  -3.026  -3.606  -3.606
  165   2HG   ARG  25          2HG       ARG 511  -4.062  -2.183  -2.183
  166   1HD   ARG  25          1HD       ARG 511  -5.526  -4.709  -4.709
  167   2HD   ARG  25          2HD       ARG 511  -4.612  -4.655  -4.655
  168    HE   ARG  25           HE       ARG 511  -6.225  -2.334  -2.334
  169   1HH1  ARG  25          1HH2      ARG 511  -6.020  -5.155  -5.155
  170   2HH1  ARG  25          2HH2      ARG 511  -7.225  -4.662  -4.662
  171   1HH2  ARG  25          1HH1      ARG 511  -7.858  -1.720  -1.720
  172   2HH2  ARG  25          2HH1      ARG 511  -8.276  -2.694  -2.694
  173    H    CYS  26           H        CYS 512  -1.331  -3.004  -3.004
  174    HA   CYS  26           HA       CYS 512  -0.981  -1.951  -1.951
  175   1HB   CYS  26          1HB       CYS 512   0.259  -4.365  -4.365
  176   2HB   CYS  26          2HB       CYS 512   0.809  -3.631  -3.631
  177    H    TYR  27           H        TYR 513  -1.826  -2.534  -2.534
  178    HA   TYR  27           HA       TYR 513  -2.994  -4.985  -4.985
  179   1HB   TYR  27          1HB       TYR 513  -1.581  -2.802  -2.802
  180   2HB   TYR  27          2HB       TYR 513  -2.461  -4.153  -4.153
  181    HD1  TYR  27           HD1      TYR 513  -4.899  -4.149  -4.149
  182    HD2  TYR  27           HD2      TYR 513  -2.734  -1.014  -1.014
  183    HE1  TYR  27           HE1      TYR 513  -7.030  -2.870  -2.870
  184    HE2  TYR  27           HE2      TYR 513  -4.878   0.275   0.275
  185    HH   TYR  27           HH       TYR 513  -6.981   0.480   0.480
  186   1H    NH2  28          1H1       TYR 513  -1.973  -6.561  -6.561
  187   2H    NH2  28          2H1       TYR 513  -0.364  -6.894  -6.894

  Start of MODEL   20
    1   1H    CYS   1          1H        CYS 514  10.763  -1.230  -1.230
    2   2H    CYS   1          2H        CYS 514  10.660  -1.702  -1.702
    3   3H    CYS   1          3H        CYS 514  10.560  -2.679  -2.679
    4    HA   CYS   1           HA       CYS 514   8.552  -0.612  -0.612
    5   1HB   CYS   1          1HB       CYS 514   7.262  -1.645  -1.645
    6   2HB   CYS   1          2HB       CYS 514   8.851  -1.132  -1.132
    7    H    LYS   2           H        LYS 515   6.736  -1.077  -1.077
    8    HA   LYS   2           HA       LYS 515   6.698  -3.294  -3.294
    9   1HB   LYS   2          1HB       LYS 515   4.591  -1.210  -1.210
   10   2HB   LYS   2          2HB       LYS 515   4.386  -2.483  -2.483
   11   1HG   LYS   2          1HG       LYS 515   6.489  -1.633  -1.633
   12   2HG   LYS   2          2HG       LYS 515   6.465  -0.268  -0.268
   13   1HD   LYS   2          1HD       LYS 515   4.186   0.311   0.311
   14   2HD   LYS   2          2HD       LYS 515   4.302  -1.001  -1.001
   15   1HE   LYS   2          1HE       LYS 515   4.809   1.092   1.092
   16   2HE   LYS   2          2HE       LYS 515   6.296   0.136   0.136
   17   1HZ   LYS   2          1HZ       LYS 515   5.624   2.329   2.329
   18   2HZ   LYS   2          2HZ       LYS 515   6.655   2.421   2.421
   19   3HZ   LYS   2          3HZ       LYS 515   6.876   1.524   1.524
   20    H    SER   3           H        SER 516   6.039  -5.083  -5.083
   21    HA   SER   3           HA       SER 516   5.544  -6.522  -6.522
   22   1HB   SER   3          1HB       SER 516   4.614  -7.327  -7.327
   23   2HB   SER   3          2HB       SER 516   5.218  -8.384  -8.384
   24    HG   SER   3           HG       SER 516   6.857  -8.025  -8.025
   25    HA   HYP   4           HA       HYP 517   1.182  -6.061  -6.061
   26   1HB   HYP   4          1HB       HYP 517   1.527  -9.027  -9.027
