*HEADER    PLANT PROTEIN                           21-DEC-08   2KCH              
*TITLE     SOLUTION STRUCTURE OF MICELLE-BOUND KALATA B2                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: KALATA-B2;                                                 
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: OLDENLANDIA AFFINIS;                            
*SOURCE   3 ORGANISM_TAXID: 60225                                                
*KEYWDS    CYCLIC CYSTINE KNOT, CYTOLYSIS, HEMOLYSIS, KNOTTIN,                   
*KEYWDS   2 OXIDATION, PLANT DEFENSE, PLANT PROTEIN                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.K.WANG                                                              
*REVDAT   1   21-JUL-09 2KCH    0                                                


!#  1 CYSS HA      2 GLY  HN      3.48            #peak     1
!#  1 CYSS HN      1 CYSS HB1     3.36            #peak     2
!#  1 CYSS HB1     2 GLY  HN      4.45            #peak     3
!#  1 CYSS HB1     3 GLU  HN      3.67            #peak     4
!#  1 CYSS HN      1 CYSS HB2     3.36            #peak     6
!#  1 CYSS HB2     2 GLY  HN      4.45            #peak     8
!#  1 CYSS HB2     3 GLU  HN      3.67            #peak     9
!#  1 CYSS HN      2 GLY  HN      2.93            #peak    10
!#  1 CYSS HN     29 VAL  HN      3.21            #peak    11
!#  2 GLY  HA1     3 GLU  HN      3.52            #peak    13
!#  2 GLY  HA2     3 GLU  HN      3.52            #peak    16
!#  3 GLU  HA      4 THR  HN      2.52            #peak    18
!#  3 GLU  HN      3 GLU  HB1     3.95            #peak    19
!#  3 GLU  HB1     4 THR  HN      3.64            #peak    20
!#  3 GLU  HN      3 GLU  HB2     3.95            #peak    22
!#  3 GLU  HB2     4 THR  HN      3.64            #peak    23
!#  2 GLY  HN      3 GLU  HN      3.14            #peak    30
!#  4 THR  HA     22 CYSS HN      3.11            #peak    32
!#  5 CYSS HA      6 PHE  HN      3.02            #peak    37
!#  5 CYSS HA      7 GLY  HN      3.67            #peak    38
!#  5 CYSS HA      8 GLY  HN      3.98            #peak    39
!#  5 CYSS HB1     6 PHE  HN      4.82            #peak    42
!#  5 CYSS HB1     8 GLY  HN      4.04            #peak    43
!#  5 CYSS HB2     6 PHE  HN      4.82            #peak    47
!#  5 CYSS HB2     8 GLY  HN      4.04            #peak    48
!#  5 CYSS HN      6 PHE  HN      3.52            #peak    50
!#  6 PHE  HA      8 GLY  HN      4.54            #peak    53
!#  6 PHE  HN      6 PHE  QB      4.02            #peak    57
!#  6 PHE  QB      7 GLY  HN      4.46            #peak    58
!#  6 PHE  HN      7 GLY  HN      3.36            #peak    65
!#  7 GLY  HN      8 GLY  HN      3.27            #peak    73
!#  9 THR  HN      9 THR  HA      2.93            #peak    75
!#  9 THR  HN      9 THR  HB      3.24            #peak    76
!#  9 THR  HB     10 CYSS HN      3.27            #peak    77
!#  8 GLY  HN      9 THR  HN      3.30            #peak    78
!# 10 CYSS HA     11 ASN  HN      3.05            #peak    81
!# 10 CYSS HA     12 THR  HN      4.11            #peak    82
!# 10 CYSS HN     10 CYSS HB1     3.45            #peak    83
!# 10 CYSS HB1    11 ASN  HN      4.07            #peak    84
!# 10 CYSS HB1    12 THR  HN      4.01            #peak    85
!# 10 CYSS HN     10 CYSS HB2     3.45            #peak    87
!# 10 CYSS HB2    11 ASN  HN      4.07            #peak    88
!# 10 CYSS HB2    12 THR  HN      4.01            #peak    89
!# 11 ASN  HN     11 ASN  QB      4.15            #peak    94
!# 11 ASN  QB     12 THR  HN      4.86            #peak    95
!# 11 ASN  HN     12 THR  HN      3.05            #peak    97
!# 13 PRO  HA     14 GLY  HN      2.56            #peak   102
!# 13 PRO  HA     15 CYSS HN      3.42            #peak   103
!# 14 GLY  HN     14 GLY  HA1     2.56            #peak   110
!# 14 GLY  HN     14 GLY  HA2     2.56            #peak   112
!# 15 CYSS HA     16 SER  HN      2.52            #peak   115
!# 15 CYSS HA     23 THR  HN      4.11            #peak   116
!# 15 CYSS HN     15 CYSS HB1     3.11            #peak   118
!# 15 CYSS HN     15 CYSS HB2     3.11            #peak   122
!# 14 GLY  HN     15 CYSS HN      3.11            #peak   126
!# 15 CYSS HN     16 SER  HN      4.23            #peak   127
!# 16 SER  HN     16 SER  HB1     3.36            #peak   129
!# 16 SER  HN     16 SER  HB2     3.36            #peak   130
!# 16 SER  HN     23 THR  HN      3.14            #peak   131
!# 17 CYSS HA     18 THR  HN      2.68            #peak   132
!# 17 CYSS HA     23 THR  HN      3.67            #peak   133
!# 17 CYSS HN     17 CYSS HB1     3.08            #peak   134
!# 17 CYSS HN     17 CYSS HB2     3.08            #peak   136
!# 19 TRP  HA     21 ILE  HN      3.14            #peak   144
!# 19 TRP  HN     19 TRP  QB      3.78            #peak   149
!# 19 TRP  HA     20 PRO  HA      2.83            #peak   150
!# 20 PRO  HA     21 ILE  HN      3.27            #peak   153
!#  5 CYSS HN     21 ILE  HA      3.24            #peak   184
!# 21 ILE  HA     22 CYSS HN      2.62            #peak   186
!# 21 ILE  HB     22 CYSS HN      3.83            #peak   187
!# 16 SER  HN     22 CYSS HA      3.76            #peak   198
!# 22 CYSS HB1    23 THR  HN      3.92            #peak   201
!# 22 CYSS HB2    23 THR  HN      3.92            #peak   203
!#  5 CYSS HN     22 CYSS HN      3.48            #peak   204
!# 21 ILE  HN     22 CYSS HN      4.17            #peak   205
!# 22 CYSS HN     23 THR  HN      4.20            #peak   206
!# 23 THR  HN     23 THR  HB      3.76            #peak   207
!# 23 THR  HB     26 GLY  HN      3.27            #peak   208
!# 23 THR  HB     27 LEU  HN      3.27            #peak   209
!# 15 CYSS HA     24 ARG  HA      4.07            #peak   215
!# 16 SER  HN     24 ARG  HA      4.32            #peak   216
!# 24 ARG  HA     26 GLY  HN      4.20            #peak   218
!# 24 ARG  HN     24 ARG  HB1     2.99            #peak   220
!# 24 ARG  HB1    25 ASP  HN      3.33            #peak   222
!# 24 ARG  HN     24 ARG  HB2     2.99            #peak   224
!# 24 ARG  HB2    25 ASP  HN      3.33            #peak   226
!# 23 THR  HN     24 ARG  HN      3.67            #peak   227
!# 24 ARG  HN     25 ASP  HN      3.86            #peak   228
!# 25 ASP  HA     26 GLY  HN      3.11            #peak   234
!# 25 ASP  HN     25 ASP  HB1     3.67            #peak   235
!# 25 ASP  HN     25 ASP  HB2     3.67            #peak   237
!# 25 ASP  HN     26 GLY  HN      3.17            #peak   244
!# 27 LEU  HN     27 LEU  HB1     3.05            #peak   247
!# 27 LEU  HN     27 LEU  HB2     3.05            #peak   248
!# 24 ARG  HN     27 LEU  HN      3.27            #peak   250
!# 25 ASP  HN     27 LEU  HN      4.35            #peak   251
!# 26 GLY  HN     27 LEU  HN      3.21            #peak   252
!#  1 CYSS HN     28 PRO  HA      3.48            #peak   256
!# 28 PRO  HA     29 VAL  HN      2.65            #peak   257
!#  1 CYSS HN     29 VAL  HA      3.30            #peak   258
!# 29 VAL  HN     29 VAL  HA      2.83            #peak   259
!# 29 VAL  HN     29 VAL  HB      3.08            #peak   260
!#  3 GLU  HN      3 GLU  HG1     3.58            #peak    25
!#  3 GLU  HN      3 GLU  HG2     3.58            #peak    28
!#  6 PHE  HA     19 TRP  HE1     3.11            #peak    54
!#  6 PHE  QB     19 TRP  HE1     6.38            #peak    59
!#  8 GLY  HA1    19 TRP  HD1     4.32            #peak    69
!#  8 GLY  HA2    19 TRP  HD1     4.32            #peak    72
!#  8 GLY  HN     19 TRP  HE1     5.25            #peak    74
!# 19 TRP  HA     19 TRP  HD1     3.52            #peak   142
!#  8 GLY  HN     19 TRP  HD1     4.45            #peak   145
!# 19 TRP  HD1    20 PRO  HA      4.11            #peak   151
!# 19 TRP  HE1    20 PRO  HA      5.50            #peak   152
!# 19 TRP  HE3    20 PRO  HB1     4.38            #peak   156
!# 19 TRP  HZ3    20 PRO  HB1     5.16            #peak   158
!# 19 TRP  HE3    20 PRO  HB2     4.38            #peak   163
!# 19 TRP  HZ3    20 PRO  HB2     5.16            #peak   166
!# 24 ARG  HB1    24 ARG  HE      3.95            #peak   219
!# 24 ARG  HB1    24 ARG  QD      3.99            #peak   221
!# 24 ARG  HB2    24 ARG  HE      3.95            #peak   223
!# 24 ARG  HB2    24 ARG  QD      3.99            #peak   225
!# 24 ARG  HN     24 ARG  QD      6.38            #peak   230
!# 24 ARG  QG     25 ASP  HN      6.26            #peak   233
!# 27 LEU  HN     27 LEU  HG      3.70            #peak   249
!#  4 THR  HN      4 THR  QG2     4.60            #peak    33
!#  4 THR  QG2     5 CYSS HN      4.94            #peak    34
!#  4 THR  QG2    22 CYSS HN      6.39            #peak    35
!#  9 THR  HN      9 THR  QG2     5.15            #peak    79
!#  9 THR  QG2    10 CYSS HN      4.72            #peak    80
!# 12 THR  HN     12 THR  QG2     5.68            #peak    99
!# 12 THR  QG2    13 PRO  QD      5.45            #peak   100
!# 12 THR  QG2    15 CYSS HN      5.81            #peak   101
!# 18 THR  HN     18 THR  QG2     5.37            #peak   140
!# 18 THR  QG2    19 TRP  HN      5.56            #peak   141
!# 21 ILE  HN     21 ILE  QD1     4.69            #peak   193
!# 21 ILE  QD1    22 CYSS HN      4.85            #peak   194
!# 19 TRP  HZ3    21 ILE  QG2     6.52            #peak   195
!# 21 ILE  QG2    22 CYSS HN      6.30            #peak   197
!# 23 THR  HN     23 THR  QG2     4.91            #peak   211
!# 23 THR  QG2    24 ARG  HN      4.16            #peak   212
!# 23 THR  QG2    26 GLY  HN      6.24            #peak   213
!# 23 THR  QG2    27 LEU  HN      4.75            #peak   214
!# 27 LEU  HN     27 LEU  QD1     5.87            #peak   254
!# 27 LEU  HN     27 LEU  QD2     5.87            #peak   255
!#  1 CYSS HN     29 VAL  QQG     6.76            #peak   261
!# 24 ARG  QD     29 VAL  QQG     8.02            #peak   262
!# 29 VAL  HN     29 VAL  QQG     5.06            #peak   263
!#  1 CYSS HN      1 CYSS QB      2.90            #peak     2
!#  1 CYSS QB      2 GLY  QA      3.56            #peak     7
!#  1 CYSS QB      3 GLU  HN      3.15            #peak     4
!#  2 GLY  HN      2 GLY  QA      2.56            #peak    15
!#  2 GLY  QA      3 GLU  HN      3.04            #peak    16
!#  3 GLU  QG      4 THR  HN      4.12            #peak    29
!#  3 GLU  QG     22 CYSS QB      4.01            #peak    26
!#  5 CYSS HN      5 CYSS QB      3.43            #peak    41
!#  5 CYSS HN     20 PRO  QB      5.03            #peak   154
!#  5 CYSS QB      6 PHE  HN      4.07            #peak    47
!#  5 CYSS QB      6 PHE  QB      6.16            #peak    55
!#  5 CYSS QB      8 GLY  HN      3.25            #peak    48
!#  5 CYSS QB      9 THR  HN      3.67            #peak    44
!#  5 CYSS QB     10 CYSS HN      5.29            #peak    49
!#  8 GLY  HN      8 GLY  QA      2.54            #peak    70
!#  8 GLY  QA     19 TRP  HD1     3.46            #peak    72
!# 10 CYSS HN     10 CYSS QB      2.90            #peak    87
!# 10 CYSS QB     11 ASN  HN      3.42            #peak    84
!# 10 CYSS QB     12 THR  QG2     4.87            #peak    98
!# 13 PRO  QB     14 GLY  HN      3.26            #peak   105
!# 13 PRO  QG     14 GLY  HN      5.03            #peak   108
!# 14 GLY  HN     14 GLY  QA      2.20            #peak   110
!# 14 GLY  QA     15 CYSS HN      3.09            #peak   113
!# 15 CYSS HN     15 CYSS QB      2.65            #peak   118
!# 15 CYSS QB     16 SER  HN      3.12            #peak   123
!# 15 CYSS QB     22 CYSS QB      4.59            #peak   124
!# 15 CYSS QB     23 THR  HN      4.94            #peak   125
!# 17 CYSS QB     18 THR  HN      3.67            #peak   137
!# 19 TRP  HD1    20 PRO  QB      5.34            #peak   155
!# 19 TRP  HE3    20 PRO  QB      3.82            #peak   163
!# 19 TRP  HE3    20 PRO  QD      3.94            #peak   173
!# 19 TRP  HE1    20 PRO  QB      5.34            #peak   162
!# 19 TRP  HZ3    20 PRO  QD      5.14            #peak   174
!# 19 TRP  HZ2    20 PRO  QB      5.34            #peak   165
!# 19 TRP  HH2    20 PRO  QB      4.57            #peak   157
!# 20 PRO  QD     21 ILE  HN      3.18            #peak   177
!# 20 PRO  QD     21 ILE  QG1     4.06            #peak   189
!# 21 ILE  HN     21 ILE  QG1     3.60            #peak   191
!# 22 CYSS HN     22 CYSS QB      2.65            #peak   200
!# 22 CYSS QB     23 THR  HN      3.33            #peak   203
!# 24 ARG  HN     27 LEU  QB      3.79            #peak   246
!# 24 ARG  QB     24 ARG  HE      3.45            #peak   219
!# 25 ASP  QB     27 LEU  HN      3.94            #peak   238
!# 25 ASP  QB     27 LEU  QQD     6.19            #peak   253
!# 26 GLY  HN     26 GLY  QA      2.49            #peak   242
!# 27 LEU  HN     27 LEU  QB      2.66            #peak   248
!# 27 LEU  HN     27 LEU  QQD     4.58            #peak   255
assign (resid   1 and name   HA)   (resid   2 and name   HN)   2.640    0.840    0.840  
assign (resid   1 and name   HN)   (resid   1 and name  HB3)   2.580    0.780    0.780  
assign (resid   1 and name  HB3)   (resid   2 and name   HN)   3.125    1.325    1.325  
assign (resid   1 and name  HB3)   (resid   3 and name   HN)   2.735    0.935    0.935  
assign (resid   1 and name   HN)   (resid   1 and name  HB2)   2.580    0.780    0.780  
assign (resid   1 and name  HB2)   (resid   2 and name   HN)   3.125    1.325    1.325  
assign (resid   1 and name  HB2)   (resid   3 and name   HN)   2.735    0.935    0.935  
assign (resid   1 and name   HN)   (resid   2 and name   HN)   2.365    0.565    0.565  
assign (resid   1 and name   HN)   (resid  29 and name   HN)   2.505    0.705    0.705  
assign (resid   2 and name  HA1)   (resid   3 and name   HN)   2.660    0.860    0.860  
assign (resid   2 and name  HA2)   (resid   3 and name   HN)   2.660    0.860    0.860  
assign (resid   3 and name   HA)   (resid   4 and name   HN)   2.160    0.360    0.360  
assign (resid   3 and name   HN)   (resid   3 and name  HB3)   2.875    1.075    1.075  
assign (resid   3 and name  HB3)   (resid   4 and name   HN)   2.720    0.920    0.920  
assign (resid   3 and name   HN)   (resid   3 and name  HB2)   2.875    1.075    1.075  
assign (resid   3 and name  HB2)   (resid   4 and name   HN)   2.720    0.920    0.920  
assign (resid   2 and name   HN)   (resid   3 and name   HN)   2.470    0.670    0.670  
assign (resid   4 and name   HA)   (resid  22 and name   HN)   2.455    0.655    0.655  
assign (resid   5 and name   HA)   (resid   6 and name   HN)   2.410    0.610    0.610  
assign (resid   5 and name   HA)   (resid   7 and name   HN)   2.735    0.935    0.935  
assign (resid   5 and name   HA)   (resid   8 and name   HN)   2.890    1.090    1.090  
assign (resid   5 and name  HB3)   (resid   6 and name   HN)   3.310    1.510    1.510  
assign (resid   5 and name  HB3)   (resid   8 and name   HN)   2.920    1.120    1.120  
assign (resid   5 and name  HB2)   (resid   6 and name   HN)   3.310    1.510    1.510  
assign (resid   5 and name  HB2)   (resid   8 and name   HN)   2.920    1.120    1.120  
assign (resid   5 and name   HN)   (resid   6 and name   HN)   2.660    0.860    0.860  
assign (resid   6 and name   HA)   (resid   8 and name   HN)   3.170    1.370    1.370  
assign (resid   6 and name   HN)   (resid   6 and name  HB#)   2.910    1.110    1.110  
assign (resid   6 and name  HB#)   (resid   7 and name   HN)   3.130    1.330    1.330  
assign (resid   6 and name   HN)   (resid   7 and name   HN)   2.580    0.780    0.780  
assign (resid   7 and name   HN)   (resid   8 and name   HN)   2.535    0.735    0.735  
assign (resid   9 and name   HN)   (resid   9 and name   HA)   2.365    0.565    0.565  
assign (resid   9 and name   HN)   (resid   9 and name   HB)   2.520    0.720    0.720  
assign (resid   9 and name   HB)   (resid  10 and name   HN)   0.000    0.000    3.500 ! 120607 set to 3.5 
assign (resid   8 and name   HN)   (resid   9 and name   HN)   2.550    0.750    0.750  
assign (resid  10 and name   HA)   (resid  11 and name   HN)   2.425    0.625    0.625  