   27   2HB   HYP   4          2HB       HYP 517   0.649  -7.804  -7.804
   28    HG   HYP   4           HG       HYP 517   3.094  -8.417  -8.417
   29    HD1  HYP   4           HD1      HYP 517   3.682  -6.138  -6.138
   30   1HD2  HYP   4          1HD2      HYP 517   4.648  -6.843  -6.843
   31   2HD2  HYP   4          2HD2      HYP 517   4.241  -8.477  -8.477
   32    H    GLY   5           H        GLY 518  -0.593  -6.171  -6.171
   33   1HA   GLY   5          1HA       GLY 518  -2.174  -6.976  -6.976
   34   2HA   GLY   5          2HA       GLY 518  -0.888  -7.961  -7.961
   35    H    SER   6           H        SER 519   1.002  -5.742  -5.742
   36    HA   SER   6           HA       SER 519   0.650  -5.023  -5.023
   37   1HB   SER   6          1HB       SER 519   2.453  -3.603  -3.603
   38   2HB   SER   6          2HB       SER 519   2.570  -3.563  -3.563
   39    HG   SER   6           HG       SER 519   4.161  -5.043  -5.043
   40    H    SER   7           H        SER 520   0.115  -3.284  -3.284
   41    HA   SER   7           HA       SER 520  -1.533  -1.221  -1.221
   42   1HB   SER   7          1HB       SER 520  -1.108  -0.236  -0.236
   43   2HB   SER   7          2HB       SER 520  -1.863  -1.838  -1.838
   44    HG   SER   7           HG       SER 520  -0.120  -1.746  -1.746
   45    H    CYS   8           H        CYS 521  -1.016   0.522   0.522
   46    HA   CYS   8           HA       CYS 521   1.645   1.755   1.755
   47   1HB   CYS   8          1HB       CYS 521   1.319   2.210   2.210
   48   2HB   CYS   8          2HB       CYS 521   0.501   0.646   0.646
   49    H    SER   9           H        SER 522   1.372   4.030   4.030
   50    HA   SER   9           HA       SER 522  -0.880   5.596   5.596
   51   1HB   SER   9          1HB       SER 522   1.054   6.683   6.683
   52   2HB   SER   9          2HB       SER 522   2.028   6.135   6.135
   53    HG   SER   9           HG       SER 522   1.628   8.474   8.474
   54    HA   HYP  10           HA       HYP 523  -2.321   5.227   5.227
   55   1HB   HYP  10          1HB       HYP 523  -3.758   7.696   7.696
   56   2HB   HYP  10          2HB       HYP 523  -4.387   6.467   6.467
   57    HG   HYP  10           HG       HYP 523  -4.954   6.209   6.209
   58    HD1  HYP  10           HD1      HYP 523  -4.751   3.847   3.847
   59   1HD2  HYP  10          1HD2      HYP 523  -2.782   4.765   4.765
   60   2HD2  HYP  10          2HD2      HYP 523  -2.872   6.521   6.521
   61    H    THR  11           H        THR 524  -1.473   8.478   8.478
   62    HA   THR  11           HA       THR 524  -1.023   9.500   9.500
   63    HB   THR  11           HB       THR 524   0.079  11.400  11.400
   64    HG1  THR  11           HG1      THR 524  -0.347  11.456  11.456
   65   1HG2  THR  11          1HG2      THR 524  -2.769  10.619  10.619
   66   2HG2  THR  11          2HG2      THR 524  -2.084  12.249  12.249
   67   3HG2  THR  11          3HG2      THR 524  -2.276  11.465  11.465
   68    H    SER  12           H        SER 525   1.085   7.926   7.926
   69    HA   SER  12           HA       SER 525   3.558   8.633   8.633
   70   1HB   SER  12          1HB       SER 525   3.065   6.682   6.682
   71   2HB   SER  12          2HB       SER 525   4.640   7.284   7.284
   72    HG   SER  12           HG       SER 525   3.862   8.458   8.458
   73    H    TYR  13           H        TYR 526   1.322   6.133   6.133
   74    HA   TYR  13           HA       TYR 526   1.309   4.036   4.036
   75   1HB   TYR  13          1HB       TYR 526   2.754   5.835   5.835
   76   2HB   TYR  13          2HB       TYR 526   2.223   4.190   4.190
   77    HD1  TYR  13           HD2      TYR 526  -0.267   3.627   3.627
   78    HD2  TYR  13           HD1      TYR 526   1.304   7.668   7.668
   79    HE1  TYR  13           HE2      TYR 526  -2.552   4.539   4.539
   80    HE2  TYR  13           HE1      TYR 526  -0.996   8.584   8.584
   81    HH   TYR  13           HH       TYR 526  -3.846   6.333   6.333
   82    H    ASN  14           H        ASN 527   3.048   3.851   3.851
   83    HA   ASN  14           HA       ASN 527   5.690   2.999   2.999
   84   1HB   ASN  14          1HB       ASN 527   5.851   2.636   2.636
   85   2HB   ASN  14          2HB       ASN 527   5.548   4.299   4.299
   86   1HD2  ASN  14          1HD2      ASN 527   4.704   2.166   2.166
   87   2HD2  ASN  14          2HD2      ASN 527   3.204   2.720   2.720
   88    H    CYS  15           H        CYS 528   3.826   1.387   1.387
   89    HA   CYS  15           HA       CYS 528   4.422  -1.257  -1.257
   90   1HB   CYS  15          1HB       CYS 528   1.994  -0.277  -0.277
   91   2HB   CYS  15          2HB       CYS 528   2.281  -1.967  -1.967
   92    H    CYS  16           H        CYS 529   4.838  -2.891  -2.891
   93    HA   CYS  16           HA       CYS 529   6.361  -2.612  -2.612
   94   1HB   CYS  16          1HB       CYS 529   4.938  -5.073  -5.073
   95   2HB   CYS  16          2HB       CYS 529   6.311  -4.955  -4.955
   96    H    ARG  17           H        ARG 530   3.087  -4.063  -4.063
   97    HA   ARG  17           HA       ARG 530   2.761  -3.486  -3.486
   98   1HB   ARG  17          1HB       ARG 530   1.214  -5.212  -5.212
   99   2HB   ARG  17          2HB       ARG 530   0.696  -4.860  -4.860
  100   1HG   ARG  17          1HG       ARG 530   2.625  -5.979  -5.979
  101   2HG   ARG  17          2HG       ARG 530   3.343  -6.161  -6.161
  102   1HD   ARG  17          1HD       ARG 530   2.293  -8.261  -8.261
  103   2HD   ARG  17          2HD       ARG 530   1.494  -7.623  -7.623
  104    HE   ARG  17           HE       ARG 530   0.208  -6.750  -6.750
  105   1HH1  ARG  17          1HH2      ARG 530   0.404  -9.635  -9.635
  106   2HH1  ARG  17          2HH2      ARG 530  -1.120 -10.121 -10.121
  107   1HH2  ARG  17          1HH1      ARG 530  -1.819  -7.516  -7.516
  108   2HH2  ARG  17          2HH1      ARG 530  -2.394  -8.908  -8.908
  109    H    SER  18           H        SER 531   2.663  -1.323  -1.323
  110    HA   SER  18           HA       SER 531   1.609   0.601   0.601
  111   1HB   SER  18          1HB       SER 531   1.033   0.612   0.612
  112   2HB   SER  18          2HB       SER 531  -0.482  -0.212  -0.212
  113    HG   SER  18           HG       SER 531  -0.785   2.138   2.138
  114    H    CYS  19           H        CYS 532  -0.277   1.566   1.566
  115    HA   CYS  19           HA       CYS 532  -1.479  -0.333  -0.333
  116   1HB   CYS  19          1HB       CYS 532   0.138   1.449   1.449
  117   2HB   CYS  19          2HB       CYS 532  -1.163   2.609   2.609
  118    H    ASN  20           H        ASN 533  -3.543  -0.340  -0.340
  119    HA   ASN  20           HA       ASN 533  -5.542   0.868   0.868
  120   1HB   ASN  20          1HB       ASN 533  -5.777  -1.407  -1.407
  121   2HB   ASN  20          2HB       ASN 533  -5.812  -0.849  -0.849
  122   1HD2  ASN  20          1HD2      ASN 533  -7.901  -2.261  -2.261
  123   2HD2  ASN  20          2HD2      ASN 533  -9.263  -1.349  -1.349
  124    HA   HYP  21           HA       HYP 534  -5.523   4.624   4.624
  125   1HB   HYP  21          1HB       HYP 534  -7.899   5.214   5.214
  126   2HB   HYP  21          2HB       HYP 534  -6.473   6.216   6.216