assign (resid  10 and name   HA)   (resid  12 and name   HN)   2.955    1.155    1.155  
assign (resid  10 and name   HN)   (resid  10 and name  HB3)   2.625    0.825    0.825  
assign (resid  10 and name  HB3)   (resid  11 and name   HN)   2.935    1.135    1.135  
assign (resid  10 and name  HB3)   (resid  12 and name   HN)   2.905    1.105    1.105  
assign (resid  10 and name   HN)   (resid  10 and name  HB2)   2.625    0.825    0.825  
assign (resid  10 and name  HB2)   (resid  11 and name   HN)   2.935    1.135    1.135  
assign (resid  10 and name  HB2)   (resid  12 and name   HN)   2.905    1.105    1.105  
assign (resid  11 and name   HN)   (resid  11 and name  HB#)   2.975    1.175    1.175  
assign (resid  11 and name  HB#)   (resid  12 and name   HN)   3.330    1.530    1.530  
assign (resid  11 and name   HN)   (resid  12 and name   HN)   2.425    0.625    0.625  
assign (resid  13 and name   HA)   (resid  14 and name   HN)   2.180    0.380    0.380  
assign (resid  13 and name   HA)   (resid  15 and name   HN)   2.610    0.810    0.810  
assign (resid  14 and name   HN)   (resid  14 and name  HA1)   0.000    0.000    3.000 ! 100607 set to 3 
assign (resid  14 and name   HN)   (resid  14 and name  HA2)   2.180    0.380    0.380  
assign (resid  15 and name   HA)   (resid  16 and name   HN)   2.160    0.360    0.360  
assign (resid  15 and name   HA)   (resid  23 and name   HN)   2.955    1.155    1.155  
assign (resid  15 and name   HN)   (resid  15 and name  HB3)   2.455    0.655    0.655  
assign (resid  15 and name   HN)   (resid  15 and name  HB2)   2.455    0.655    0.655  
assign (resid  14 and name   HN)   (resid  15 and name   HN)   2.455    0.655    0.655  
assign (resid  15 and name   HN)   (resid  16 and name   HN)   0.000    0.000    4.500 ! 120607 set to 4.5 
assign (resid  16 and name   HN)   (resid  16 and name  HB3)   2.580    0.780    0.780  
assign (resid  16 and name   HN)   (resid  16 and name  HB2)   2.580    0.780    0.780  
assign (resid  16 and name   HN)   (resid  23 and name   HN)   2.470    0.670    0.670  
assign (resid  17 and name   HA)   (resid  18 and name   HN)   2.240    0.440    0.440  
assign (resid  17 and name   HA)   (resid  23 and name   HN)   2.735    0.935    0.935  
assign (resid  17 and name   HN)   (resid  17 and name  HB3)   2.440    0.640    0.640  
assign (resid  17 and name   HN)   (resid  17 and name  HB2)   2.440    0.640    0.640  
assign (resid  19 and name   HA)   (resid  21 and name   HN)   2.470    0.670    0.670  
assign (resid  19 and name   HN)   (resid  19 and name  HB#)   2.790    0.990    0.990  
assign (resid  19 and name   HA)   (resid  20 and name   HA)   2.315    0.515    0.515  
assign (resid  20 and name   HA)   (resid  21 and name   HN)   2.535    0.735    0.735  
assign (resid   5 and name   HN)   (resid  21 and name   HA)   2.520    0.720    0.720  
assign (resid  21 and name   HA)   (resid  22 and name   HN)   2.210    0.410    0.410  
assign (resid  21 and name   HB)   (resid  22 and name   HN)   2.815    1.015    1.015  
assign (resid  16 and name   HN)   (resid  22 and name   HA)   0.000    0.000    4.500 ! 150607 set to 4.5 
assign (resid  22 and name  HB3)   (resid  23 and name   HN)   2.860    1.060    1.060  
assign (resid  22 and name  HB2)   (resid  23 and name   HN)   2.860    1.060    1.060  
assign (resid   5 and name   HN)   (resid  22 and name   HN)   2.640    0.840    0.840  
assign (resid  21 and name   HN)   (resid  22 and name   HN)   2.985    1.185    1.185  
assign (resid  22 and name   HN)   (resid  23 and name   HN)   0.000    0.000    4.500 ! 120607 set to 4.5 
assign (resid  23 and name   HN)   (resid  23 and name   HB)   2.780    0.980    0.980  
assign (resid  23 and name   HB)   (resid  26 and name   HN)   2.535    0.735    0.735  
assign (resid  23 and name   HB)   (resid  27 and name   HN)   2.535    0.735    0.735  
assign (resid  15 and name   HA)   (resid  24 and name   HA)   2.935    1.135    1.135  
assign (resid  16 and name   HN)   (resid  24 and name   HA)   3.060    1.260    1.260  
assign (resid  24 and name   HA)   (resid  26 and name   HN)   3.000    1.200    1.200  
assign (resid  24 and name   HN)   (resid  24 and name  HB3)   2.395    0.595    0.595  
assign (resid  24 and name  HB3)   (resid  25 and name   HN)   2.565    0.765    0.765  
assign (resid  24 and name   HN)   (resid  24 and name  HB2)   0.000    0.000    3.500 ! 110607 set to 3.5 
assign (resid  24 and name  HB2)   (resid  25 and name   HN)   2.565    0.765    0.765  
assign (resid  23 and name   HN)   (resid  24 and name   HN)   0.000    0.000    5.000 ! 100607 set to 5  
assign (resid  24 and name   HN)   (resid  25 and name   HN)   0.000    0.000    4.500 ! 110607 set to 4.5 
assign (resid  25 and name   HA)   (resid  26 and name   HN)   2.455    0.655    0.655  
assign (resid  25 and name   HN)   (resid  25 and name  HB3)   2.735    0.935    0.935  
assign (resid  25 and name   HN)   (resid  25 and name  HB2)   2.735    0.935    0.935  
assign (resid  25 and name   HN)   (resid  26 and name   HN)   2.485    0.685    0.685  
assign (resid  27 and name   HN)   (resid  27 and name  HB3)   2.425    0.625    0.625  
assign (resid  27 and name   HN)   (resid  27 and name  HB2)   2.425    0.625    0.625  
assign (resid  24 and name   HN)   (resid  27 and name   HN)   2.535    0.735    0.735  
assign (resid  25 and name   HN)   (resid  27 and name   HN)   3.075    1.275    1.275  
assign (resid  26 and name   HN)   (resid  27 and name   HN)   2.505    0.705    0.705  
assign (resid   1 and name   HN)   (resid  28 and name   HA)   2.640    0.840    0.840  
assign (resid  28 and name   HA)   (resid  29 and name   HN)   2.225    0.425    0.425  
assign (resid   1 and name   HN)   (resid  29 and name   HA)   2.550    0.750    0.750  
assign (resid  29 and name   HN)   (resid  29 and name   HA)   2.315    0.515    0.515  
assign (resid  29 and name   HN)   (resid  29 and name   HB)   2.440    0.640    0.640  
assign (resid   3 and name   HN)   (resid   3 and name  HG1)   2.690    0.890    0.890  
assign (resid   3 and name   HN)   (resid   3 and name  HG2)   2.690    0.890    0.890  
assign (resid   6 and name   HA)   (resid  19 and name  HE1)   2.455    0.655    0.655  
assign (resid   6 and name  HB#)   (resid  19 and name  HE1)   4.090    2.290    2.290  
assign (resid   8 and name  HA1)   (resid  19 and name  HD1)   3.060    1.260    1.260  
assign (resid   8 and name  HA2)   (resid  19 and name  HD1)   3.060    1.260    1.260  
assign (resid   8 and name   HN)   (resid  19 and name  HE1)   3.525    1.725    1.725  
assign (resid  19 and name   HA)   (resid  19 and name  HD1)   2.660    0.860    0.860  
assign (resid   8 and name   HN)   (resid  19 and name  HD1)   3.125    1.325    1.325  
assign (resid  19 and name  HD1)   (resid  20 and name   HA)   2.955    1.155    1.155  
assign (resid  19 and name  HE1)   (resid  20 and name   HA)   3.650    1.850    1.850  
assign (resid  19 and name  HE3)   (resid  20 and name  HB3)   3.090    1.290    1.290  
assign (resid  19 and name  HZ3)   (resid  20 and name  HB3)   3.480    1.680    1.680  
assign (resid  19 and name  HE3)   (resid  20 and name  HB2)   3.090    1.290    1.290  
assign (resid  19 and name  HZ3)   (resid  20 and name  HB2)   3.480    1.680    1.680  
assign (resid  24 and name  HB3)   (resid  24 and name   HE)   2.875    1.075    1.075  
assign (resid  24 and name  HB3)   (resid  24 and name  HD#)   2.895    1.095    1.095  
assign (resid  24 and name  HB2)   (resid  24 and name   HE)   2.875    1.075    1.075  
assign (resid  24 and name  HB2)   (resid  24 and name  HD#)   2.895    1.095    1.095  
assign (resid  24 and name   HN)   (resid  24 and name  HD#)   4.090    2.290    2.290  
assign (resid  24 and name  HG#)   (resid  25 and name   HN)   4.030    2.230    2.230  
assign (resid  27 and name   HN)   (resid  27 and name   HG)   2.750    0.950    0.950  
assign (resid   4 and name   HN)   (resid   4 and name HG2#)   3.200    1.400    1.400  
assign (resid   4 and name HG2#)   (resid   5 and name   HN)   3.370    1.570    1.570  
assign (resid   4 and name HG2#)   (resid  22 and name   HN)   4.095    2.295    2.295  
assign (resid   9 and name   HN)   (resid   9 and name HG2#)   3.475    1.675    1.675  
assign (resid   9 and name HG2#)   (resid  10 and name   HN)   3.260    1.460    1.460  
assign (resid  12 and name   HN)   (resid  12 and name HG2#)   3.740    1.940    1.940  
assign (resid  12 and name HG2#)   (resid  13 and name  HD#)   3.625    1.825    1.825  
assign (resid  12 and name HG2#)   (resid  15 and name   HN)   3.805    2.005    2.005  
assign (resid  18 and name   HN)   (resid  18 and name HG2#)   3.585    1.785    1.785  
assign (resid  18 and name HG2#)   (resid  19 and name   HN)   3.680    1.880    1.880  
assign (resid  21 and name   HN)   (resid  21 and name HD1#)   3.245    1.445    1.445  
assign (resid  21 and name HD1#)   (resid  22 and name   HN)   3.325    1.525    1.525  
assign (resid  19 and name  HZ3)   (resid  21 and name HG2#)   4.160    2.360    2.360  
assign (resid  21 and name HG2#)   (resid  22 and name   HN)   4.050    2.250    2.250  
assign (resid  23 and name   HN)   (resid  23 and name HG2#)   3.355    1.555    1.555  
assign (resid  23 and name HG2#)   (resid  24 and name   HN)   2.980    1.180    1.180  
assign (resid  23 and name HG2#)   (resid  26 and name   HN)   4.020    2.220    2.220  
assign (resid  23 and name HG2#)   (resid  27 and name   HN)   3.275    1.475    1.475  
assign (resid  27 and name   HN)   (resid  27 and name HD1#)   3.835    2.035    2.035  
assign (resid  27 and name   HN)   (resid  27 and name HD2#)   3.835    2.035    2.035  
assign (resid   1 and name   HN)   (resid  29 and name  HG*)   4.280    2.480    2.480  
assign (resid  24 and name  HD#)   (resid  29 and name  HG*)   4.910    3.110    3.110  
assign (resid  29 and name   HN)   (resid  29 and name  HG*)   3.430    1.630    1.630  
assign (resid   1 and name   HN)   (resid   1 and name  HB#)   2.350    0.550    0.550  
assign (resid   1 and name  HB#)   (resid   2 and name  HA#)   0.000    0.000    4.000 ! 120607 set to 4.0 
assign (resid   1 and name  HB#)   (resid   3 and name   HN)   2.475    0.675    0.675  
assign (resid   2 and name   HN)   (resid   2 and name  HA#)   2.180    0.380    0.380  
assign (resid   2 and name  HA#)   (resid   3 and name   HN)   2.420    0.620    0.620  
assign (resid   3 and name  HG#)   (resid   4 and name   HN)   2.960    1.160    1.160  
assign (resid   3 and name  HG#)   (resid  22 and name  HB#)   2.905    1.105    1.105  
assign (resid   5 and name   HN)   (resid   5 and name  HB#)   2.615    0.815    0.815  
assign (resid   5 and name   HN)   (resid  20 and name  HB#)   3.415    1.615    1.615  
assign (resid   5 and name  HB#)   (resid   6 and name   HN)   2.935    1.135    1.135  
assign (resid   5 and name  HB#)   (resid   6 and name  HB#)   3.980    2.180    2.180  
assign (resid   5 and name  HB#)   (resid   8 and name   HN)   2.525    0.725    0.725  
assign (resid   5 and name  HB#)   (resid   9 and name   HN)   2.735    0.935    0.935  
assign (resid   5 and name  HB#)   (resid  10 and name   HN)   3.545    1.745    1.745  
assign (resid   8 and name   HN)   (resid   8 and name  HA#)   2.170    0.370    0.370  
assign (resid   8 and name  HA#)   (resid  19 and name  HD1)   2.630    0.830    0.830  
assign (resid  10 and name   HN)   (resid  10 and name  HB#)   2.350    0.550    0.550  
assign (resid  10 and name  HB#)   (resid  11 and name   HN)   2.610    0.810    0.810  
assign (resid  10 and name  HB#)   (resid  12 and name HG2#)   3.335    1.535    1.535  
assign (resid  13 and name  HB#)   (resid  14 and name   HN)   2.530    0.730    0.730  
assign (resid  13 and name  HG#)   (resid  14 and name   HN)   3.415    1.615    1.615  
assign (resid  14 and name   HN)   (resid  14 and name  HA#)   2.000    0.200    0.200  
assign (resid  14 and name  HA#)   (resid  15 and name   HN)   2.445    0.645    0.645  
assign (resid  15 and name   HN)   (resid  15 and name  HB#)   2.225    0.425    0.425  
assign (resid  15 and name  HB#)   (resid  16 and name   HN)   2.460    0.660    0.660  
assign (resid  15 and name  HB#)   (resid  22 and name  HB#)   3.195    1.395    1.395  
assign (resid  15 and name  HB#)   (resid  23 and name   HN)   3.370    1.570    1.570  
assign (resid  17 and name  HB#)   (resid  18 and name   HN)   2.735    0.935    0.935  
assign (resid  19 and name  HD1)   (resid  20 and name  HB#)   3.570    1.770    1.770  
assign (resid  19 and name  HE3)   (resid  20 and name  HB#)   2.810    1.010    1.010  
assign (resid  19 and name  HE3)   (resid  20 and name  HD#)   2.870    1.070    1.070  
assign (resid  19 and name  HE1)   (resid  20 and name  HB#)   3.570    1.770    1.770  
assign (resid  19 and name  HZ3)   (resid  20 and name  HD#)   3.470    1.670    1.670  
assign (resid  19 and name  HZ2)   (resid  20 and name  HB#)   3.570    1.770    1.770  
assign (resid  19 and name  HH2)   (resid  20 and name  HB#)   3.185    1.385    1.385  
assign (resid  20 and name  HD#)   (resid  21 and name   HN)   2.490    0.690    0.690  
assign (resid  20 and name  HD#)   (resid  21 and name HG1#)   2.930    1.130    1.130  
assign (resid  21 and name   HN)   (resid  21 and name HG1#)   2.700    0.900    0.900  
assign (resid  22 and name   HN)   (resid  22 and name  HB#)   2.225    0.425    0.425  
assign (resid  22 and name  HB#)   (resid  23 and name   HN)   2.565    0.765    0.765  
assign (resid  24 and name   HN)   (resid  27 and name  HB#)   2.795    0.995    0.995  
assign (resid  24 and name  HB#)   (resid  24 and name   HE)   2.625    0.825    0.825  
assign (resid  25 and name  HB#)   (resid  27 and name   HN)   2.870    1.070    1.070  
assign (resid  25 and name  HB#)   (resid  27 and name  HD#)   3.995    2.195    2.195  
assign (resid  26 and name   HN)   (resid  26 and name  HA#)   2.145    0.345    0.345  
assign (resid  27 and name   HN)   (resid  27 and name  HB#)   2.230    0.430    0.430  
assign (resid  27 and name   HN)   (resid  27 and name  HD#)   3.190    1.390    1.390  

assign (resid   2 and name   HN)   (resid  21 and name   HN)   9.290    0.100    0.300
assign (resid   2 and name   HN)   (resid  21 and name   HA)   7.030    0.100    0.300
assign (resid   2 and name   HN)   (resid  22 and name   HN)   5.830    0.300    0.300
assign (resid   2 and name   HN)   (resid  22 and name   HA)   7.220    0.100    0.300
assign (resid   2 and name   HN)   (resid  23 and name   HN)   7.210    0.100    0.300
assign (resid   2 and name   HN)   (resid  23 and name   HA)   5.240    0.100    0.600
assign (resid   2 and name  HA#)   (resid  21 and name   HA)   7.830    0.900    0.100
assign (resid   2 and name  HA#)   (resid  22 and name   HN)   6.960    0.900    0.100
assign (resid   2 and name  HA#)   (resid  22 and name   HA)   8.940    0.800    0.100
assign (resid   2 and name  HA#)   (resid  23 and name   HN)   9.310    0.900    0.250
assign (resid   2 and name  HA#)   (resid  23 and name   HA)   7.600    0.500    0.100

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   CYS   1           H1       CYS   1   3.075   0.736   4.478
    2    HA   CYS   1           HA       CYS   1   2.540   3.505   4.498
    3    HB2  CYS   1           HB3      CYS   1   1.076   1.511   2.776
    4    HB3  CYS   1           HB2      CYS   1   1.505   3.176   2.394
    5    H    GLY   2           H        GLY   2   0.574   0.673   5.207
    6    HA2  GLY   2           HA3      GLY   2  -1.280   0.469   6.559
    7    HA3  GLY   2           HA2      GLY   2  -1.159   2.182   6.912
    8    H    GLU   3           H        GLU   3  -1.309   3.040   4.174
    9    HA   GLU   3           HA       GLU   3  -4.051   3.399   3.920
   10    HB2  GLU   3           HB3      GLU   3  -3.584   4.334   1.720
   11    HB3  GLU   3           HB2      GLU   3  -2.406   4.891   2.900
   12    HG2  GLU   3           HG3      GLU   3  -0.707   3.587   2.006