  127    HG   HYP  21           HG       HYP 534  -6.711   4.986   4.986
  128    HD1  HYP  21           HD1      HYP 534  -4.369   4.667   4.667
  129   1HD2  HYP  21          1HD2      HYP 534  -5.378   2.650   2.650
  130   2HD2  HYP  21          2HD2      HYP 534  -7.140   2.732   2.732
  131    H    TYR  22           H        TYR 535  -8.450   2.775   2.775
  132    HA   TYR  22           HA       TYR 535 -10.082   3.891   3.891
  133   1HB   TYR  22          1HB       TYR 535 -10.161   1.223   1.223
  134   2HB   TYR  22          2HB       TYR 535 -11.394   1.730   1.730
  135    HD1  TYR  22           HD1      TYR 535 -12.736   3.863   3.863
  136    HD2  TYR  22           HD2      TYR 535 -10.289   1.819   1.819
  137    HE1  TYR  22           HE1      TYR 535 -13.762   5.260   5.260
  138    HE2  TYR  22           HE2      TYR 535 -11.346   3.196   3.196
  139    HH   TYR  22           HH       TYR 535 -12.443   4.996   4.996
  140    H    THR  23           H        THR 536  -7.968   1.101   1.101
  141    HA   THR  23           HA       THR 536  -8.953   0.192   0.192
  142    HB   THR  23           HB       THR 536  -7.912  -1.965  -1.965
  143    HG1  THR  23           HG1      THR 536  -6.914  -2.278  -2.278
  144   1HG2  THR  23          1HG2      THR 536  -9.638  -1.004  -1.004
  145   2HG2  THR  23          2HG2      THR 536  -9.261  -2.688  -2.688
  146   3HG2  THR  23          3HG2      THR 536 -10.173  -1.687  -1.687
  147    H    LYS  24           H        LYS 537  -6.306   1.773   1.773
  148    HA   LYS  24           HA       LYS 537  -4.144   2.249   2.249
  149   1HB   LYS  24          1HB       LYS 537  -4.948   1.214   1.214
  150   2HB   LYS  24          2HB       LYS 537  -3.421   2.034   2.034
  151   1HG   LYS  24          1HG       LYS 537  -4.700   4.033   4.033
  152   2HG   LYS  24          2HG       LYS 537  -6.202   3.210   3.210
  153   1HD   LYS  24          1HD       LYS 537  -4.007   3.522   3.522
  154   2HD   LYS  24          2HD       LYS 537  -5.062   4.898   4.898
  155   1HE   LYS  24          1HE       LYS 537  -7.038   3.455   3.455
  156   2HE   LYS  24          2HE       LYS 537  -5.921   2.171   2.171
  157   1HZ   LYS  24          1HZ       LYS 537  -6.019   4.816   4.816
  158   2HZ   LYS  24          2HZ       LYS 537  -6.545   3.576   3.576
  159   3HZ   LYS  24          3HZ       LYS 537  -5.079   3.735   3.735
  160    H    ARG  25           H        ARG 538  -4.835  -0.480  -0.480
  161    HA   ARG  25           HA       ARG 538  -2.569  -1.994  -1.994
  162   1HB   ARG  25          1HB       ARG 538  -5.136  -3.078  -3.078
  163   2HB   ARG  25          2HB       ARG 538  -3.736  -4.054  -4.054
  164   1HG   ARG  25          1HG       ARG 538  -3.931  -3.373  -3.373
  165   2HG   ARG  25          2HG       ARG 538  -5.125  -2.128  -2.128
  166   1HD   ARG  25          1HD       ARG 538  -6.653  -4.014  -4.014
  167   2HD   ARG  25          2HD       ARG 538  -5.499  -5.139  -5.139
  168    HE   ARG  25           HE       ARG 538  -6.893  -2.989  -2.989
  169   1HH1  ARG  25          1HH2      ARG 538  -5.054  -5.915  -5.915
  170   2HH1  ARG  25          2HH2      ARG 538  -5.571  -6.208  -6.208
  171   1HH2  ARG  25          1HH1      ARG 538  -7.316  -3.319  -3.319
  172   2HH2  ARG  25          2HH1      ARG 538  -6.857  -4.717  -4.717
  173    H    CYS  26           H        CYS 539  -1.091  -2.743  -2.743
  174    HA   CYS  26           HA       CYS 539  -0.653  -2.091  -2.091
  175   1HB   CYS  26          1HB       CYS 539   0.479  -4.474  -4.474
  176   2HB   CYS  26          2HB       CYS 539   1.167  -3.659  -3.659
  177    H    TYR  27           H        TYR 540  -1.150  -3.094  -3.094
  178    HA   TYR  27           HA       TYR 540  -3.025  -5.263  -5.263
  179   1HB   TYR  27          1HB       TYR 540  -1.433  -3.672  -3.672
  180   2HB   TYR  27          2HB       TYR 540  -2.685  -4.858  -4.858
  181    HD1  TYR  27           HD2      TYR 540  -4.944  -4.289  -4.289
  182    HD2  TYR  27           HD1      TYR 540  -2.111  -1.544  -1.544
  183    HE1  TYR  27           HE2      TYR 540  -6.802  -2.676  -2.676
  184    HE2  TYR  27           HE1      TYR 540  -3.967   0.079   0.079
  185    HH   TYR  27           HH       TYR 540  -7.406  -0.699  -0.699
  186   1H    NH2  28          1H1       TYR 540  -2.585  -7.195  -7.195
  187   2H    NH2  28          2H1       TYR 540  -1.093  -7.889  -7.889

  Start of MODEL   21
    1   1H    CYS   1          1H        CYS 541  11.279  -1.513  -1.513
    2   2H    CYS   1          2H        CYS 541  11.267  -2.088  -2.088
    3   3H    CYS   1          3H        CYS 541  11.096  -2.981  -2.981
    4    HA   CYS   1           HA       CYS 541   9.132  -0.968  -0.968
    5   1HB   CYS   1          1HB       CYS 541   7.680  -1.933  -1.933
    6   2HB   CYS   1          2HB       CYS 541   9.171  -1.260  -1.260
    7    H    LYS   2           H        LYS 542   7.440  -1.503  -1.503
    8    HA   LYS   2           HA       LYS 542   7.544  -3.794  -3.794
    9   1HB   LYS   2          1HB       LYS 542   5.361  -1.794  -1.794
   10   2HB   LYS   2          2HB       LYS 542   5.157  -3.173  -3.173
   11   1HG   LYS   2          1HG       LYS 542   6.890  -2.324  -2.324
   12   2HG   LYS   2          2HG       LYS 542   7.265  -1.016  -1.016
   13   1HD   LYS   2          1HD       LYS 542   4.914  -0.221  -0.221
   14   2HD   LYS   2          2HD       LYS 542   4.606  -1.487  -1.487
   15   1HE   LYS   2          1HE       LYS 542   5.787  -0.397  -0.397
   16   2HE   LYS   2          2HE       LYS 542   6.874   0.399   0.399
   17   1HZ   LYS   2          1HZ       LYS 542   4.061   1.118   1.118
   18   2HZ   LYS   2          2HZ       LYS 542   5.198   1.945   1.945
   19   3HZ   LYS   2          3HZ       LYS 542   4.976   1.788   1.788
   20    H    SER   3           H        SER 543   6.495  -5.655  -5.655
   21    HA   SER   3           HA       SER 543   5.486  -6.864  -6.864
   22   1HB   SER   3          1HB       SER 543   4.487  -8.522  -8.522
   23   2HB   SER   3          2HB       SER 543   6.239  -8.271  -8.271
   24    HG   SER   3           HG       SER 543   5.229  -8.253  -8.253
   25    HA   HYP   4           HA       HYP 544   1.215  -5.416  -5.416
   26   1HB   HYP   4          1HB       HYP 544   1.304  -8.299  -8.299
   27   2HB   HYP   4          2HB       HYP 544   0.346  -6.947  -6.947
   28    HG   HYP   4           HG       HYP 544   2.532  -7.409  -7.409
   29    HD1  HYP   4           HD1      HYP 544   3.207  -5.138  -5.138
   30   1HD2  HYP   4          1HD2      HYP 544   4.413  -6.147  -6.147
   31   2HD2  HYP   4          2HD2      HYP 544   4.060  -7.862  -7.862
   32    H    GLY   5           H        GLY 545  -0.539  -5.683  -5.683
   33   1HA   GLY   5          1HA       GLY 545  -1.962  -6.753  -6.753
   34   2HA   GLY   5          2HA       GLY 545  -0.527  -7.610  -7.610
   35    H    SER   6           H        SER 546   1.157  -5.292  -5.292
   36    HA   SER   6           HA       SER 546   0.941  -4.496  -4.496
   37   1HB   SER   6          1HB       SER 546   2.592  -3.271  -3.271
   38   2HB   SER   6          2HB       SER 546   2.794  -2.918  -2.918