   13    HG3  GLU   3           HG2      GLU   3  -1.836   2.529   1.159
   14    H    THR   4           H        THR   4  -5.612   2.560   2.652
   15    HA   THR   4           HA       THR   4  -5.194  -0.171   1.719
   16    HB   THR   4           HB       THR   4  -7.693   1.469   2.224
   17    HG1  THR   4           HG1      THR   4  -6.286  -0.517   3.630
   18   HG21  THR   4          HG21      THR   4  -7.655  -0.438   0.351
   19   HG22  THR   4          HG22      THR   4  -9.044  -0.170   1.406
   20   HG23  THR   4          HG23      THR   4  -7.892  -1.455   1.773
   21    H    CYS   5           H        CYS   5  -4.891  -0.550  -0.399
   22    HA   CYS   5           HA       CYS   5  -5.476   1.549  -2.320
   23    HB2  CYS   5           HB3      CYS   5  -4.352   0.014  -3.954
   24    HB3  CYS   5           HB2      CYS   5  -3.336   0.509  -2.606
   25    H    PHE   6           H        PHE   6  -7.791   1.057  -1.537
   26    HA   PHE   6           HA       PHE   6  -9.241  -1.168  -2.299
   27    HB2  PHE   6           HB3      PHE   6 -10.123   0.682  -0.910
   28    HB3  PHE   6           HB2      PHE   6 -10.180   1.711  -2.336
   29    HD1  PHE   6           HD1      PHE   6 -11.255  -1.800  -1.644
   30    HD2  PHE   6           HD2      PHE   6 -12.346   2.092  -2.975
   31    HE1  PHE   6           HE1      PHE   6 -13.527  -2.608  -2.130
   32    HE2  PHE   6           HE2      PHE   6 -14.621   1.292  -3.463
   33    HZ   PHE   6           HZ       PHE   6 -15.214  -1.061  -3.040
   34    H    GLY   7           H        GLY   7  -8.473   1.726  -4.194
   35    HA2  GLY   7           HA3      GLY   7  -9.717   0.538  -6.558
   36    HA3  GLY   7           HA2      GLY   7  -9.105   2.181  -6.423
   37    H    GLY   8           H        GLY   8  -7.159  -0.479  -5.323
   38    HA2  GLY   8           HA3      GLY   8  -5.313  -1.524  -6.215
   39    HA3  GLY   8           HA2      GLY   8  -5.765  -0.900  -7.788
   40    H    THR   9           H        THR   9  -5.739   1.901  -6.825
   41    HA   THR   9           HA       THR   9  -2.880   2.318  -7.121
   42    HB   THR   9           HB       THR   9  -4.874   4.536  -6.856
   43    HG1  THR   9           HG1      THR   9  -5.042   2.544  -8.639
   44   HG21  THR   9          HG21      THR   9  -2.293   4.753  -7.148
   45   HG22  THR   9          HG22      THR   9  -3.364   5.781  -8.099
   46   HG23  THR   9          HG23      THR   9  -2.632   4.353  -8.831
   47    H    CYS  10           H        CYS  10  -1.624   3.552  -5.718
   48    HA   CYS  10           HA       CYS  10  -2.667   3.807  -2.980
   49    HB2  CYS  10           HB3      CYS  10   0.200   3.396  -3.876
   50    HB3  CYS  10           HB2      CYS  10  -0.334   3.567  -2.208
   51    H    ASN  11           H        ASN  11  -2.046   5.650  -1.776
   52    HA   ASN  11           HA       ASN  11  -1.731   8.023  -3.432
   53    HB2  ASN  11           HB3      ASN  11  -3.429   7.738  -1.526
   54    HB3  ASN  11           HB2      ASN  11  -2.067   7.941  -0.433
   55   HD21  ASN  11          HD22      ASN  11  -1.408   9.781  -3.096
   56   HD22  ASN  11          HD21      ASN  11  -2.048  11.288  -2.553
   57    H    THR  12           H        THR  12   0.164   6.029  -1.357
   58    HA   THR  12           HA       THR  12   2.211   8.111  -1.060
   59    HB   THR  12           HB       THR  12   2.303   5.340   0.121
   60    HG1  THR  12           HG1      THR  12   0.382   6.180   0.859
   61   HG21  THR  12          HG21      THR  12   4.363   6.659   0.204
   62   HG22  THR  12          HG22      THR  12   3.691   6.426   1.817
   63   HG23  THR  12          HG23      THR  12   3.494   7.974   0.996
   64    HA   PRO  13           HA       PRO  13   4.395   6.338  -4.535
   65    HB2  PRO  13           HB2      PRO  13   6.706   7.763  -4.140
   66    HB3  PRO  13           HB3      PRO  13   5.280   8.406  -4.960
   67    HG2  PRO  13           HG3      PRO  13   6.176   8.793  -2.134
   68    HG3  PRO  13           HG2      PRO  13   5.480   9.970  -3.262
   69    HD2  PRO  13           HD3      PRO  13   4.021   8.821  -1.309
   70    HD3  PRO  13           HD2      PRO  13   3.320   9.244  -2.884
   71    H    GLY  14           H        GLY  14   5.645   4.560  -4.687
   72    HA2  GLY  14           HA3      GLY  14   7.517   3.221  -4.123
   73    HA3  GLY  14           HA2      GLY  14   7.534   3.964  -2.529
   74    H    CYS  15           H        CYS  15   4.503   3.599  -2.501
   75    HA   CYS  15           HA       CYS  15   4.601   0.947  -1.332
   76    HB2  CYS  15           HB3      CYS  15   2.367   2.987  -1.431
   77    HB3  CYS  15           HB2      CYS  15   2.295   1.452  -0.574
   78    H    SER  16           H        SER  16   3.940  -0.815  -2.286
   79    HA   SER  16           HA       SER  16   2.611  -0.640  -4.884
   80    HB2  SER  16           HB3      SER  16   3.836  -3.059  -3.530
   81    HB3  SER  16           HB2      SER  16   3.368  -2.913  -5.224
   82    HG   SER  16           HG       SER  16   5.171  -1.034  -4.240
   83    H    CYS  17           H        CYS  17   0.595  -1.572  -5.232
   84    HA   CYS  17           HA       CYS  17  -1.051  -1.813  -2.943
   85    HB2  CYS  17           HB3      CYS  17  -1.956  -0.995  -5.050
   86    HB3  CYS  17           HB2      CYS  17  -1.646  -2.553  -5.807
   87    H    THR  18           H        THR  18  -1.421  -3.423  -1.712
   88    HA   THR  18           HA       THR  18  -1.164  -6.175  -2.701
   89    HB   THR  18           HB       THR  18  -0.370  -5.347   0.104
   90    HG1  THR  18           HG1      THR  18   1.019  -5.064  -2.240
   91   HG21  THR  18          HG21      THR  18   0.343  -7.806  -1.502
   92   HG22  THR  18          HG22      THR  18  -0.992  -7.728  -0.350
   93   HG23  THR  18          HG23      THR  18   0.667  -7.518   0.208
   94    H    TRP  19           H        TRP  19  -3.404  -5.229  -3.000
   95    HA   TRP  19           HA       TRP  19  -5.308  -4.429  -1.459
   96    HB2  TRP  19           HB3      TRP  19  -5.328  -5.796  -3.786
   97    HB3  TRP  19           HB2      TRP  19  -6.136  -6.959  -2.739
   98    HD1  TRP  19           HD1      TRP  19  -6.702  -3.716  -4.570
   99    HE1  TRP  19           HE1      TRP  19  -9.131  -2.934  -4.210
  100    HE3  TRP  19           HE3      TRP  19  -8.056  -6.974  -0.876
  101    HZ2  TRP  19           HZ2      TRP  19 -11.326  -3.611  -2.560
  102    HZ3  TRP  19           HZ3      TRP  19 -10.321  -6.833   0.054
  103    HH2  TRP  19           HH2      TRP  19 -11.930  -5.189  -0.775
  104    HA   PRO  20           HA       PRO  20  -6.612  -3.981  -0.433
  105    HB2  PRO  20           HB2      PRO  20  -7.906  -3.508   1.837
  106    HB3  PRO  20           HB3      PRO  20  -8.509  -4.702   0.684
  107    HG2  PRO  20           HG3      PRO  20  -7.176  -5.111   3.301
  108    HG3  PRO  20           HG2      PRO  20  -8.350  -6.138   2.463
  109    HD2  PRO  20           HD3      PRO  20  -5.492  -6.396   2.507
  110    HD3  PRO  20           HD2      PRO  20  -6.665  -7.405   1.638
  111    H    ILE  21           H        ILE  21  -3.799  -4.320   0.605
  112    HA   ILE  21           HA       ILE  21  -3.687  -1.758   2.008
  113    HB   ILE  21           HB       ILE  21  -2.043  -2.601   3.640
  114   HG12  ILE  21          HG13      ILE  21  -2.805  -5.347   2.614
  115   HG13  ILE  21          HG12      ILE  21  -1.261  -4.553   2.322
  116   HG21  ILE  21          HG21      ILE  21  -4.786  -3.828   3.607
  117   HG22  ILE  21          HG22      ILE  21  -4.214  -2.417   4.501
  118   HG23  ILE  21          HG23      ILE  21  -3.686  -4.031   4.975
  119   HD11  ILE  21          HD11      ILE  21  -0.567  -4.819   4.507
  120   HD12  ILE  21          HD12      ILE  21  -1.452  -6.313   4.197
  121   HD13  ILE  21          HD13      ILE  21  -2.210  -5.012   5.115
  122    H    CYS  22           H        CYS  22  -1.995  -0.507   1.462
  123    HA   CYS  22           HA       CYS  22  -0.291  -1.426  -0.701
  124    HB2  CYS  22           HB3      CYS  22  -0.381   1.243   0.705
  125    HB3  CYS  22           HB2      CYS  22   0.587   0.880  -0.713
  126    H    THR  23           H        THR  23   1.808  -1.894  -0.600
  127    HA   THR  23           HA       THR  23   3.179  -1.668   1.998
  128    HB   THR  23           HB       THR  23   4.319  -3.815   1.480
  129    HG1  THR  23           HG1      THR  23   2.410  -4.579  -0.384
  130   HG21  THR  23          HG21      THR  23   2.212  -5.281   1.723
  131   HG22  THR  23          HG22      THR  23   1.327  -3.756   1.742
  132   HG23  THR  23          HG23      THR  23   2.540  -4.086   2.980
  133    H    ARG  24           H        ARG  24   5.054  -0.519   1.845
  134    HA   ARG  24           HA       ARG  24   6.153  -0.089  -0.817
  135    HB2  ARG  24           HB3      ARG  24   7.456   1.684   0.143
  136    HB3  ARG  24           HB2      ARG  24   5.796   1.881   0.658
  137    HG2  ARG  24           HG3      ARG  24   6.294   1.552   2.833
  138    HG3  ARG  24           HG2      ARG  24   7.567   0.380   2.478
  139    HD2  ARG  24           HD3      ARG  24   7.757   3.373   2.137
  140    HD3  ARG  24           HD2      ARG  24   8.502   2.426   3.425
  141    HE   ARG  24           HE       ARG  24   9.337   1.393   0.941
  142   HH11  ARG  24          HH11      ARG  24   9.778   4.266   2.905
  143   HH12  ARG  24          HH12      ARG  24  11.357   4.597   2.277
  144   HH21  ARG  24          HH22      ARG  24  11.376   1.803   0.120
  145   HH22  ARG  24          HH21      ARG  24  12.279   3.184   0.676
  146    H    ASP  25           H        ASP  25   7.866  -1.166  -1.502
  147    HA   ASP  25           HA       ASP  25   9.614  -2.623  -1.574
  148    HB2  ASP  25           HB3      ASP  25  10.209  -1.657   1.238
  149    HB3  ASP  25           HB2      ASP  25  11.335  -2.450   0.146
  150    H    GLY  26           H        GLY  26   6.984  -3.407  -0.474
  151    HA2  GLY  26           HA3      GLY  26   6.150  -5.503   0.088
  152    HA3  GLY  26           HA2      GLY  26   7.771  -6.002   0.542
  153    H    LEU  27           H        LEU  27   7.190  -3.076   2.004
  154    HA   LEU  27           HA       LEU  27   6.486  -4.433   4.513
  155    HB2  LEU  27           HB3      LEU  27   7.724  -1.716   4.059
  156    HB3  LEU  27           HB2      LEU  27   7.405  -2.439   5.624
  157    HG   LEU  27           HG       LEU  27   9.334  -3.524   3.569
  158   HD11  LEU  27          HD11      LEU  27  10.621  -1.854   4.331
  159   HD12  LEU  27          HD12      LEU  27  10.797  -2.871   5.761
  160   HD13  LEU  27          HD13      LEU  27   9.600  -1.575   5.742
  161   HD21  LEU  27          HD21      LEU  27   9.021  -4.365   6.440
  162   HD22  LEU  27          HD22      LEU  27   9.954  -5.148   5.165
  163   HD23  LEU  27          HD23      LEU  27   8.192  -5.177   5.111
  164    HA   PRO  28           HA       PRO  28   2.525  -2.393   4.139
  165    HB2  PRO  28           HB2      PRO  28   1.784  -3.687   6.617
  166    HB3  PRO  28           HB3      PRO  28   1.236  -4.053   4.981
  167    HG2  PRO  28           HG3      PRO  28   2.821  -5.721   6.462
  168    HG3  PRO  28           HG2      PRO  28   2.795  -5.697   4.690
  169    HD2  PRO  28           HD3      PRO  28   4.761  -4.454   6.576
  170    HD3  PRO  28           HD2      PRO  28   5.049  -5.287   5.032
  171    H    VAL  29           H        VAL  29   4.551  -0.826   5.138
  172    HA   VAL  29           HA       VAL  29   3.728   0.155   7.735
  173    HB   VAL  29           HB       VAL  29   6.143  -0.037   7.143
  174   HG11  VAL  29          HG11      VAL  29   5.650   2.338   5.360
  175   HG12  VAL  29          HG12      VAL  29   5.896   0.689   4.785
  176   HG13  VAL  29          HG13      VAL  29   7.185   1.521   5.655
  177   HG21  VAL  29          HG21      VAL  29   6.035   1.341   8.926
  178   HG22  VAL  29          HG22      VAL  29   4.856   2.411   8.168
  179   HG23  VAL  29          HG23      VAL  29   6.563   2.545   7.750
  Start of MODEL    2
    1    H1   CYS   1           H        CYS   1   2.814   1.080   4.256
    2    HA   CYS   1           HA       CYS   1   2.135   3.808   4.280
    3    HB2  CYS   1           HB3      CYS   1   0.675   1.848   2.547
    4    HB3  CYS   1           HB2      CYS   1   1.282   3.453   2.147
    5    H    GLY   2           H        GLY   2   0.282   0.892   4.976
    6    HA2  GLY   2           HA3      GLY   2  -1.577   0.624   6.316
    7    HA3  GLY   2           HA2      GLY   2  -1.553   2.351   6.630
    8    H    GLU   3           H        GLU   3  -1.675   3.159   3.894
    9    HA   GLU   3           HA       GLU   3  -4.424   3.351   3.539
   10    HB2  GLU   3           HB3      GLU   3  -3.889   4.232   1.289
   11    HB3  GLU   3           HB2      GLU   3  -2.922   4.964   2.562
   12    HG2  GLU   3           HG3      GLU   3  -1.009   3.693   1.951
   13    HG3  GLU   3           HG2      GLU   3  -1.954   2.697   0.844
   14    H    THR   4           H        THR   4  -5.917   2.283   2.410
   15    HA   THR   4           HA       THR   4  -5.219  -0.356   1.413
   16    HB   THR   4           HB       THR   4  -7.782  -0.519   1.216
   17    HG1  THR   4           HG1      THR   4  -8.559   1.146   2.973
   18   HG21  THR   4          HG21      THR   4  -6.852  -1.713   2.986
   19   HG22  THR   4          HG22      THR   4  -7.980  -0.628   3.800
   20   HG23  THR   4          HG23      THR   4  -6.255  -0.256   3.783
   21    H    CYS   5           H        CYS   5  -4.776  -0.594  -0.699
   22    HA   CYS   5           HA       CYS   5  -5.581   1.480  -2.552
   23    HB2  CYS   5           HB3      CYS   5  -4.109   0.347  -4.159
   24    HB3  CYS   5           HB2      CYS   5  -3.281   0.704  -2.649
   25    H    PHE   6           H        PHE   6  -7.871   0.524  -1.924
   26    HA   PHE   6           HA       PHE   6  -8.813  -1.813  -3.136
   27    HB2  PHE   6           HB3      PHE   6 -10.121   0.736  -2.267
   28    HB3  PHE   6           HB2      PHE   6 -11.049  -0.429  -3.203
   29    HD1  PHE   6           HD1      PHE   6  -8.564  -0.792  -0.432
   30    HD2  PHE   6           HD2      PHE   6 -12.508  -1.538  -1.843
   31    HE1  PHE   6           HE1      PHE   6  -9.055  -2.060   1.617
   32    HE2  PHE   6           HE2      PHE   6 -13.005  -2.807   0.204
   33    HZ   PHE   6           HZ       PHE   6 -11.278  -3.068   1.938
   34    H    GLY   7           H        GLY   7  -8.414   1.440  -4.439
   35    HA2  GLY   7           HA3      GLY   7  -9.581   0.648  -6.988
   36    HA3  GLY   7           HA2      GLY   7  -9.015   2.253  -6.558
   37    H    GLY   8           H        GLY   8  -6.869  -0.333  -5.855
   38    HA2  GLY   8           HA3      GLY   8  -4.864  -0.979  -6.760
   39    HA3  GLY   8           HA2      GLY   8  -5.574  -0.640  -8.330
   40    H    THR   9           H        THR   9  -4.985   1.649  -5.701
   41    HA   THR   9           HA       THR   9  -2.729   2.815  -7.117
   42    HB   THR   9           HB       THR   9  -5.010   4.630  -6.359
   43    HG1  THR   9           HG1      THR   9  -4.872   2.920  -8.502
   44   HG21  THR   9          HG21      THR   9  -2.886   5.023  -8.453
   45   HG22  THR   9          HG22      THR   9  -2.644   5.468  -6.764
   46   HG23  THR   9          HG23      THR   9  -3.922   6.239  -7.704
   47    H    CYS  10           H        CYS  10  -1.504   4.243  -5.780
   48    HA   CYS  10           HA       CYS  10  -2.254   4.250  -2.942
   49    HB2  CYS  10           HB3      CYS  10   0.540   3.745  -3.989
   50    HB3  CYS  10           HB2      CYS  10   0.045   3.774  -2.299
   51    H    ASN  11           H        ASN  11  -1.707   6.049  -1.795
   52    HA   ASN  11           HA       ASN  11  -1.120   8.422  -3.377
   53    HB2  ASN  11           HB3      ASN  11  -3.001   8.425  -1.781
   54    HB3  ASN  11           HB2      ASN  11  -1.878   8.119  -0.461
   55   HD21  ASN  11          HD22      ASN  11  -1.244   9.823   0.631
   56   HD22  ASN  11          HD21      ASN  11  -1.239  11.454   0.064
   57    H    THR  12           H        THR  12   0.517   6.265  -1.291
   58    HA   THR  12           HA       THR  12   2.595   8.236  -0.671
   59    HB   THR  12           HB       THR  12   2.442   5.390   0.318
   60    HG1  THR  12           HG1      THR  12   0.543   6.315   0.994
   61   HG21  THR  12          HG21      THR  12   4.130   5.919   1.719
   62   HG22  THR  12          HG22      THR  12   3.532   7.556   1.989
   63   HG23  THR  12          HG23      THR  12   4.461   7.185   0.537
   64    HA   PRO  13           HA       PRO  13   5.067   6.640  -4.032
   65    HB2  PRO  13           HB2      PRO  13   7.378   7.915  -3.299
   66    HB3  PRO  13           HB3      PRO  13   6.065   8.695  -4.185
   67    HG2  PRO  13           HG3      PRO  13   6.699   8.788  -1.264
   68    HG3  PRO  13           HG2      PRO  13   6.169  10.095  -2.340
   69    HD2  PRO  13           HD3      PRO  13   4.476   8.855  -0.645
   70    HD3  PRO  13           HD2      PRO  13   3.953   9.454  -2.233
   71    H    GLY  14           H        GLY  14   6.327   4.860  -4.235
   72    HA2  GLY  14           HA3      GLY  14   8.024   3.347  -3.621
   73    HA3  GLY  14           HA2      GLY  14   7.974   3.990  -1.984
   74    H    CYS  15           H        CYS  15   4.906   3.788  -2.371
   75    HA   CYS  15           HA       CYS  15   4.712   1.133  -1.223
   76    HB2  CYS  15           HB3      CYS  15   2.692   3.357  -1.577
   77    HB3  CYS  15           HB2      CYS  15   2.322   1.806  -0.834
   78    H    SER  16           H        SER  16   3.877  -0.594  -2.195
   79    HA   SER  16           HA       SER  16   2.894  -0.298  -4.949
   80    HB2  SER  16           HB3      SER  16   4.093  -2.761  -3.655
   81    HB3  SER  16           HB2      SER  16   3.731  -2.527  -5.366
   82    HG   SER  16           HG       SER  16   5.423  -0.678  -4.152
   83    H    CYS  17           H        CYS  17   0.903  -1.121  -5.444
   84    HA   CYS  17           HA       CYS  17  -0.879  -1.596  -3.314
   85    HB2  CYS  17           HB3      CYS  17  -1.591  -0.606  -5.453
   86    HB3  CYS  17           HB2      CYS  17  -1.304  -2.150  -6.251
   87    H    THR  18           H        THR  18  -1.400  -3.325  -2.281
   88    HA   THR  18           HA       THR  18  -0.977  -5.981  -3.459
   89    HB   THR  18           HB       THR  18  -0.468  -5.411  -0.532
   90    HG1  THR  18           HG1      THR  18   1.105  -4.763  -2.663
   91   HG21  THR  18          HG21      THR  18  -0.849  -7.727  -1.012
   92   HG22  THR  18          HG22      THR  18   0.885  -7.518  -0.765
   93   HG23  THR  18          HG23      THR  18   0.240  -7.676  -2.398
   94    H    TRP  19           H        TRP  19  -3.241  -5.205  -3.886
   95    HA   TRP  19           HA       TRP  19  -5.299  -4.564  -2.461
   96    HB2  TRP  19           HB3      TRP  19  -5.081  -5.860  -4.821
   97    HB3  TRP  19           HB2      TRP  19  -5.895  -7.092  -3.862
   98    HD1  TRP  19           HD1      TRP  19  -6.485  -3.794  -5.596
   99    HE1  TRP  19           HE1      TRP  19  -8.968  -3.141  -5.392
  100    HE3  TRP  19           HE3      TRP  19  -7.964  -7.310  -2.197
  101    HZ2  TRP  19           HZ2      TRP  19 -11.250  -4.007  -3.966
  102    HZ3  TRP  19           HZ3      TRP  19 -10.301  -7.321  -1.450
  103    HH2  TRP  19           HH2      TRP  19 -11.917  -5.706  -2.322
  104    HA   PRO  20           HA       PRO  20  -6.737  -4.251  -1.550
  105    HB2  PRO  20           HB2      PRO  20  -8.239  -3.929   0.609
  106    HB3  PRO  20           HB3      PRO  20  -8.649  -5.152  -0.598
  107    HG2  PRO  20           HG3      PRO  20  -7.465  -5.486   2.104
  108    HG3  PRO  20           HG2      PRO  20  -8.519  -6.580   1.196
  109    HD2  PRO  20           HD3      PRO  20  -5.671  -6.679   1.413
  110    HD3  PRO  20           HD2      PRO  20  -6.718  -7.718   0.428
  111    H    ILE  21           H        ILE  21  -4.019  -4.547  -0.105
  112    HA   ILE  21           HA       ILE  21  -4.162  -1.947   1.235
  113    HB   ILE  21           HB       ILE  21  -2.690  -2.705   3.042
  114   HG12  ILE  21          HG13      ILE  21  -3.116  -5.488   1.927
  115   HG13  ILE  21          HG12      ILE  21  -1.618  -4.574   1.796
  116   HG21  ILE  21          HG21      ILE  21  -4.948  -2.706   3.656
  117   HG22  ILE  21          HG22      ILE  21  -4.368  -4.296   4.151
  118   HG23  ILE  21          HG23      ILE  21  -5.312  -4.122   2.668
  119   HD11  ILE  21          HD11      ILE  21  -1.524  -4.530   4.288
  120   HD12  ILE  21          HD12      ILE  21  -1.380  -6.135   3.570
  121   HD13  ILE  21          HD13      ILE  21  -2.904  -5.629   4.299
  122    H    CYS  22           H        CYS  22  -2.366  -0.673   1.005
  123    HA   CYS  22           HA       CYS  22  -0.484  -1.526  -1.046
  124    HB2  CYS  22           HB3      CYS  22  -1.641   0.764  -0.947
  125    HB3  CYS  22           HB2      CYS  22  -0.458   1.160   0.289
  126    H    THR  23           H        THR  23   1.678  -1.668  -0.790
  127    HA   THR  23           HA       THR  23   2.764  -1.480   1.939
  128    HB   THR  23           HB       THR  23   4.012  -3.602   1.541
  129    HG1  THR  23           HG1      THR  23   2.201  -4.359  -0.455
  130   HG21  THR  23          HG21      THR  23   2.232  -4.000   2.949
  131   HG22  THR  23          HG22      THR  23   1.843  -5.088   1.616
  132   HG23  THR  23          HG23      THR  23   1.036  -3.525   1.744
  133    H    ARG  24           H        ARG  24   4.670  -0.408   1.991
  134    HA   ARG  24           HA       ARG  24   6.017   0.104  -0.537
  135    HB2  ARG  24           HB3      ARG  24   7.326   1.748   0.696
  136    HB3  ARG  24           HB2      ARG  24   5.613   2.036   0.913
  137    HG2  ARG  24           HG3      ARG  24   5.666   1.469   3.135
  138    HG3  ARG  24           HG2      ARG  24   7.088   0.435   2.948
  139    HD2  ARG  24           HD3      ARG  24   7.063   3.447   2.760
  140    HD3  ARG  24           HD2      ARG  24   7.622   2.510   4.147
  141    HE   ARG  24           HE       ARG  24   9.077   1.545   2.032
  142   HH11  ARG  24          HH11      ARG  24   8.611   4.724   3.439
  143   HH12  ARG  24          HH12      ARG  24  10.188   5.280   2.997
  144   HH21  ARG  24          HH22      ARG  24  11.107   2.238   1.453
  145   HH22  ARG  24          HH21      ARG  24  11.631   3.853   1.850
  146    H    ASP  25           H        ASP  25   7.789  -0.955  -1.109
  147    HA   ASP  25           HA       ASP  25   9.513  -2.444  -1.089
  148    HB2  ASP  25           HB3      ASP  25   9.835  -1.667   1.823
  149    HB3  ASP  25           HB2      ASP  25  11.060  -2.380   0.781
  150    H    GLY  26           H        GLY  26   6.773  -3.244  -0.298
  151    HA2  GLY  26           HA3      GLY  26   5.823  -5.317   0.100
  152    HA3  GLY  26           HA2      GLY  26   7.403  -5.920   0.576
  153    H    LEU  27           H        LEU  27   6.659  -3.045   2.167
  154    HA   LEU  27           HA       LEU  27   5.804  -4.556   4.548
  155    HB2  LEU  27           HB3      LEU  27   7.344  -1.962   4.388
  156    HB3  LEU  27           HB2      LEU  27   6.842  -2.753   5.870
  157    HG   LEU  27           HG       LEU  27   8.780  -3.904   3.860
  158   HD11  LEU  27          HD11      LEU  27   9.347  -2.833   6.615
  159   HD12  LEU  27          HD12      LEU  27   9.589  -1.908   5.132
  160   HD13  LEU  27          HD13      LEU  27  10.510  -3.387   5.409
  161   HD21  LEU  27          HD21      LEU  27   8.284  -4.894   6.647
  162   HD22  LEU  27          HD22      LEU  27   9.073  -5.716   5.301
  163   HD23  LEU  27          HD23      LEU  27   7.326  -5.473   5.284
  164    HA   PRO  28           HA       PRO  28   2.054  -2.181   4.226
  165    HB2  PRO  28           HB2      PRO  28   1.344  -3.262   6.835
  166    HB3  PRO  28           HB3      PRO  28   0.636  -3.616   5.258
  167    HG2  PRO  28           HG3      PRO  28   2.110  -5.419   6.651
  168    HG3  PRO  28           HG2      PRO  28   2.039  -5.391   4.880
  169    HD2  PRO  28           HD3      PRO  28   4.160  -4.326   6.710
  170    HD3  PRO  28           HD2      PRO  28   4.334  -5.216   5.180
  171    H    VAL  29           H        VAL  29   4.098  -0.584   4.954
  172    HA   VAL  29           HA       VAL  29   3.565   0.576   7.552
  173    HB   VAL  29           HB       VAL  29   5.489   1.531   5.427
  174   HG11  VAL  29          HG11      VAL  29   6.578   2.754   7.195
  175   HG12  VAL  29          HG12      VAL  29   5.458   2.098   8.388
  176   HG13  VAL  29          HG13      VAL  29   4.874   3.204   7.145
  177   HG21  VAL  29          HG21      VAL  29   6.006  -0.760   6.101
  178   HG22  VAL  29          HG22      VAL  29   6.020  -0.263   7.793
  179   HG23  VAL  29          HG23      VAL  29   7.232   0.369   6.678
  Start of MODEL    3
    1    H1   CYS   1           H        CYS   1   3.341   0.705   4.216
    2    HA   CYS   1           HA       CYS   1   2.724   3.439   4.498
    3    HB2  CYS   1           HB3      CYS   1   1.100   1.628   2.746
    4    HB3  CYS   1           HB2      CYS   1   1.686   3.258   2.422
    5    H    GLY   2           H        GLY   2   0.901   0.491   5.116
    6    HA2  GLY   2           HA3      GLY   2  -0.842   0.117   6.579
    7    HA3  GLY   2           HA2      GLY   2  -0.758   1.806   7.047
    8    H    GLU   3           H        GLU   3  -1.112   2.866   4.420
    9    HA   GLU   3           HA       GLU   3  -3.875   3.131   4.339
   10    HB2  GLU   3           HB3      GLU   3  -3.538   4.210   2.153
   11    HB3  GLU   3           HB2      GLU   3  -2.399   4.784   3.363
   12    HG2  GLU   3           HG3      GLU   3  -0.617   3.598   2.406
   13    HG3  GLU   3           HG2      GLU   3  -1.696   2.608   1.425
   14    H    THR   4           H        THR   4  -5.489   2.218   3.233
   15    HA   THR   4           HA       THR   4  -4.983  -0.358   1.989
   16    HB   THR   4           HB       THR   4  -7.510  -0.469   1.944
   17    HG1  THR   4           HG1      THR   4  -7.619   1.955   2.096
   18   HG21  THR   4          HG21      THR   4  -5.786  -0.382   4.325
   19   HG22  THR   4          HG22      THR   4  -6.903  -1.633   3.780
   20   HG23  THR   4          HG23      THR   4  -7.511  -0.230   4.657
   21    H    CYS   5           H        CYS   5  -4.723  -0.487  -0.177
   22    HA   CYS   5           HA       CYS   5  -5.497   1.776  -1.818
   23    HB2  CYS   5           HB3      CYS   5  -4.295   0.595  -3.635
   24    HB3  CYS   5           HB2      CYS   5  -3.294   0.855  -2.212
   25    H    PHE   6           H        PHE   6  -7.758   1.053  -1.055
   26    HA   PHE   6           HA       PHE   6  -9.109  -1.129  -2.109
   27    HB2  PHE   6           HB3      PHE   6 -10.027   0.416  -0.406
   28    HB3  PHE   6           HB2      PHE   6 -10.190   1.662  -1.636
   29    HD1  PHE   6           HD1      PHE   6 -11.106  -1.955  -1.401
   30    HD2  PHE   6           HD2      PHE   6 -12.363   2.025  -2.232
   31    HE1  PHE   6           HE1      PHE   6 -13.362  -2.782  -1.934
   32    HE2  PHE   6           HE2      PHE   6 -14.620   1.205  -2.766
   33    HZ   PHE   6           HZ       PHE   6 -15.122  -1.201  -2.617
   34    H    GLY   7           H        GLY   7  -8.485   2.044  -3.542
   35    HA2  GLY   7           HA3      GLY   7  -9.825   1.233  -6.009
   36    HA3  GLY   7           HA2      GLY   7  -9.235   2.844  -5.633
   37    H    GLY   8           H        GLY   8  -7.150   0.136  -5.052
   38    HA2  GLY   8           HA3      GLY   8  -5.325  -0.693  -6.190
   39    HA3  GLY   8           HA2      GLY   8  -5.912   0.112  -7.633
   40    H    THR   9           H        THR   9  -5.918   2.753  -6.254
   41    HA   THR   9           HA       THR   9  -3.126   3.364  -6.751
   42    HB   THR   9           HB       THR   9  -5.186   5.392  -5.947
   43    HG1  THR   9           HG1      THR   9  -5.418   3.701  -8.013
   44   HG21  THR   9          HG21      THR   9  -2.518   5.479  -6.866
   45   HG22  THR   9          HG22      THR   9  -3.610   6.836  -6.584
   46   HG23  THR   9          HG23      THR   9  -3.528   6.085  -8.178
   47    H    CYS  10           H        CYS  10  -1.797   4.509  -5.311
   48    HA   CYS  10           HA       CYS  10  -2.571   4.363  -2.477
   49    HB2  CYS  10           HB3      CYS  10   0.203   3.961  -3.624
   50    HB3  CYS  10           HB2      CYS  10  -0.233   3.888  -1.920
   51    H    ASN  11           H        ASN  11  -1.814   6.021  -1.134
   52    HA   ASN  11           HA       ASN  11  -1.443   8.557  -2.515
   53    HB2  ASN  11           HB3      ASN  11  -3.104   8.377  -0.712
   54    HB3  ASN  11           HB2      ASN  11  -1.834   7.926   0.420
   55   HD21  ASN  11          HD22      ASN  11  -1.048   9.494   1.614
   56   HD22  ASN  11          HD21      ASN  11  -1.100  11.180   1.245
   57    H    THR  12           H        THR  12   0.438   6.253  -0.785
   58    HA   THR  12           HA       THR  12   2.581   8.196  -0.315
   59    HB   THR  12           HB       THR  12   2.538   5.302   0.533
   60    HG1  THR  12           HG1      THR  12   0.721   6.204   1.450
   61   HG21  THR  12          HG21      THR  12   4.162   5.947   2.143
   62   HG22  THR  12          HG22      THR  12   3.909   7.661   1.813
   63   HG23  THR  12          HG23      THR  12   4.680   6.635   0.603
   64    HA   PRO  13           HA       PRO  13   4.632   6.765  -4.021
   65    HB2  PRO  13           HB2      PRO  13   6.993   8.063  -3.538
   66    HB3  PRO  13           HB3      PRO  13   5.564   8.849  -4.217
   67    HG2  PRO  13           HG3      PRO  13   6.568   8.844  -1.400
   68    HG3  PRO  13           HG2      PRO  13   5.886  10.181  -2.345
   69    HD2  PRO  13           HD3      PRO  13   4.442   8.842  -0.501
   70    HD3  PRO  13           HD2      PRO  13   3.711   9.498  -1.980
   71    H    GLY  14           H        GLY  14   5.880   5.015  -4.436
   72    HA2  GLY  14           HA3      GLY  14   7.685   3.536  -4.077
   73    HA3  GLY  14           HA2      GLY  14   7.793   4.106  -2.417
   74    H    CYS  15           H        CYS  15   4.711   3.839  -2.472
   75    HA   CYS  15           HA       CYS  15   4.704   1.115  -1.470
   76    HB2  CYS  15           HB3      CYS  15   2.602   3.293  -1.442
   77    HB3  CYS  15           HB2      CYS  15   2.381   1.697  -0.736
   78    H    SER  16           H        SER  16   3.767  -0.568  -2.445
   79    HA   SER  16           HA       SER  16   2.508  -0.114  -5.062
   80    HB2  SER  16           HB3      SER  16   3.792  -2.652  -4.015
   81    HB3  SER  16           HB2      SER  16   3.261  -2.335  -5.667
   82    HG   SER  16           HG       SER  16   5.083  -0.546  -4.569
   83    H    CYS  17           H        CYS  17   0.467  -0.887  -5.405
   84    HA   CYS  17           HA       CYS  17  -1.112  -1.446  -3.144
   85    HB2  CYS  17           HB3      CYS  17  -2.014  -0.359  -5.156
   86    HB3  CYS  17           HB2      CYS  17  -1.820  -1.866  -6.047
   87    H    THR  18           H        THR  18  -1.548  -3.198  -2.140
   88    HA   THR  18           HA       THR  18  -1.269  -5.812  -3.450
   89    HB   THR  18           HB       THR  18  -0.570  -5.363  -0.540
   90    HG1  THR  18           HG1      THR  18   0.845  -4.547  -2.674
   91   HG21  THR  18          HG21      THR  18   0.602  -7.494  -2.263
   92   HG22  THR  18          HG22      THR  18  -1.078  -7.664  -1.753
   93   HG23  THR  18          HG23      THR  18   0.201  -7.526  -0.546
   94    H    TRP  19           H        TRP  19  -3.520  -4.869  -3.680