   39    HG   SER   6           HG       SER 546   4.341  -4.570  -4.570
   40    H    SER   7           H        SER 547   0.452  -2.785  -2.785
   41    HA   SER   7           HA       SER 547  -1.554  -0.990  -0.990
   42   1HB   SER   7          1HB       SER 547   0.285  -0.881  -0.881
   43   2HB   SER   7          2HB       SER 547  -1.190   0.077   0.077
   44    HG   SER   7           HG       SER 547  -1.579  -1.856  -1.856
   45    H    CYS   8           H        CYS 548  -1.469   0.849   0.849
   46    HA   CYS   8           HA       CYS 548   0.857   2.563   2.563
   47   1HB   CYS   8          1HB       CYS 548   0.626   2.545   2.545
   48   2HB   CYS   8          2HB       CYS 548   1.128   0.975   0.975
   49    H    SER   9           H        SER 549   0.437   4.587   4.587
   50    HA   SER   9           HA       SER 549  -2.200   5.694   5.694
   51   1HB   SER   9          1HB       SER 549   0.497   6.971   6.971
   52   2HB   SER   9          2HB       SER 549  -1.010   7.872   7.872
   53    HG   SER   9           HG       SER 549   0.254   7.702   7.702
   54    HA   HYP  10           HA       HYP 550  -3.325   6.338   6.338
   55   1HB   HYP  10          1HB       HYP 550  -3.755   9.193   9.193
   56   2HB   HYP  10          2HB       HYP 550  -4.783   8.255   8.255
   57    HG   HYP  10           HG       HYP 550  -5.508   8.407   8.407
   58    HD1  HYP  10           HD1      HYP 550  -6.254   6.156   6.156
   59   1HD2  HYP  10          1HD2      HYP 550  -4.155   6.161   6.161
   60   2HD2  HYP  10          2HD2      HYP 550  -3.485   7.785   7.785
   61    H    THR  11           H        THR 551  -1.415   8.880   8.880
   62    HA   THR  11           HA       THR 551  -0.129   9.912   9.912
   63    HB   THR  11           HB       THR 551   1.548  10.732  10.732
   64    HG1  THR  11           HG1      THR 551   0.767  10.563  10.563
   65   1HG2  THR  11          1HG2      THR 551  -1.396  11.421  11.421
   66   2HG2  THR  11          2HG2      THR 551  -0.033  12.395  12.395
   67   3HG2  THR  11          3HG2      THR 551  -0.286  12.163  12.163
   68    H    SER  12           H        SER 552   0.550   7.021   7.021
   69    HA   SER  12           HA       SER 552   3.428   7.136   7.136
   70   1HB   SER  12          1HB       SER 552   2.182   5.873   5.873
   71   2HB   SER  12          2HB       SER 552   3.900   6.172   6.172
   72    HG   SER  12           HG       SER 552   2.981   7.783   7.783
   73    H    TYR  13           H        TYR 553   2.614   6.046   6.046
   74    HA   TYR  13           HA       TYR 553   1.556   3.400   3.400
   75   1HB   TYR  13          1HB       TYR 553   2.784   5.022   5.022
   76   2HB   TYR  13          2HB       TYR 553   1.868   3.516   3.516
   77    HD1  TYR  13           HD2      TYR 553  -0.628   3.518   3.518
   78    HD2  TYR  13           HD1      TYR 553   1.751   7.102   7.102
   79    HE1  TYR  13           HE2      TYR 553  -2.712   4.813   4.813
   80    HE2  TYR  13           HE1      TYR 553  -0.331   8.386   8.386
   81    HH   TYR  13           HH       TYR 553  -3.624   6.736   6.736
   82    H    ASN  14           H        ASN 554   3.966   3.460   3.460
   83    HA   ASN  14           HA       ASN 554   6.264   2.666   2.666
   84   1HB   ASN  14          1HB       ASN 554   7.446   2.611   2.611
   85   2HB   ASN  14          2HB       ASN 554   6.714   4.157   4.157
   86   1HD2  ASN  14          1HD2      ASN 554   5.964   1.304   1.304
   87   2HD2  ASN  14          2HD2      ASN 554   5.274   2.128   2.128