   95    HA   TRP  19           HA       TRP  19  -5.466  -4.255  -2.117
   96    HB2  TRP  19           HB3      TRP  19  -5.441  -5.386  -4.554
   97    HB3  TRP  19           HB2      TRP  19  -6.209  -6.680  -3.640
   98    HD1  TRP  19           HD1      TRP  19  -6.881  -3.282  -5.121
   99    HE1  TRP  19           HE1      TRP  19  -9.338  -2.628  -4.709
  100    HE3  TRP  19           HE3      TRP  19  -8.153  -6.966  -1.817
  101    HZ2  TRP  19           HZ2      TRP  19 -11.523  -3.560  -3.180
  102    HZ3  TRP  19           HZ3      TRP  19 -10.434  -7.008  -0.914
  103    HH2  TRP  19           HH2      TRP  19 -12.090  -5.341  -1.585
  104    HA   PRO  20           HA       PRO  20  -6.829  -3.931  -1.111
  105    HB2  PRO  20           HB2      PRO  20  -8.191  -3.661   1.142
  106    HB3  PRO  20           HB3      PRO  20  -8.723  -4.801  -0.096
  107    HG2  PRO  20           HG3      PRO  20  -7.394  -5.322   2.510
  108    HG3  PRO  20           HG2      PRO  20  -8.559  -6.318   1.623
  109    HD2  PRO  20           HD3      PRO  20  -5.715  -6.570   1.650
  110    HD3  PRO  20           HD2      PRO  20  -6.873  -7.497   0.676
  111    H    ILE  21           H        ILE  21  -4.046  -4.416   0.121
  112    HA   ILE  21           HA       ILE  21  -3.983  -1.901   1.623
  113    HB   ILE  21           HB       ILE  21  -2.408  -2.825   3.258
  114   HG12  ILE  21          HG13      ILE  21  -3.031  -5.515   2.012
  115   HG13  ILE  21          HG12      ILE  21  -1.510  -4.649   1.824
  116   HG21  ILE  21          HG21      ILE  21  -4.623  -2.779   4.028
  117   HG22  ILE  21          HG22      ILE  21  -4.055  -4.404   4.410
  118   HG23  ILE  21          HG23      ILE  21  -5.100  -4.141   3.011
  119   HD11  ILE  21          HD11      ILE  21  -2.245  -4.994   4.606
  120   HD12  ILE  21          HD12      ILE  21  -0.745  -5.394   3.769
  121   HD13  ILE  21          HD13      ILE  21  -2.098  -6.526   3.745
  122    H    CYS  22           H        CYS  22  -2.204  -0.653   1.272
  123    HA   CYS  22           HA       CYS  22  -0.505  -1.448  -0.951
  124    HB2  CYS  22           HB3      CYS  22  -1.607   0.869  -0.576
  125    HB3  CYS  22           HB2      CYS  22  -0.242   1.162   0.489
  126    H    THR  23           H        THR  23   1.665  -1.648  -0.883
  127    HA   THR  23           HA       THR  23   2.983  -1.618   1.749
  128    HB   THR  23           HB       THR  23   4.133  -3.744   1.160
  129    HG1  THR  23           HG1      THR  23   2.189  -4.414  -0.719
  130   HG21  THR  23          HG21      THR  23   2.449  -4.189   2.666
  131   HG22  THR  23          HG22      THR  23   1.932  -5.185   1.304
  132   HG23  THR  23          HG23      THR  23   1.183  -3.613   1.582
  133    H    ARG  24           H        ARG  24   4.931  -0.617   1.693
  134    HA   ARG  24           HA       ARG  24   6.040   0.058  -0.906
  135    HB2  ARG  24           HB3      ARG  24   7.517   1.552   0.303
  136    HB3  ARG  24           HB2      ARG  24   5.857   1.839   0.783
  137    HG2  ARG  24           HG3      ARG  24   6.186   0.842   2.886
  138    HG3  ARG  24           HG2      ARG  24   7.711   0.105   2.386
  139    HD2  ARG  24           HD3      ARG  24   7.124   2.983   3.009
  140    HD3  ARG  24           HD2      ARG  24   8.350   1.931   3.713
  141    HE   ARG  24           HE       ARG  24   8.708   3.616   1.516
  142   HH11  ARG  24          HH11      ARG  24   9.494   0.329   2.474
  143   HH12  ARG  24          HH12      ARG  24  10.769   0.167   1.301
  144   HH21  ARG  24          HH22      ARG  24  10.437   3.381   0.011
  145   HH22  ARG  24          HH21      ARG  24  11.295   1.868  -0.070
  146    H    ASP  25           H        ASP  25   7.604  -1.095  -1.788
  147    HA   ASP  25           HA       ASP  25   9.181  -2.694  -2.127
  148    HB2  ASP  25           HB3      ASP  25  10.016  -1.847   0.656
  149    HB3  ASP  25           HB2      ASP  25  10.924  -2.999  -0.314
  150    H    GLY  26           H        GLY  26   6.585  -3.419  -1.069
  151    HA2  GLY  26           HA3      GLY  26   5.571  -5.446  -0.622
  152    HA3  GLY  26           HA2      GLY  26   7.161  -6.152  -0.381
  153    H    LEU  27           H        LEU  27   6.794  -3.345   1.444
  154    HA   LEU  27           HA       LEU  27   6.183  -4.960   3.829
  155    HB2  LEU  27           HB3      LEU  27   7.741  -2.382   3.607
  156    HB3  LEU  27           HB2      LEU  27   7.413  -3.241   5.099
  157    HG   LEU  27           HG       LEU  27   9.058  -4.315   2.805
  158   HD11  LEU  27          HD11      LEU  27  10.229  -2.511   3.870
  159   HD12  LEU  27          HD12      LEU  27  10.945  -4.036   4.391
  160   HD13  LEU  27          HD13      LEU  27   9.860  -3.157   5.469
  161   HD21  LEU  27          HD21      LEU  27   9.629  -5.741   5.102
  162   HD22  LEU  27          HD22      LEU  27   8.640  -6.291   3.750
  163   HD23  LEU  27          HD23      LEU  27   7.877  -5.547   5.154
  164    HA   PRO  28           HA       PRO  28   2.463  -2.521   4.075
  165    HB2  PRO  28           HB2      PRO  28   1.533  -3.553   6.392
  166    HB3  PRO  28           HB3      PRO  28   1.489  -4.451   4.870
  167    HG2  PRO  28           HG3      PRO  28   3.436  -4.654   7.133
  168    HG3  PRO  28           HG2      PRO  28   2.682  -5.950   6.185
  169    HD2  PRO  28           HD3      PRO  28   5.216  -5.053   5.739
  170    HD3  PRO  28           HD2      PRO  28   4.187  -5.734   4.465
  171    H    VAL  29           H        VAL  29   4.625  -1.023   4.682
  172    HA   VAL  29           HA       VAL  29   4.392  -0.019   7.387
  173    HB   VAL  29           HB       VAL  29   6.121   1.022   5.138
  174   HG11  VAL  29          HG11      VAL  29   7.156   1.405   7.795
  175   HG12  VAL  29          HG12      VAL  29   5.550   2.119   7.645
  176   HG13  VAL  29          HG13      VAL  29   6.835   2.596   6.534
  177   HG21  VAL  29          HG21      VAL  29   7.537  -0.662   5.441
  178   HG22  VAL  29          HG22      VAL  29   6.324  -1.434   6.463
  179   HG23  VAL  29          HG23      VAL  29   7.556  -0.398   7.184
  Start of MODEL    4
    1    H1   CYS   1           H        CYS   1   2.935   0.825   4.260
    2    HA   CYS   1           HA       CYS   1   2.282   3.563   4.438
    3    HB2  CYS   1           HB3      CYS   1   0.778   1.734   2.612
    4    HB3  CYS   1           HB2      CYS   1   1.451   3.332   2.291
    5    H    GLY   2           H        GLY   2   0.409   0.614   4.932
    6    HA2  GLY   2           HA3      GLY   2  -1.437   0.254   6.267
    7    HA3  GLY   2           HA2      GLY   2  -1.381   1.944   6.732
    8    H    GLU   3           H        GLU   3  -1.536   2.986   4.069
    9    HA   GLU   3           HA       GLU   3  -4.276   3.285   3.793
   10    HB2  GLU   3           HB3      GLU   3  -3.775   4.284   1.585
   11    HB3  GLU   3           HB2      GLU   3  -2.747   4.901   2.871
   12    HG2  GLU   3           HG3      GLU   3  -0.895   3.624   2.119
   13    HG3  GLU   3           HG2      GLU   3  -1.903   2.706   1.001
   14    H    THR   4           H        THR   4  -5.846   2.327   2.681
   15    HA   THR   4           HA       THR   4  -5.300  -0.274   1.506
   16    HB   THR   4           HB       THR   4  -7.830  -0.376   1.383
   17    HG1  THR   4           HG1      THR   4  -7.974   2.027   1.490
   18   HG21  THR   4          HG21      THR   4  -7.903  -0.121   4.089
   19   HG22  THR   4          HG22      THR   4  -6.168  -0.268   3.810
   20   HG23  THR   4          HG23      THR   4  -7.262  -1.528   3.240
   21    H    CYS   5           H        CYS   5  -4.841  -0.365  -0.616
   22    HA   CYS   5           HA       CYS   5  -5.674   1.798  -2.356
   23    HB2  CYS   5           HB3      CYS   5  -4.222   0.749  -4.034
   24    HB3  CYS   5           HB2      CYS   5  -3.372   1.030  -2.520
   25    H    PHE   6           H        PHE   6  -7.954   0.811  -1.746
   26    HA   PHE   6           HA       PHE   6  -8.913  -1.473  -3.034
   27    HB2  PHE   6           HB3      PHE   6 -10.209   1.043  -2.062
   28    HB3  PHE   6           HB2      PHE   6 -11.148  -0.088  -3.029
   29    HD1  PHE   6           HD2      PHE   6  -8.625  -0.568  -0.312
   30    HD2  PHE   6           HD1      PHE   6 -12.599  -1.225  -1.683
   31    HE1  PHE   6           HE2      PHE   6  -9.096  -1.907   1.698
   32    HE2  PHE   6           HE1      PHE   6 -13.076  -2.563   0.325
   33    HZ   PHE   6           HZ       PHE   6 -11.322  -2.907   2.018
   34    H    GLY   7           H        GLY   7  -8.526   1.822  -4.230
   35    HA2  GLY   7           HA3      GLY   7  -9.725   1.122  -6.791
   36    HA3  GLY   7           HA2      GLY   7  -9.139   2.708  -6.314
   37    H    GLY   8           H        GLY   8  -7.000   0.096  -5.711
   38    HA2  GLY   8           HA3      GLY   8  -5.013  -0.540  -6.659
   39    HA3  GLY   8           HA2      GLY   8  -5.739  -0.153  -8.209
   40    H    THR   9           H        THR   9  -5.089   2.041  -5.514
   41    HA   THR   9           HA       THR   9  -2.858   3.249  -6.938
   42    HB   THR   9           HB       THR   9  -5.077   5.060  -6.022
   43    HG1  THR   9           HG1      THR   9  -5.075   3.426  -8.229
   44   HG21  THR   9          HG21      THR   9  -2.605   5.304  -7.671
   45   HG22  THR   9          HG22      THR   9  -3.222   6.363  -6.403
   46   HG23  THR   9          HG23      THR   9  -3.961   6.382  -8.004
   47    H    CYS  10           H        CYS  10  -1.558   4.555  -5.570
   48    HA   CYS  10           HA       CYS  10  -2.239   4.446  -2.714
   49    HB2  CYS  10           HB3      CYS  10   0.517   3.967  -3.867
   50    HB3  CYS  10           HB2      CYS  10   0.071   3.914  -2.165
   51    H    ASN  11           H        ASN  11  -1.630   6.169  -1.489
   52    HA   ASN  11           HA       ASN  11  -1.046   8.618  -2.953
   53    HB2  ASN  11           HB3      ASN  11  -2.882   8.572  -1.312
   54    HB3  ASN  11           HB2      ASN  11  -1.740   8.154  -0.041
   55   HD21  ASN  11          HD22      ASN  11  -1.057   9.768   1.150
   56   HD22  ASN  11          HD21      ASN  11  -1.014  11.431   0.689
   57    H    THR  12           H        THR  12   0.586   6.318  -1.013
   58    HA   THR  12           HA       THR  12   2.739   8.201  -0.366
   59    HB   THR  12           HB       THR  12   2.532   5.323   0.510
   60    HG1  THR  12           HG1      THR  12   0.664   6.255   1.257
   61   HG21  THR  12          HG21      THR  12   3.833   7.663   1.892
   62   HG22  THR  12          HG22      THR  12   4.692   6.610   0.769
   63   HG23  THR  12          HG23      THR  12   4.016   5.947   2.256
   64    HA   PRO  13           HA       PRO  13   5.064   6.643  -3.854
   65    HB2  PRO  13           HB2      PRO  13   7.413   7.879  -3.191
   66    HB3  PRO  13           HB3      PRO  13   6.070   8.699  -3.994
   67    HG2  PRO  13           HG3      PRO  13   6.835   8.699  -1.104
   68    HG3  PRO  13           HG2      PRO  13   6.279  10.045  -2.117
   69    HD2  PRO  13           HD3      PRO  13   4.644   8.774  -0.385
   70    HD3  PRO  13           HD2      PRO  13   4.061   9.438  -1.925
   71    H    GLY  14           H        GLY  14   6.351   4.884  -4.152
   72    HA2  GLY  14           HA3      GLY  14   8.055   3.352  -3.608
   73    HA3  GLY  14           HA2      GLY  14   8.022   3.937  -1.949
   74    H    CYS  15           H        CYS  15   4.962   3.756  -2.264
   75    HA   CYS  15           HA       CYS  15   4.777   1.051  -1.240
   76    HB2  CYS  15           HB3      CYS  15   2.766   3.300  -1.444
   77    HB3  CYS  15           HB2      CYS  15   2.405   1.721  -0.759
   78    H    SER  16           H        SER  16   3.865  -0.619  -2.252
   79    HA   SER  16           HA       SER  16   2.877  -0.197  -4.988
   80    HB2  SER  16           HB3      SER  16   3.948  -2.754  -3.763
   81    HB3  SER  16           HB2      SER  16   3.608  -2.450  -5.467
   82    HG   SER  16           HG       SER  16   5.356  -0.679  -4.263
   83    H    CYS  17           H        CYS  17   0.841  -0.896  -5.495
   84    HA   CYS  17           HA       CYS  17  -0.921  -1.402  -3.335
   85    HB2  CYS  17           HB3      CYS  17  -1.651  -0.176  -5.323
   86    HB3  CYS  17           HB2      CYS  17  -1.445  -1.629  -6.296
   87    H    THR  18           H        THR  18  -1.366  -3.179  -2.388
   88    HA   THR  18           HA       THR  18  -1.262  -5.721  -3.843
   89    HB   THR  18           HB       THR  18  -0.596  -6.697  -1.504
   90    HG1  THR  18           HG1      THR  18  -0.722  -4.434  -0.610
   91   HG21  THR  18          HG21      THR  18   1.041  -5.578  -3.672
   92   HG22  THR  18          HG22      THR  18   1.062  -7.185  -2.948
   93   HG23  THR  18          HG23      THR  18   1.909  -5.853  -2.160
   94    H    TRP  19           H        TRP  19  -3.474  -5.031  -4.085
   95    HA   TRP  19           HA       TRP  19  -5.432  -4.337  -2.526
   96    HB2  TRP  19           HB3      TRP  19  -5.358  -5.648  -4.905
   97    HB3  TRP  19           HB2      TRP  19  -6.187  -6.830  -3.896
   98    HD1  TRP  19           HD1      TRP  19  -6.664  -3.437  -5.534
   99    HE1  TRP  19           HE1      TRP  19  -9.116  -2.701  -5.260
  100    HE3  TRP  19           HE3      TRP  19  -8.228  -7.054  -2.281
  101    HZ2  TRP  19           HZ2      TRP  19 -11.408  -3.545  -3.837
  102    HZ3  TRP  19           HZ3      TRP  19 -10.554  -7.010  -1.496
  103    HH2  TRP  19           HH2      TRP  19 -12.117  -5.295  -2.264
  104    HA   PRO  20           HA       PRO  20  -6.893  -4.067  -1.596
  105    HB2  PRO  20           HB2      PRO  20  -8.324  -3.764   0.619
  106    HB3  PRO  20           HB3      PRO  20  -8.760  -4.986  -0.581
  107    HG2  PRO  20           HG3      PRO  20  -7.495  -5.319   2.083
  108    HG3  PRO  20           HG2      PRO  20  -8.551  -6.428   1.191
  109    HD2  PRO  20           HD3      PRO  20  -5.694  -6.465   1.338
  110    HD3  PRO  20           HD2      PRO  20  -6.746  -7.529   0.383
  111    H    ILE  21           H        ILE  21  -4.131  -4.355  -0.144
  112    HA   ILE  21           HA       ILE  21  -4.273  -1.698   1.069
  113    HB   ILE  21           HB       ILE  21  -2.948  -2.280   2.980
  114   HG12  ILE  21          HG13      ILE  21  -1.662  -4.137   1.801
  115   HG13  ILE  21          HG12      ILE  21  -2.076  -4.424   3.485
  116   HG21  ILE  21          HG21      ILE  21  -5.422  -3.880   2.521
  117   HG22  ILE  21          HG22      ILE  21  -5.143  -2.510   3.600
  118   HG23  ILE  21          HG23      ILE  21  -4.508  -4.103   4.016
  119   HD11  ILE  21          HD11      ILE  21  -3.449  -5.583   1.072
  120   HD12  ILE  21          HD12      ILE  21  -3.970  -5.819   2.740
  121   HD13  ILE  21          HD13      ILE  21  -2.403  -6.431   2.211
  122    H    CYS  22           H        CYS  22  -2.368  -0.516   0.991
  123    HA   CYS  22           HA       CYS  22  -0.542  -1.379  -1.108
  124    HB2  CYS  22           HB3      CYS  22  -1.599   0.970  -0.871
  125    HB3  CYS  22           HB2      CYS  22  -0.337   1.246   0.319
  126    H    THR  23           H        THR  23   1.610  -1.627  -0.868
  127    HA   THR  23           HA       THR  23   2.724  -1.577   1.853
  128    HB   THR  23           HB       THR  23   3.870  -3.777   1.301
  129    HG1  THR  23           HG1      THR  23   1.757  -4.329  -0.468
  130   HG21  THR  23          HG21      THR  23   1.693  -5.122   1.706
  131   HG22  THR  23          HG22      THR  23   0.922  -3.538   1.799
  132   HG23  THR  23          HG23      THR  23   2.210  -3.960   2.927
  133    H    ARG  24           H        ARG  24   4.687  -0.619   1.902
  134    HA   ARG  24           HA       ARG  24   6.023  -0.109  -0.630
  135    HB2  ARG  24           HB3      ARG  24   7.428   1.429   0.605
  136    HB3  ARG  24           HB2      ARG  24   5.746   1.771   0.945
  137    HG2  ARG  24           HG3      ARG  24   5.937   1.218   3.128
  138    HG3  ARG  24           HG2      ARG  24   7.139  -0.039   2.820
  139    HD2  ARG  24           HD3      ARG  24   7.616   2.940   2.783
  140    HD3  ARG  24           HD2      ARG  24   8.140   1.815   4.036
  141    HE   ARG  24           HE       ARG  24   9.143   0.955   1.540
  142   HH11  ARG  24          HH11      ARG  24   9.624   3.528   3.875
  143   HH12  ARG  24          HH12      ARG  24  11.282   3.771   3.444
  144   HH21  ARG  24          HH22      ARG  24  11.286   1.252   0.972
  145   HH22  ARG  24          HH21      ARG  24  12.243   2.464   1.776
  146    H    ASP  25           H        ASP  25   7.733  -1.237  -1.281
  147    HA   ASP  25           HA       ASP  25   9.369  -2.822  -1.359
  148    HB2  ASP  25           HB3      ASP  25   9.788  -2.180   1.575
  149    HB3  ASP  25           HB2      ASP  25  10.947  -2.934   0.491
  150    H    GLY  26           H        GLY  26   6.611  -3.507  -0.553
  151    HA2  GLY  26           HA3      GLY  26   5.536  -5.522  -0.188
  152    HA3  GLY  26           HA2      GLY  26   7.092  -6.246   0.190
  153    H    LEU  27           H        LEU  27   6.493  -3.384   1.910
  154    HA   LEU  27           HA       LEU  27   5.709  -4.952   4.278
  155    HB2  LEU  27           HB3      LEU  27   7.334  -2.409   4.137
  156    HB3  LEU  27           HB2      LEU  27   6.868  -3.232   5.614
  157    HG   LEU  27           HG       LEU  27   8.673  -4.384   3.484
  158   HD11  LEU  27          HD11      LEU  27  10.046  -4.107   5.893
  159   HD12  LEU  27          HD12      LEU  27   9.181  -2.585   5.674
  160   HD13  LEU  27          HD13      LEU  27  10.276  -3.166   4.419
  161   HD21  LEU  27          HD21      LEU  27   8.389  -6.348   4.474
  162   HD22  LEU  27          HD22      LEU  27   7.185  -5.631   5.545
  163   HD23  LEU  27          HD23      LEU  27   8.883  -5.658   6.020
  164    HA   PRO  28           HA       PRO  28   2.041  -2.439   4.231
  165    HB2  PRO  28           HB2      PRO  28   0.965  -3.340   6.537
  166    HB3  PRO  28           HB3      PRO  28   1.003  -4.319   5.065
  167    HG2  PRO  28           HG3      PRO  28   2.808  -4.414   7.451
  168    HG3  PRO  28           HG2      PRO  28   2.099  -5.753   6.529
  169    HD2  PRO  28           HD3      PRO  28   4.665  -4.894   6.192
  170    HD3  PRO  28           HD2      PRO  28   3.711  -5.648   4.900
  171    H    VAL  29           H        VAL  29   4.163  -0.911   4.867
  172    HA   VAL  29           HA       VAL  29   3.813   0.209   7.513
  173    HB   VAL  29           HB       VAL  29   5.635   1.158   5.298
  174   HG11  VAL  29          HG11      VAL  29   6.286   2.793   6.654
  175   HG12  VAL  29          HG12      VAL  29   6.555   1.659   7.978
  176   HG13  VAL  29          HG13      VAL  29   4.956   2.360   7.729
  177   HG21  VAL  29          HG21      VAL  29   6.715  -0.338   7.610
  178   HG22  VAL  29          HG22      VAL  29   7.244  -0.309   5.928
  179   HG23  VAL  29          HG23      VAL  29   5.840  -1.269   6.395
  Start of MODEL    5
    1    H1   CYS   1           H        CYS   1   3.452   1.099   4.043
    2    HA   CYS   1           HA       CYS   1   2.782   3.836   4.237
    3    HB2  CYS   1           HB3      CYS   1   1.000   2.059   2.672
    4    HB3  CYS   1           HB2      CYS   1   1.820   3.542   2.187
    5    H    GLY   2           H        GLY   2   1.067   0.863   5.035
    6    HA2  GLY   2           HA3      GLY   2  -0.752   0.437   6.360
    7    HA3  GLY   2           HA2      GLY   2  -0.389   1.960   7.157
    8    H    GLU   3           H        GLU   3  -1.290   1.490   3.775
    9    HA   GLU   3           HA       GLU   3  -3.819   2.870   4.346
   10    HB2  GLU   3           HB3      GLU   3  -3.595   4.131   2.271
   11    HB3  GLU   3           HB2      GLU   3  -2.233   4.448   3.335
   12    HG2  GLU   3           HG3      GLU   3  -0.791   3.083   2.031
   13    HG3  GLU   3           HG2      GLU   3  -2.141   2.462   1.082
   14    H    THR   4           H        THR   4  -5.591   2.234   3.200
   15    HA   THR   4           HA       THR   4  -5.386  -0.351   1.891
   16    HB   THR   4           HB       THR   4  -7.923  -0.162   1.888
   17    HG1  THR   4           HG1      THR   4  -7.851   2.200   2.135
   18   HG21  THR   4          HG21      THR   4  -6.114  -0.502   4.154
   19   HG22  THR   4          HG22      THR   4  -7.491  -1.483   3.650
   20   HG23  THR   4          HG23      THR   4  -7.747  -0.043   4.636
   21    H    CYS   5           H        CYS   5  -4.950  -0.332  -0.237
   22    HA   CYS   5           HA       CYS   5  -5.720   1.948  -1.854
   23    HB2  CYS   5           HB3      CYS   5  -4.414   0.816  -3.644
   24    HB3  CYS   5           HB2      CYS   5  -3.484   1.117  -2.180
   25    H    PHE   6           H        PHE   6  -8.029   1.077  -1.215
   26    HA   PHE   6           HA       PHE   6  -9.150  -1.109  -2.545
   27    HB2  PHE   6           HB3      PHE   6 -10.280   1.444  -1.457
   28    HB3  PHE   6           HB2      PHE   6 -11.306   0.387  -2.421
   29    HD1  PHE   6           HD2      PHE   6  -8.709  -0.358   0.158
   30    HD2  PHE   6           HD1      PHE   6 -12.788  -0.646  -1.015
   31    HE1  PHE   6           HE2      PHE   6  -9.183  -1.724   2.149
   32    HE2  PHE   6           HE1      PHE   6 -13.269  -2.011   0.974
   33    HZ   PHE   6           HZ       PHE   6 -11.465  -2.553   2.558
   34    H    GLY   7           H        GLY   7  -8.552   2.179  -3.629
   35    HA2  GLY   7           HA3      GLY   7  -9.881   1.700  -6.172
   36    HA3  GLY   7           HA2      GLY   7  -9.125   3.200  -5.657
   37    H    GLY   8           H        GLY   8  -7.223   0.384  -5.208
   38    HA2  GLY   8           HA3      GLY   8  -5.475  -0.538  -6.399
   39    HA3  GLY   8           HA2      GLY   8  -6.033   0.328  -7.818
   40    H    THR   9           H        THR   9  -5.889   2.931  -6.410
   41    HA   THR   9           HA       THR   9  -3.070   3.406  -6.898
   42    HB   THR   9           HB       THR   9  -5.028   5.527  -6.078
   43    HG1  THR   9           HG1      THR   9  -5.323   3.877  -8.174
   44   HG21  THR   9          HG21      THR   9  -3.539   6.985  -6.964
   45   HG22  THR   9          HG22      THR   9  -3.109   5.902  -8.289
   46   HG23  THR   9          HG23      THR   9  -2.400   5.666  -6.692
   47    H    CYS  10           H        CYS  10  -1.689   4.458  -5.437
   48    HA   CYS  10           HA       CYS  10  -2.473   4.255  -2.609
   49    HB2  CYS  10           HB3      CYS  10   0.283   3.875  -3.804
   50    HB3  CYS  10           HB2      CYS  10  -0.114   3.786  -2.092
   51    H    ASN  11           H        ASN  11  -1.759   5.865  -1.216
   52    HA   ASN  11           HA       ASN  11  -1.339   8.445  -2.495
   53    HB2  ASN  11           HB3      ASN  11  -1.841   7.674   0.389
   54    HB3  ASN  11           HB2      ASN  11  -1.716   9.330  -0.198
   55   HD21  ASN  11          HD22      ASN  11  -3.700   6.575   0.151
   56   HD22  ASN  11          HD21      ASN  11  -5.130   7.242  -0.560
   57    H    THR  12           H        THR  12   0.480   6.034  -0.898
   58    HA   THR  12           HA       THR  12   2.643   7.911  -0.262
   59    HB   THR  12           HB       THR  12   2.623   4.971   0.388
   60    HG1  THR  12           HG1      THR  12   0.701   5.794   1.249
   61   HG21  THR  12          HG21      THR  12   4.344   5.430   1.795
   62   HG22  THR  12          HG22      THR  12   3.725   7.030   2.206
   63   HG23  THR  12          HG23      THR  12   4.584   6.779   0.686
   64    HA   PRO  13           HA       PRO  13   4.681   6.672  -4.044
   65    HB2  PRO  13           HB2      PRO  13   7.071   7.881  -3.491
   66    HB3  PRO  13           HB3      PRO  13   5.655   8.744  -4.101
   67    HG2  PRO  13           HG3      PRO  13   6.676   8.518  -1.299
   68    HG3  PRO  13           HG2      PRO  13   6.025   9.935  -2.144
   69    HD2  PRO  13           HD3      PRO  13   4.556   8.506  -0.388
   70    HD3  PRO  13           HD2      PRO  13   3.835   9.286  -1.809
   71    H    GLY  14           H        GLY  14   5.886   4.929  -4.584
   72    HA2  GLY  14           HA3      GLY  14   7.613   3.355  -4.371
   73    HA3  GLY  14           HA2      GLY  14   7.843   3.864  -2.703
   74    H    CYS  15           H        CYS  15   4.716   3.655  -2.671
   75    HA   CYS  15           HA       CYS  15   4.718   0.941  -1.651
   76    HB2  CYS  15           HB3      CYS  15   2.631   3.128  -1.614
   77    HB3  CYS  15           HB2      CYS  15   2.407   1.537  -0.893
   78    H    SER  16           H        SER  16   3.703  -0.746  -2.529
   79    HA   SER  16           HA       SER  16   2.469  -0.375  -5.166
   80    HB2  SER  16           HB3      SER  16   3.593  -2.929  -3.992
   81    HB3  SER  16           HB2      SER  16   3.154  -2.624  -5.674
   82    HG   SER  16           HG       SER  16   4.940  -0.798  -4.781
   83    H    CYS  17           H        CYS  17   0.392  -1.053  -5.472
   84    HA   CYS  17           HA       CYS  17  -1.172  -1.511  -3.152
   85    HB2  CYS  17           HB3      CYS  17  -2.037  -0.271  -5.087
   86    HB3  CYS  17           HB2      CYS  17  -1.983  -1.746  -6.047
   87    H    THR  18           H        THR  18  -1.541  -3.272  -2.163
   88    HA   THR  18           HA       THR  18  -1.533  -5.841  -3.592
   89    HB   THR  18           HB       THR  18  -0.786  -5.507  -0.674
   90    HG1  THR  18           HG1      THR  18   1.248  -5.149  -1.236
   91   HG21  THR  18          HG21      THR  18  -0.903  -7.736  -0.708
   92   HG22  THR  18          HG22      THR  18   0.458  -7.740  -1.830
   93   HG23  THR  18          HG23      THR  18  -1.195  -7.743  -2.447
   94    H    TRP  19           H        TRP  19  -3.727  -4.842  -3.827
   95    HA   TRP  19           HA       TRP  19  -5.650  -4.134  -2.257
   96    HB2  TRP  19           HB3      TRP  19  -5.665  -5.260  -4.708
   97    HB3  TRP  19           HB2      TRP  19  -6.527  -6.498  -3.798
   98    HD1  TRP  19           HD1      TRP  19  -6.947  -3.050  -5.266
   99    HE1  TRP  19           HE1      TRP  19  -9.357  -2.229  -4.873
  100    HE3  TRP  19           HE3      TRP  19  -8.513  -6.671  -2.020
  101    HZ2  TRP  19           HZ2      TRP  19 -11.617  -3.016  -3.374
  102    HZ3  TRP  19           HZ3      TRP  19 -10.799  -6.558  -1.138
  103    HH2  TRP  19           HH2      TRP  19 -12.326  -4.770  -1.806
  104    HA   PRO  20           HA       PRO  20  -7.023  -3.767  -1.260
  105    HB2  PRO  20           HB2      PRO  20  -8.378  -3.463   0.998
  106    HB3  PRO  20           HB3      PRO  20  -8.958  -4.560  -0.258
  107    HG2  PRO  20           HG3      PRO  20  -7.669  -5.180   2.345
  108    HG3  PRO  20           HG2      PRO  20  -8.868  -6.111   1.432
  109    HD2  PRO  20           HD3      PRO  20  -6.037  -6.484   1.476
  110    HD3  PRO  20           HD2      PRO  20  -7.226  -7.347   0.482
  111    H    ILE  21           H        ILE  21  -4.275  -4.395  -0.008
  112    HA   ILE  21           HA       ILE  21  -4.124  -1.900   1.524
  113    HB   ILE  21           HB       ILE  21  -2.583  -2.920   3.147
  114   HG12  ILE  21          HG13      ILE  21  -3.365  -5.554   1.872
  115   HG13  ILE  21          HG12      ILE  21  -1.793  -4.782   1.702
  116   HG21  ILE  21          HG21      ILE  21  -4.327  -4.413   4.277
  117   HG22  ILE  21          HG22      ILE  21  -5.352  -4.057   2.885
  118   HG23  ILE  21          HG23      ILE  21  -4.787  -2.747   3.924
  119   HD11  ILE  21          HD11      ILE  21  -2.781  -5.314   4.444
  120   HD12  ILE  21          HD12      ILE  21  -1.139  -5.344   3.802
  121   HD13  ILE  21          HD13      ILE  21  -2.239  -6.683   3.473
  122    H    CYS  22           H        CYS  22  -2.392  -0.671   1.109
  123    HA   CYS  22           HA       CYS  22  -0.624  -1.523  -1.038
  124    HB2  CYS  22           HB3      CYS  22  -1.739   0.784  -0.824
  125    HB3  CYS  22           HB2      CYS  22  -0.478   1.133   0.349
  126    H    THR  23           H        THR  23   1.539  -1.671  -0.913
  127    HA   THR  23           HA       THR  23   2.853  -1.485   1.704
  128    HB   THR  23           HB       THR  23   3.949  -3.752   1.151
  129    HG1  THR  23           HG1      THR  23   2.587  -3.575  -1.002
  130   HG21  THR  23          HG21      THR  23   2.494  -4.834   2.559
  131   HG22  THR  23          HG22      THR  23   1.064  -4.175   1.762
  132   HG23  THR  23          HG23      THR  23   2.010  -3.164   2.854
  133    H    ARG  24           H        ARG  24   4.861  -0.607   1.506
  134    HA   ARG  24           HA       ARG  24   5.936  -0.298  -1.183
  135    HB2  ARG  24           HB3      ARG  24   7.473   1.299  -0.217
  136    HB3  ARG  24           HB2      ARG  24   5.840   1.694   0.273
  137    HG2  ARG  24           HG3      ARG  24   6.252   1.275   2.460
  138    HG3  ARG  24           HG2      ARG  24   7.432   0.007   2.110
  139    HD2  ARG  24           HD3      ARG  24   7.862   2.979   1.814
  140    HD3  ARG  24           HD2      ARG  24   8.529   1.951   3.084
  141    HE   ARG  24           HE       ARG  24   9.286   0.895   0.588
  142   HH11  ARG  24          HH11      ARG  24   9.934   3.717   2.569
  143   HH12  ARG  24          HH12      ARG  24  11.526   3.944   1.933
  144   HH21  ARG  24          HH22      ARG  24  11.342   1.168  -0.242
  145   HH22  ARG  24          HH21      ARG  24  12.341   2.480   0.316
  146    H    ASP  25           H        ASP  25   7.581  -1.476  -1.918
  147    HA   ASP  25           HA       ASP  25   9.185  -3.092  -2.042
  148    HB2  ASP  25           HB3      ASP  25   9.893  -2.259   0.787
  149    HB3  ASP  25           HB2      ASP  25  10.937  -3.093  -0.355
  150    H    GLY  26           H        GLY  26   6.519  -3.682  -0.943
  151    HA2  GLY  26           HA3      GLY  26   5.448  -5.626  -0.306
  152    HA3  GLY  26           HA2      GLY  26   7.023  -6.371  -0.069
  153    H    LEU  27           H        LEU  27   6.665  -3.388   1.516
  154    HA   LEU  27           HA       LEU  27   6.173  -4.781   4.063
  155    HB2  LEU  27           HB3      LEU  27   7.771  -2.271   3.548
  156    HB3  LEU  27           HB2      LEU  27   7.494  -2.990   5.123
  157    HG   LEU  27           HG       LEU  27   9.013  -4.302   2.866
  158   HD11  LEU  27          HD11      LEU  27  10.924  -3.453   3.673
  159   HD12  LEU  27          HD12      LEU  27  10.397  -3.590   5.350
  160   HD13  LEU  27          HD13      LEU  27   9.879  -2.217   4.372
  161   HD21  LEU  27          HD21      LEU  27   9.273  -6.142   4.164
  162   HD22  LEU  27          HD22      LEU  27   7.721  -5.607   4.807
  163   HD23  LEU  27          HD23      LEU  27   9.211  -5.225   5.670
  164    HA   PRO  28           HA       PRO  28   2.562  -2.206   4.348
  165    HB2  PRO  28           HB2      PRO  28   1.793  -2.937   6.822
  166    HB3  PRO  28           HB3      PRO  28   1.651  -4.027   5.438
  167    HG2  PRO  28           HG3      PRO  28   3.736  -3.948   7.582
  168    HG3  PRO  28           HG2      PRO  28   2.930  -5.350   6.855
  169    HD2  PRO  28           HD3      PRO  28   5.432  -4.500   6.147
  170    HD3  PRO  28           HD2      PRO  28   4.347  -5.382   5.056
  171    H    VAL  29           H        VAL  29   4.733  -0.649   4.566
  172    HA   VAL  29           HA       VAL  29   4.806   0.620   7.163
  173    HB   VAL  29           HB       VAL  29   6.229   1.437   4.627
  174   HG11  VAL  29          HG11      VAL  29   6.309   2.398   7.438
  175   HG12  VAL  29          HG12      VAL  29   6.453   3.298   5.927