   88    H    CYS  15           H        CYS 555   4.406   0.851   0.851
   89    HA   CYS  15           HA       CYS 555   5.363  -1.667  -1.667
   90   1HB   CYS  15          1HB       CYS 555   2.592  -0.746  -0.746
   91   2HB   CYS  15          2HB       CYS 555   2.999  -2.461  -2.461
   92    H    CYS  16           H        CYS 556   5.475  -3.374  -3.374
   93    HA   CYS  16           HA       CYS 556   6.682  -3.030  -3.030
   94   1HB   CYS  16          1HB       CYS 556   5.458  -5.520  -5.520
   95   2HB   CYS  16          2HB       CYS 556   6.660  -5.403  -5.403
   96    H    ARG  17           H        ARG 557   3.270  -3.880  -3.880
   97    HA   ARG  17           HA       ARG 557   2.626  -2.950  -2.950
   98   1HB   ARG  17          1HB       ARG 557   1.126  -4.981  -4.981
   99   2HB   ARG  17          2HB       ARG 557   0.589  -4.367  -4.367
  100   1HG   ARG  17          1HG       ARG 557   3.116  -5.961  -5.961
  101   2HG   ARG  17          2HG       ARG 557   1.610  -6.597  -6.597
  102   1HD   ARG  17          1HD       ARG 557   1.836  -5.120  -5.120
  103   2HD   ARG  17          2HD       ARG 557   3.298  -4.397  -4.397
  104    HE   ARG  17           HE       ARG 557   3.045  -7.182  -7.182
  105   1HH1  ARG  17          1HH2      ARG 557   5.265  -4.701  -4.701
  106   2HH1  ARG  17          2HH2      ARG 557   6.568  -5.485  -5.485
  107   1HH2  ARG  17          1HH1      ARG 557   4.892  -8.203  -8.203
  108   2HH2  ARG  17          2HH1      ARG 557   6.361  -7.471  -7.471
  109    H    SER  18           H        SER 558   2.877  -1.173  -1.173
  110    HA   SER  18           HA       SER 558   2.007   0.832   0.832
  111   1HB   SER  18          1HB       SER 558   1.412   0.913   0.913
  112   2HB   SER  18          2HB       SER 558  -0.165   0.217   0.217
  113    HG   SER  18           HG       SER 558  -0.274   2.578   2.578
  114    H    CYS  19           H        CYS 559   0.187   1.953   1.953
  115    HA   CYS  19           HA       CYS 559  -1.212   0.271   0.271
  116   1HB   CYS  19          1HB       CYS 559   0.071   2.390   2.390
  117   2HB   CYS  19          2HB       CYS 559  -1.208   3.299   3.299
  118    H    ASN  20           H        ASN 560  -3.371   0.211   0.211
  119    HA   ASN  20           HA       ASN 560  -5.117   1.557   1.557
  120   1HB   ASN  20          1HB       ASN 560  -5.399  -0.925  -0.925
  121   2HB   ASN  20          2HB       ASN 560  -5.841  -0.635  -0.635
  122   1HD2  ASN  20          1HD2      ASN 560  -7.536  -1.806  -1.806
  123   2HD2  ASN  20          2HD2      ASN 560  -8.857  -0.841  -0.841
  124    HA   HYP  21           HA       HYP 561  -5.648   4.667   4.667
  125   1HB   HYP  21          1HB       HYP 561  -7.820   5.357   5.357
  126   2HB   HYP  21          2HB       HYP 561  -6.671   6.430   6.430
  127    HG   HYP  21           HG       HYP 561  -6.321   5.702   5.702
  128    HD1  HYP  21           HD1      HYP 561  -4.040   6.039   6.039
  129   1HD2  HYP  21          1HD2      HYP 561  -4.450   3.732   3.732
  130   2HD2  HYP  21          2HD2      HYP 561  -6.108   3.389   3.389
  131    H    TYR  22           H        TYR 562  -8.315   2.886   2.886
  132    HA   TYR  22           HA       TYR 562 -10.263   3.508   3.508
  133   1HB   TYR  22          1HB       TYR 562 -10.157   1.212   1.212
  134   2HB   TYR  22          2HB       TYR 562 -11.594   1.759   1.759
  135    HD1  TYR  22           HD1      TYR 562 -12.342   4.270   4.270
  136    HD2  TYR  22           HD2      TYR 562  -9.685   2.049   2.049
  137    HE1  TYR  22           HE1      TYR 562 -12.536   6.069   6.069