  176   HG13  VAL  29          HG13      VAL  29   7.820   2.359   6.528
  177   HG21  VAL  29          HG21      VAL  29   7.813  -0.100   4.983
  178   HG22  VAL  29          HG22      VAL  29   6.626  -0.895   6.018
  179   HG23  VAL  29          HG23      VAL  29   7.827   0.189   6.723
  Start of MODEL    6
    1    H1   CYS   1           H        CYS   1   3.265   0.681   4.294
    2    HA   CYS   1           HA       CYS   1   2.577   3.409   4.534
    3    HB2  CYS   1           HB3      CYS   1   1.042   1.530   2.774
    4    HB3  CYS   1           HB2      CYS   1   1.581   3.175   2.443
    5    H    GLY   2           H        GLY   2   0.802   0.414   5.097
    6    HA2  GLY   2           HA3      GLY   2  -0.958  -0.009   6.525
    7    HA3  GLY   2           HA2      GLY   2  -0.907   1.674   7.021
    8    H    GLU   3           H        GLU   3  -1.242   2.774   4.411
    9    HA   GLU   3           HA       GLU   3  -4.008   2.987   4.292
   10    HB2  GLU   3           HB3      GLU   3  -3.649   4.103   2.114
   11    HB3  GLU   3           HB2      GLU   3  -2.584   4.702   3.378
   12    HG2  GLU   3           HG3      GLU   3  -0.716   3.627   2.474
   13    HG3  GLU   3           HG2      GLU   3  -1.704   2.577   1.459
   14    H    THR   4           H        THR   4  -5.589   2.059   3.158
   15    HA   THR   4           HA       THR   4  -5.009  -0.470   1.848
   16    HB   THR   4           HB       THR   4  -7.535  -0.636   1.773
   17    HG1  THR   4           HG1      THR   4  -7.716   1.769   1.997
   18   HG21  THR   4          HG21      THR   4  -6.007  -1.498   3.648
   19   HG22  THR   4          HG22      THR   4  -7.724  -1.326   4.011
   20   HG23  THR   4          HG23      THR   4  -6.577  -0.110   4.574
   21    H    CYS   5           H        CYS   5  -4.717  -0.526  -0.311
   22    HA   CYS   5           HA       CYS   5  -5.545   1.748  -1.910
   23    HB2  CYS   5           HB3      CYS   5  -4.287   0.623  -3.739
   24    HB3  CYS   5           HB2      CYS   5  -3.311   0.938  -2.309
   25    H    PHE   6           H        PHE   6  -7.791   0.963  -1.225
   26    HA   PHE   6           HA       PHE   6  -9.058  -1.248  -2.314
   27    HB2  PHE   6           HB3      PHE   6 -10.061   0.264  -0.634
   28    HB3  PHE   6           HB2      PHE   6 -10.223   1.511  -1.865
   29    HD1  PHE   6           HD1      PHE   6 -11.044  -2.131  -1.694
   30    HD2  PHE   6           HD2      PHE   6 -12.396   1.823  -2.492
   31    HE1  PHE   6           HE1      PHE   6 -13.262  -3.014  -2.290
   32    HE2  PHE   6           HE2      PHE   6 -14.616   0.949  -3.088
   33    HZ   PHE   6           HZ       PHE   6 -15.052  -1.473  -2.988
   34    H    GLY   7           H        GLY   7  -8.509   1.947  -3.741
   35    HA2  GLY   7           HA3      GLY   7  -9.778   1.094  -6.229
   36    HA3  GLY   7           HA2      GLY   7  -9.222   2.717  -5.851
   37    H    GLY   8           H        GLY   8  -7.073   0.087  -5.200
   38    HA2  GLY   8           HA3      GLY   8  -5.223  -0.723  -6.317
   39    HA3  GLY   8           HA2      GLY   8  -5.804   0.064  -7.773
   40    H    THR   9           H        THR   9  -5.910   2.702  -6.424
   41    HA   THR   9           HA       THR   9  -3.132   3.392  -6.849
   42    HB   THR   9           HB       THR   9  -4.590   5.690  -6.154
   43    HG1  THR   9           HG1      THR   9  -6.073   4.039  -7.952
   44   HG21  THR   9          HG21      THR   9  -2.959   4.793  -8.203
   45   HG22  THR   9          HG22      THR   9  -3.675   6.399  -8.073
   46   HG23  THR   9          HG23      THR   9  -4.487   5.146  -9.009
   47    H    CYS  10           H        CYS  10  -1.787   4.346  -5.374
   48    HA   CYS  10           HA       CYS  10  -2.663   4.268  -2.568
   49    HB2  CYS  10           HB3      CYS  10   0.148   4.028  -3.671
   50    HB3  CYS  10           HB2      CYS  10  -0.302   3.943  -1.971
   51    H    ASN  11           H        ASN  11  -1.974   5.941  -1.182
   52    HA   ASN  11           HA       ASN  11  -1.763   8.517  -2.521
   53    HB2  ASN  11           HB3      ASN  11  -3.388   8.230  -0.704
   54    HB3  ASN  11           HB2      ASN  11  -2.090   7.801   0.403
   55   HD21  ASN  11          HD22      ASN  11  -1.325   9.365   1.619
   56   HD22  ASN  11          HD21      ASN  11  -1.463  11.057   1.304
   57    H    THR  12           H        THR  12   0.229   6.309  -0.763
   58    HA   THR  12           HA       THR  12   2.301   8.344  -0.368
   59    HB   THR  12           HB       THR  12   2.345   5.481   0.582
   60    HG1  THR  12           HG1      THR  12   0.532   6.355   1.506
   61   HG21  THR  12          HG21      THR  12   3.676   7.897   1.789
   62   HG22  THR  12          HG22      THR  12   4.454   6.895   0.563
   63   HG23  THR  12          HG23      THR  12   3.997   6.194   2.115
   64    HA   PRO  13           HA       PRO  13   4.381   6.831  -4.030
   65    HB2  PRO  13           HB2      PRO  13   6.672   8.274  -3.654
   66    HB3  PRO  13           HB3      PRO  13   5.193   8.955  -4.338
   67    HG2  PRO  13           HG3      PRO  13   6.245   9.132  -1.545
   68    HG3  PRO  13           HG2      PRO  13   5.481  10.388  -2.537
   69    HD2  PRO  13           HD3      PRO  13   4.142   9.058  -0.603
   70    HD3  PRO  13           HD2      PRO  13   3.351   9.622  -2.088
   71    H    GLY  14           H        GLY  14   5.789   5.172  -4.390
   72    HA2  GLY  14           HA3      GLY  14   7.692   3.841  -3.937
   73    HA3  GLY  14           HA2      GLY  14   7.686   4.441  -2.283
   74    H    CYS  15           H        CYS  15   4.673   3.985  -2.349
   75    HA   CYS  15           HA       CYS  15   4.796   1.253  -1.380
   76    HB2  CYS  15           HB3      CYS  15   2.622   3.354  -1.327
   77    HB3  CYS  15           HB2      CYS  15   2.421   1.729  -0.685
   78    H    SER  16           H        SER  16   3.919  -0.463  -2.357
   79    HA   SER  16           HA       SER  16   2.713  -0.060  -5.004
   80    HB2  SER  16           HB3      SER  16   3.951  -2.590  -3.892
   81    HB3  SER  16           HB2      SER  16   3.529  -2.252  -5.572
   82    HG   SER  16           HG       SER  16   5.198  -0.369  -4.558
   83    H    CYS  17           H        CYS  17   0.689  -0.842  -5.397
   84    HA   CYS  17           HA       CYS  17  -0.925  -1.446  -3.151
   85    HB2  CYS  17           HB3      CYS  17  -1.813  -0.241  -5.086
   86    HB3  CYS  17           HB2      CYS  17  -1.598  -1.675  -6.084
   87    H    THR  18           H        THR  18  -1.260  -3.237  -2.208
   88    HA   THR  18           HA       THR  18  -1.074  -5.780  -3.664
   89    HB   THR  18           HB       THR  18  -0.298  -5.408  -0.754
   90    HG1  THR  18           HG1      THR  18   1.729  -5.074  -1.377
   91   HG21  THR  18          HG21      THR  18  -0.200  -7.691  -2.701
   92   HG22  THR  18          HG22      THR  18  -0.857  -7.655  -1.064
   93   HG23  THR  18          HG23      THR  18   0.888  -7.639  -1.314
   94    H    TRP  19           H        TRP  19  -3.303  -4.962  -3.910
   95    HA   TRP  19           HA       TRP  19  -5.271  -4.343  -2.353
   96    HB2  TRP  19           HB3      TRP  19  -5.215  -5.458  -4.795
   97    HB3  TRP  19           HB2      TRP  19  -5.973  -6.768  -3.895
   98    HD1  TRP  19           HD1      TRP  19  -6.661  -3.338  -5.313
   99    HE1  TRP  19           HE1      TRP  19  -9.134  -2.727  -4.930
  100    HE3  TRP  19           HE3      TRP  19  -7.949  -7.137  -2.148
  101    HZ2  TRP  19           HZ2      TRP  19 -11.336  -3.732  -3.472
  102    HZ3  TRP  19           HZ3      TRP  19 -10.245  -7.234  -1.292
  103    HH2  TRP  19           HH2      TRP  19 -11.910  -5.569  -1.944
  104    HA   PRO  20           HA       PRO  20  -6.681  -4.059  -1.396
  105    HB2  PRO  20           HB2      PRO  20  -8.122  -3.831   0.812
  106    HB3  PRO  20           HB3      PRO  20  -8.582  -4.984  -0.441
  107    HG2  PRO  20           HG3      PRO  20  -7.327  -5.472   2.206
  108    HG3  PRO  20           HG2      PRO  20  -8.430  -6.501   1.277
  109    HD2  PRO  20           HD3      PRO  20  -5.577  -6.659   1.400
  110    HD3  PRO  20           HD2      PRO  20  -6.673  -7.628   0.396
  111    H    ILE  21           H        ILE  21  -3.928  -4.472  -0.087
  112    HA   ILE  21           HA       ILE  21  -3.981  -1.967   1.431
  113    HB   ILE  21           HB       ILE  21  -2.437  -2.864   3.115
  114   HG12  ILE  21          HG13      ILE  21  -2.969  -5.560   1.841
  115   HG13  ILE  21          HG12      ILE  21  -1.460  -4.665   1.704
  116   HG21  ILE  21          HG21      ILE  21  -4.681  -2.860   3.807
  117   HG22  ILE  21          HG22      ILE  21  -4.091  -4.474   4.208
  118   HG23  ILE  21          HG23      ILE  21  -5.093  -4.232   2.775
  119   HD11  ILE  21          HD11      ILE  21  -1.924  -4.819   4.432
  120   HD12  ILE  21          HD12      ILE  21  -0.776  -5.776   3.494
  121   HD13  ILE  21          HD13      ILE  21  -2.395  -6.400   3.808
  122    H    CYS  22           H        CYS  22  -2.253  -0.662   1.133
  123    HA   CYS  22           HA       CYS  22  -0.434  -1.373  -1.016
  124    HB2  CYS  22           HB3      CYS  22  -1.594   0.922  -0.609
  125    HB3  CYS  22           HB2      CYS  22  -0.260   1.201   0.498
  126    H    THR  23           H        THR  23   1.728  -1.526  -0.854
  127    HA   THR  23           HA       THR  23   2.961  -1.516   1.813
  128    HB   THR  23           HB       THR  23   4.101  -3.707   1.167
  129    HG1  THR  23           HG1      THR  23   2.715  -3.322  -1.048
  130   HG21  THR  23          HG21      THR  23   1.735  -4.960   1.566
  131   HG22  THR  23          HG22      THR  23   1.325  -3.326   2.092
  132   HG23  THR  23          HG23      THR  23   2.664  -4.187   2.852
  133    H    ARG  24           H        ARG  24   4.976  -0.654   1.788
  134    HA   ARG  24           HA       ARG  24   6.172  -0.091  -0.814
  135    HB2  ARG  24           HB3      ARG  24   7.681   1.396   0.429
  136    HB3  ARG  24           HB2      ARG  24   6.002   1.811   0.699
  137    HG2  ARG  24           HG3      ARG  24   6.055   1.154   2.896
  138    HG3  ARG  24           HG2      ARG  24   7.386   0.022   2.637
  139    HD2  ARG  24           HD3      ARG  24   7.612   3.030   2.550
  140    HD3  ARG  24           HD2      ARG  24   8.076   2.015   3.916
  141    HE   ARG  24           HE       ARG  24   9.430   1.038   1.689
  142   HH11  ARG  24          HH11      ARG  24   9.355   4.007   3.555
  143   HH12  ARG  24          HH12      ARG  24  11.005   4.402   3.215
  144   HH21  ARG  24          HH22      ARG  24  11.552   1.528   1.236
  145   HH22  ARG  24          HH21      ARG  24  12.276   2.979   1.877
  146    H    ASP  25           H        ASP  25   7.873  -1.210  -1.536
  147    HA   ASP  25           HA       ASP  25   9.507  -2.793  -1.673
  148    HB2  ASP  25           HB3      ASP  25  10.008  -2.198   1.257
  149    HB3  ASP  25           HB2      ASP  25  11.141  -2.915   0.116
  150    H    GLY  26           H        GLY  26   6.769  -3.470  -0.793
  151    HA2  GLY  26           HA3      GLY  26   5.684  -5.475  -0.410
  152    HA3  GLY  26           HA2      GLY  26   7.247  -6.222  -0.110
  153    H    LEU  27           H        LEU  27   6.842  -3.405   1.702
  154    HA   LEU  27           HA       LEU  27   6.144  -5.006   4.069
  155    HB2  LEU  27           HB3      LEU  27   7.709  -2.429   3.888
  156    HB3  LEU  27           HB2      LEU  27   7.336  -3.288   5.371
  157    HG   LEU  27           HG       LEU  27   9.055  -4.357   3.129
  158   HD11  LEU  27          HD11      LEU  27  10.931  -3.946   4.527
  159   HD12  LEU  27          HD12      LEU  27   9.901  -3.466   5.876
  160   HD13  LEU  27          HD13      LEU  27  10.009  -2.445   4.441
  161   HD21  LEU  27          HD21      LEU  27   8.369  -5.471   5.846
  162   HD22  LEU  27          HD22      LEU  27   9.632  -6.105   4.791
  163   HD23  LEU  27          HD23      LEU  27   7.945  -6.157   4.277
  164    HA   PRO  28           HA       PRO  28   2.433  -2.572   4.272
  165    HB2  PRO  28           HB2      PRO  28   2.001  -3.721   6.909
  166    HB3  PRO  28           HB3      PRO  28   1.129  -4.035   5.407
  167    HG2  PRO  28           HG3      PRO  28   2.735  -5.876   6.594
  168    HG3  PRO  28           HG2      PRO  28   2.476  -5.805   4.842
  169    HD2  PRO  28           HD3      PRO  28   4.783  -4.779   6.457
  170    HD3  PRO  28           HD2      PRO  28   4.792  -5.645   4.905
  171    H    VAL  29           H        VAL  29   4.570  -1.022   4.808
  172    HA   VAL  29           HA       VAL  29   4.349   0.066   7.481
  173    HB   VAL  29           HB       VAL  29   6.031   1.062   5.175
  174   HG11  VAL  29          HG11      VAL  29   6.837   2.648   6.522
  175   HG12  VAL  29          HG12      VAL  29   7.001   1.532   7.878
  176   HG13  VAL  29          HG13      VAL  29   5.451   2.312   7.560
  177   HG21  VAL  29          HG21      VAL  29   6.398  -1.181   7.039
  178   HG22  VAL  29          HG22      VAL  29   7.788  -0.109   6.872
  179   HG23  VAL  29          HG23      VAL  29   7.105  -0.896   5.449
  Start of MODEL    7
    1    H1   CYS   1           H        CYS   1   3.145   0.746   4.253
    2    HA   CYS   1           HA       CYS   1   2.600   3.492   4.517
    3    HB2  CYS   1           HB3      CYS   1   0.947   1.771   2.717
    4    HB3  CYS   1           HB2      CYS   1   1.690   3.337   2.396
    5    H    GLY   2           H        GLY   2   0.664   0.611   5.093
    6    HA2  GLY   2           HA3      GLY   2  -1.129   0.309   6.510
    7    HA3  GLY   2           HA2      GLY   2  -1.021   2.006   6.944
    8    H    GLU   3           H        GLU   3  -1.274   3.010   4.266
    9    HA   GLU   3           HA       GLU   3  -4.047   3.275   4.125
   10    HB2  GLU   3           HB3      GLU   3  -3.700   4.444   2.035
   11    HB3  GLU   3           HB2      GLU   3  -2.467   4.916   3.194
   12    HG2  GLU   3           HG3      GLU   3  -0.807   3.659   2.091
   13    HG3  GLU   3           HG2      GLU   3  -2.000   2.807   1.112
   14    H    THR   4           H        THR   4  -5.621   2.368   2.948
   15    HA   THR   4           HA       THR   4  -5.044  -0.208   1.734
   16    HB   THR   4           HB       THR   4  -7.612  -0.289   1.631
   17    HG1  THR   4           HG1      THR   4  -8.300   1.272   3.501
   18   HG21  THR   4          HG21      THR   4  -7.661  -1.288   3.686
   19   HG22  THR   4          HG22      THR   4  -6.793   0.032   4.469
   20   HG23  THR   4          HG23      THR   4  -5.913  -1.147   3.497
   21    H    CYS   5           H        CYS   5  -4.705  -0.321  -0.409
   22    HA   CYS   5           HA       CYS   5  -5.517   1.903  -2.084
   23    HB2  CYS   5           HB3      CYS   5  -4.178   0.802  -3.843
   24    HB3  CYS   5           HB2      CYS   5  -3.256   1.084  -2.371
   25    H    PHE   6           H        PHE   6  -7.807   1.006  -1.416
   26    HA   PHE   6           HA       PHE   6  -8.891  -1.227  -2.708
   27    HB2  PHE   6           HB3      PHE   6 -10.058   1.315  -1.640
   28    HB3  PHE   6           HB2      PHE   6 -11.071   0.249  -2.606
   29    HD1  PHE   6           HD1      PHE   6  -8.488  -0.421   0.011
   30    HD2  PHE   6           HD2      PHE   6 -12.534  -0.844  -1.234
   31    HE1  PHE   6           HE1      PHE   6  -8.954  -1.793   1.999
   32    HE2  PHE   6           HE2      PHE   6 -13.008  -2.215   0.752
   33    HZ   PHE   6           HZ       PHE   6 -11.216  -2.691   2.373
   34    H    GLY   7           H        GLY   7  -8.350   2.053  -3.840
   35    HA2  GLY   7           HA3      GLY   7  -9.658   1.492  -6.383
   36    HA3  GLY   7           HA2      GLY   7  -8.973   3.031  -5.881
   37    H    GLY   8           H        GLY   8  -6.987   0.265  -5.404