  138    HE2  TYR  22           HE2      TYR 562  -9.847   3.874   3.874
  139    HH   TYR  22           HH       TYR 562 -10.489   5.907   5.907
  140    H    THR  23           H        THR 563  -8.648   0.412   0.412
  141    HA   THR  23           HA       THR 563  -9.450  -0.777  -0.777
  142    HB   THR  23           HB       THR 563  -7.768  -2.522  -2.522
  143    HG1  THR  23           HG1      THR 563  -6.462  -2.311  -2.311
  144   1HG2  THR  23          1HG2      THR 563  -9.386  -1.750  -1.750
  145   2HG2  THR  23          2HG2      THR 563  -8.632  -3.325  -3.325
  146   3HG2  THR  23          3HG2      THR 563  -9.916  -2.735  -2.735
  147    H    LYS  24           H        LYS 564  -6.973   1.432   1.432
  148    HA   LYS  24           HA       LYS 564  -5.109   2.253   2.253
  149   1HB   LYS  24          1HB       LYS 564  -6.382   1.061   1.061
  150   2HB   LYS  24          2HB       LYS 564  -4.942   2.094   2.094
  151   1HG   LYS  24          1HG       LYS 564  -7.519   2.985   2.985
  152   2HG   LYS  24          2HG       LYS 564  -7.223   3.195   3.195
  153   1HD   LYS  24          1HD       LYS 564  -5.151   4.471   4.471
  154   2HD   LYS  24          2HD       LYS 564  -5.593   4.353   4.353
  155   1HE   LYS  24          1HE       LYS 564  -7.565   5.475   5.475
  156   2HE   LYS  24          2HE       LYS 564  -6.233   6.490   6.490
  157   1HZ   LYS  24          1HZ       LYS 564  -8.189   5.210   5.210
  158   2HZ   LYS  24          2HZ       LYS 564  -8.172   6.668   6.668
  159   3HZ   LYS  24          3HZ       LYS 564  -7.068   6.064   6.064
  160    H    ARG  25           H        ARG 565  -5.165  -0.508  -0.508
  161    HA   ARG  25           HA       ARG 565  -2.759  -1.698  -1.698
  162   1HB   ARG  25          1HB       ARG 565  -5.249  -3.092  -3.092
  163   2HB   ARG  25          2HB       ARG 565  -3.696  -3.916  -3.916
  164   1HG   ARG  25          1HG       ARG 565  -3.681  -3.234  -3.234
  165   2HG   ARG  25          2HG       ARG 565  -5.245  -2.434  -2.434
  166   1HD   ARG  25          1HD       ARG 565  -5.648  -4.582  -4.582
  167   2HD   ARG  25          2HD       ARG 565  -6.202  -4.654  -4.654
  168    HE   ARG  25           HE       ARG 565  -3.532  -5.539  -5.539
  169   1HH1  ARG  25          1HH2      ARG 565  -6.671  -6.822  -6.822
  170   2HH1  ARG  25          2HH2      ARG 565  -6.191  -8.378  -8.378
  171   1HH2  ARG  25          1HH1      ARG 565  -2.976  -7.701  -7.701
  172   2HH2  ARG  25          2HH1      ARG 565  -4.112  -8.873  -8.873
  173    H    CYS  26           H        CYS 566  -1.504  -2.930  -2.930
  174    HA   CYS  26           HA       CYS 566  -1.245  -1.748  -1.748
  175   1HB   CYS  26          1HB       CYS 566   0.450  -3.722  -3.722
  176   2HB   CYS  26          2HB       CYS 566   0.821  -3.074  -3.074
  177    H    TYR  27           H        TYR 567  -1.379  -2.736  -2.736
  178    HA   TYR  27           HA       TYR 567  -3.411  -4.650  -4.650
  179   1HB   TYR  27          1HB       TYR 567  -1.523  -3.338  -3.338
  180   2HB   TYR  27          2HB       TYR 567  -2.722  -4.541  -4.541
  181    HD1  TYR  27           HD1      TYR 567  -5.165  -4.118  -4.118
  182    HD2  TYR  27           HD2      TYR 567  -2.103  -1.058  -1.058
  183    HE1  TYR  27           HE1      TYR 567  -6.863  -2.372  -2.372
  184    HE2  TYR  27           HE2      TYR 567  -3.800   0.689   0.689
  185    HH   TYR  27           HH       TYR 567  -5.845   1.155   1.155
  186   1H    NH2  28          1H1       TYR 567  -3.321  -6.801  -6.801
  187   2H    NH2  28          2H1       TYR 567  -1.970  -7.715  -7.715