   38    HA2  GLY   8           HA3      GLY   8  -5.189  -0.595  -6.560
   39    HA3  GLY   8           HA2      GLY   8  -5.755   0.247  -7.990
   40    H    THR   9           H        THR   9  -5.706   2.866  -6.617
   41    HA   THR   9           HA       THR   9  -2.890   3.411  -7.054
   42    HB   THR   9           HB       THR   9  -4.930   5.486  -6.318
   43    HG1  THR   9           HG1      THR   9  -5.139   3.795  -8.378
   44   HG21  THR   9          HG21      THR   9  -3.040   5.971  -8.498
   45   HG22  THR   9          HG22      THR   9  -2.263   5.630  -6.951
   46   HG23  THR   9          HG23      THR   9  -3.415   6.959  -7.086
   47    H    CYS  10           H        CYS  10  -1.578   4.545  -5.583
   48    HA   CYS  10           HA       CYS  10  -2.421   4.377  -2.771
   49    HB2  CYS  10           HB3      CYS  10   0.362   4.003  -3.905
   50    HB3  CYS  10           HB2      CYS  10  -0.048   3.993  -2.193
   51    H    ASN  11           H        ASN  11  -1.743   6.037  -1.394
   52    HA   ASN  11           HA       ASN  11  -1.419   8.595  -2.732
   53    HB2  ASN  11           HB3      ASN  11  -1.923   7.854   0.154
   54    HB3  ASN  11           HB2      ASN  11  -1.816   9.510  -0.438
   55   HD21  ASN  11          HD22      ASN  11  -3.751   6.699  -0.154
   56   HD22  ASN  11          HD21      ASN  11  -5.184   7.352  -0.875
   57    H    THR  12           H        THR  12   0.482   6.390  -0.823
   58    HA   THR  12           HA       THR  12   2.545   8.447  -0.488
   59    HB   THR  12           HB       THR  12   3.649   6.689   0.986
   60    HG1  THR  12           HG1      THR  12   1.071   5.488   0.657
   61   HG21  THR  12          HG21      THR  12   1.942   7.071   2.848
   62   HG22  THR  12          HG22      THR  12   1.002   7.953   1.645
   63   HG23  THR  12          HG23      THR  12   2.621   8.503   2.075
   64    HA   PRO  13           HA       PRO  13   4.824   6.798  -3.913
   65    HB2  PRO  13           HB2      PRO  13   7.082   8.294  -2.758
   66    HB3  PRO  13           HB3      PRO  13   6.287   8.493  -4.323
   67    HG2  PRO  13           HG3      PRO  13   5.988  10.291  -2.352
   68    HG3  PRO  13           HG2      PRO  13   4.668   9.901  -3.473
   69    HD2  PRO  13           HD3      PRO  13   5.108   8.964  -0.660
   70    HD3  PRO  13           HD2      PRO  13   3.603   9.474  -1.456
   71    H    GLY  14           H        GLY  14   6.169   5.092  -4.236
   72    HA2  GLY  14           HA3      GLY  14   7.979   3.664  -3.721
   73    HA3  GLY  14           HA2      GLY  14   7.917   4.223  -2.055
   74    H    CYS  15           H        CYS  15   4.901   3.905  -2.256
   75    HA   CYS  15           HA       CYS  15   4.870   1.144  -1.375
   76    HB2  CYS  15           HB3      CYS  15   2.792   3.339  -1.306
   77    HB3  CYS  15           HB2      CYS  15   2.513   1.708  -0.706
   78    H    SER  16           H        SER  16   3.904  -0.497  -2.402
   79    HA   SER  16           HA       SER  16   2.745   0.038  -5.049
   80    HB2  SER  16           HB3      SER  16   3.970  -2.539  -4.031
   81    HB3  SER  16           HB2      SER  16   3.488  -2.175  -5.689
   82    HG   SER  16           HG       SER  16   5.304  -0.444  -4.486
   83    H    CYS  17           H        CYS  17   0.703  -0.707  -5.472
   84    HA   CYS  17           HA       CYS  17  -0.949  -1.288  -3.273
   85    HB2  CYS  17           HB3      CYS  17  -1.768  -0.165  -5.307
   86    HB3  CYS  17           HB2      CYS  17  -1.578  -1.671  -6.200
   87    H    THR  18           H        THR  18  -1.480  -3.054  -2.325
   88    HA   THR  18           HA       THR  18  -1.179  -5.651  -3.658
   89    HB   THR  18           HB       THR  18  -0.520  -5.242  -0.732
   90    HG1  THR  18           HG1      THR  18   0.954  -4.487  -2.871
   91   HG21  THR  18          HG21      THR  18   0.244  -7.417  -0.750
   92   HG22  THR  18          HG22      THR  18   0.604  -7.390  -2.477
   93   HG23  THR  18          HG23      THR  18  -1.066  -7.526  -1.927
   94    H    TRP  19           H        TRP  19  -3.427  -4.753  -3.932
   95    HA   TRP  19           HA       TRP  19  -5.395  -4.133  -2.386
   96    HB2  TRP  19           HB3      TRP  19  -5.325  -5.292  -4.827
   97    HB3  TRP  19           HB2      TRP  19  -6.154  -6.545  -3.906
   98    HD1  TRP  19           HD1      TRP  19  -6.671  -3.126  -5.420
   99    HE1  TRP  19           HE1      TRP  19  -9.114  -2.387  -5.068
  100    HE3  TRP  19           HE3      TRP  19  -8.156  -6.777  -2.170
  101    HZ2  TRP  19           HZ2      TRP  19 -11.369  -3.243  -3.596
  102    HZ3  TRP  19           HZ3      TRP  19 -10.459  -6.739  -1.322
  103    HH2  TRP  19           HH2      TRP  19 -12.038  -5.011  -2.025
  104    HA   PRO  20           HA       PRO  20  -6.792  -3.828  -1.406
  105    HB2  PRO  20           HB2      PRO  20  -8.175  -3.570   0.842
  106    HB3  PRO  20           HB3      PRO  20  -8.691  -4.702  -0.412
  107    HG2  PRO  20           HG3      PRO  20  -7.402  -5.241   2.207
  108    HG3  PRO  20           HG2      PRO  20  -8.540  -6.238   1.287
  109    HD2  PRO  20           HD3      PRO  20  -5.691  -6.459   1.367
  110    HD3  PRO  20           HD2      PRO  20  -6.823  -7.397   0.372
  111    H    ILE  21           H        ILE  21  -4.016  -4.279  -0.127
  112    HA   ILE  21           HA       ILE  21  -4.011  -1.750   1.352
  113    HB   ILE  21           HB       ILE  21  -2.486  -2.642   3.050
  114   HG12  ILE  21          HG13      ILE  21  -3.051  -5.354   1.823
  115   HG13  ILE  21          HG12      ILE  21  -1.532  -4.479   1.670
  116   HG21  ILE  21          HG21      ILE  21  -4.166  -4.239   4.154
  117   HG22  ILE  21          HG22      ILE  21  -5.168  -3.956   2.728
  118   HG23  ILE  21          HG23      ILE  21  -4.711  -2.606   3.771
  119   HD11  ILE  21          HD11      ILE  21  -0.906  -4.916   3.816
  120   HD12  ILE  21          HD12      ILE  21  -1.859  -6.359   3.469
  121   HD13  ILE  21          HD13      ILE  21  -2.567  -5.035   4.396
  122    H    CYS  22           H        CYS  22  -2.208  -0.510   1.068
  123    HA   CYS  22           HA       CYS  22  -0.442  -1.309  -1.099
  124    HB2  CYS  22           HB3      CYS  22  -1.520   1.023  -0.745
  125    HB3  CYS  22           HB2      CYS  22  -0.193   1.286   0.374
  126    H    THR  23           H        THR  23   1.730  -1.535  -0.946
  127    HA   THR  23           HA       THR  23   2.924  -1.565   1.744
  128    HB   THR  23           HB       THR  23   4.052  -3.709   1.186
  129    HG1  THR  23           HG1      THR  23   2.192  -4.307  -0.801
  130   HG21  THR  23          HG21      THR  23   1.831  -5.109   1.214
  131   HG22  THR  23          HG22      THR  23   1.082  -3.529   1.438
  132   HG23  THR  23          HG23      THR  23   2.273  -4.111   2.600
  133    H    ARG  24           H        ARG  24   4.896  -0.619   1.802
  134    HA   ARG  24           HA       ARG  24   6.172   0.034  -0.730
  135    HB2  ARG  24           HB3      ARG  24   7.584   1.521   0.537
  136    HB3  ARG  24           HB2      ARG  24   5.915   1.818   0.973
  137    HG2  ARG  24           HG3      ARG  24   6.178   0.846   3.083
  138    HG3  ARG  24           HG2      ARG  24   7.683   0.043   2.622
  139    HD2  ARG  24           HD3      ARG  24   7.214   2.973   3.137
  140    HD3  ARG  24           HD2      ARG  24   8.299   1.878   3.992
  141    HE   ARG  24           HE       ARG  24   8.924   3.397   1.711
  142   HH11  ARG  24          HH11      ARG  24   9.516   0.215   3.072
  143   HH12  ARG  24          HH12      ARG  24  10.900  -0.089   2.064
  144   HH21  ARG  24          HH22      ARG  24  10.782   2.974   0.418
  145   HH22  ARG  24          HH21      ARG  24  11.595   1.444   0.567
  146    H    ASP  25           H        ASP  25   7.815  -1.126  -1.490
  147    HA   ASP  25           HA       ASP  25   9.415  -2.732  -1.688
  148    HB2  ASP  25           HB3      ASP  25   9.939  -2.075   1.226
  149    HB3  ASP  25           HB2      ASP  25  11.002  -3.030   0.200
  150    H    GLY  26           H        GLY  26   6.682  -3.411  -0.838
  151    HA2  GLY  26           HA3      GLY  26   5.600  -5.433  -0.537
  152    HA3  GLY  26           HA2      GLY  26   7.153  -6.180  -0.196
  153    H    LEU  27           H        LEU  27   6.657  -3.396   1.651
  154    HA   LEU  27           HA       LEU  27   5.832  -5.046   3.949
  155    HB2  LEU  27           HB3      LEU  27   7.524  -2.543   3.912
  156    HB3  LEU  27           HB2      LEU  27   7.039  -3.415   5.354
  157    HG   LEU  27           HG       LEU  27   8.806  -4.521   3.168
  158   HD11  LEU  27          HD11      LEU  27  10.412  -3.340   4.156
  159   HD12  LEU  27          HD12      LEU  27  10.225  -4.419   5.538
  160   HD13  LEU  27          HD13      LEU  27   9.359  -2.883   5.494
  161   HD21  LEU  27          HD21      LEU  27   8.378  -5.704   5.889
  162   HD22  LEU  27          HD22      LEU  27   9.034  -6.460   4.438
  163   HD23  LEU  27          HD23      LEU  27   7.311  -6.102   4.542
  164    HA   PRO  28           HA       PRO  28   2.214  -2.449   4.006
  165    HB2  PRO  28           HB2      PRO  28   1.569  -3.703   6.554
  166    HB3  PRO  28           HB3      PRO  28   0.761  -3.877   4.995
  167    HG2  PRO  28           HG3      PRO  28   2.185  -5.877   6.148
  168    HG3  PRO  28           HG2      PRO  28   2.028  -5.691   4.392
  169    HD2  PRO  28           HD3      PRO  28   4.303  -4.924   6.185
  170    HD3  PRO  28           HD2      PRO  28   4.341  -5.678   4.576
  171    H    VAL  29           H        VAL  29   4.366  -1.019   4.746
  172    HA   VAL  29           HA       VAL  29   4.029  -0.052   7.455
  173    HB   VAL  29           HB       VAL  29   5.892   0.981   5.311
  174   HG11  VAL  29          HG11      VAL  29   6.630   1.239   8.137
  175   HG12  VAL  29          HG12      VAL  29   5.227   2.190   7.653
  176   HG13  VAL  29          HG13      VAL  29   6.764   2.399   6.816
  177   HG21  VAL  29          HG21      VAL  29   6.590  -0.918   7.539
  178   HG22  VAL  29          HG22      VAL  29   7.602  -0.413   6.186
  179   HG23  VAL  29          HG23      VAL  29   6.199  -1.445   5.901
  Start of MODEL    8
    1    H1   CYS   1           H        CYS   1   3.008   0.723   4.494
    2    HA   CYS   1           HA       CYS   1   2.602   3.510   4.579
    3    HB2  CYS   1           HB3      CYS   1   0.931   1.628   2.924
    4    HB3  CYS   1           HB2      CYS   1   1.464   3.259   2.527
    5    H    GLY   2           H        GLY   2   0.632   0.770   5.519
    6    HA2  GLY   2           HA3      GLY   2  -1.271   0.608   6.782
    7    HA3  GLY   2           HA2      GLY   2  -0.902   2.224   7.360
    8    H    GLU   3           H        GLU   3  -1.732   1.085   4.103
    9    HA   GLU   3           HA       GLU   3  -4.271   2.498   4.275
   10    HB2  GLU   3           HB3      GLU   3  -3.850   3.686   2.149
   11    HB3  GLU   3           HB2      GLU   3  -2.769   4.200   3.436
   12    HG2  GLU   3           HG3      GLU   3  -0.938   3.085   2.498
   13    HG3  GLU   3           HG2      GLU   3  -1.964   2.120   1.437
   14    H    THR   4           H        THR   4  -5.847   1.690   3.008
   15    HA   THR   4           HA       THR   4  -5.275  -0.826   1.648
   16    HB   THR   4           HB       THR   4  -7.812  -0.950   1.541
   17    HG1  THR   4           HG1      THR   4  -8.019   1.405   1.890
   18   HG21  THR   4          HG21      THR   4  -6.761  -2.234   3.224
   19   HG22  THR   4          HG22      THR   4  -8.025  -1.327   4.053
   20   HG23  THR   4          HG23      THR   4  -6.344  -0.803   4.167
   21    H    CYS   5           H        CYS   5  -4.814  -0.689  -0.474
   22    HA   CYS   5           HA       CYS   5  -5.735   1.596  -2.000
   23    HB2  CYS   5           HB3      CYS   5  -4.286   0.691  -3.796
   24    HB3  CYS   5           HB2      CYS   5  -3.424   0.957  -2.285
   25    H    PHE   6           H        PHE   6  -7.978   0.509  -1.476
   26    HA   PHE   6           HA       PHE   6  -8.882  -1.687  -2.953
   27    HB2  PHE   6           HB3      PHE   6 -10.241   0.700  -1.757
   28    HB3  PHE   6           HB2      PHE   6 -11.154  -0.373  -2.812
   29    HD1  PHE   6           HD1      PHE   6  -8.578  -1.057  -0.195
   30    HD2  PHE   6           HD2      PHE   6 -12.583  -1.610  -1.520
   31    HE1  PHE   6           HE1      PHE   6  -8.992  -2.573   1.697
   32    HE2  PHE   6           HE2      PHE   6 -13.005  -3.126   0.370
   33    HZ   PHE   6           HZ       PHE   6 -11.207  -3.609   1.982
   34    H    GLY   7           H        GLY   7  -8.529   1.696  -3.837
   35    HA2  GLY   7           HA3      GLY   7  -9.736   1.237  -6.448
   36    HA3  GLY   7           HA2      GLY   7  -9.158   2.774  -5.823
   37    H    GLY   8           H        GLY   8  -7.011   0.115  -5.475
   38    HA2  GLY   8           HA3      GLY   8  -5.140  -0.554  -6.644
   39    HA3  GLY   8           HA2      GLY   8  -5.726   0.352  -8.027
   40    H    THR   9           H        THR   9  -5.875   2.859  -6.446
   41    HA   THR   9           HA       THR   9  -3.094   3.615  -6.782
   42    HB   THR   9           HB       THR   9  -5.258   5.496  -5.904
   43    HG1  THR   9           HG1      THR   9  -5.349   3.970  -8.107
   44   HG21  THR   9          HG21      THR   9  -3.238   6.104  -7.999
   45   HG22  THR   9          HG22      THR   9  -2.675   5.964  -6.334
   46   HG23  THR   9          HG23      THR   9  -3.917   7.146  -6.748
   47    H    CYS  10           H        CYS  10  -1.864   4.668  -5.194
   48    HA   CYS  10           HA       CYS  10  -2.734   4.200  -2.424
   49    HB2  CYS  10           HB3      CYS  10   0.090   4.157  -3.514
   50    HB3  CYS  10           HB2      CYS  10  -0.367   3.901  -1.834
   51    H    ASN  11           H        ASN  11  -2.138   5.741  -0.872
   52    HA   ASN  11           HA       ASN  11  -1.966   8.446  -1.935
   53    HB2  ASN  11           HB3      ASN  11  -3.633   7.910  -0.201
   54    HB3  ASN  11           HB2      ASN  11  -2.340   7.450   0.901
   55   HD21  ASN  11          HD22      ASN  11  -1.719   8.941   2.278
   56   HD22  ASN  11          HD21      ASN  11  -1.916  10.646   2.092
   57    H    THR  12           H        THR  12   0.052   6.105  -0.414
   58    HA   THR  12           HA       THR  12   2.042   8.136   0.298
   59    HB   THR  12           HB       THR  12   2.227   5.182   0.856
   60    HG1  THR  12           HG1      THR  12   0.307   5.787   1.793
   61   HG21  THR  12          HG21      THR  12   3.620   5.925   2.728
   62   HG22  THR  12          HG22      THR  12   3.381   7.603   2.243
   63   HG23  THR  12          HG23      THR  12   4.262   6.498   1.189
   64    HA   PRO  13           HA       PRO  13   4.220   7.228  -3.502
   65    HB2  PRO  13           HB2      PRO  13   6.398   8.737  -2.208
   66    HB3  PRO  13           HB3      PRO  13   5.543   9.073  -3.716
   67    HG2  PRO  13           HG3      PRO  13   5.159  10.568  -1.523
   68    HG3  PRO  13           HG2      PRO  13   3.838  10.211  -2.652
   69    HD2  PRO  13           HD3      PRO  13   4.451   8.968   0.005
   70    HD3  PRO  13           HD2      PRO  13   2.882   9.435  -0.686
   71    H    GLY  14           H        GLY  14   5.562   5.597  -4.053
   72    HA2  GLY  14           HA3      GLY  14   7.469   4.228  -3.835
   73    HA3  GLY  14           HA2      GLY  14   7.568   4.674  -2.137
   74    H    CYS  15           H        CYS  15   4.497   4.156  -2.200
   75    HA   CYS  15           HA       CYS  15   4.742   1.384  -1.376
   76    HB2  CYS  15           HB3      CYS  15   2.442   3.347  -1.230
   77    HB3  CYS  15           HB2      CYS  15   2.377   1.699  -0.619
   78    H    SER  16           H        SER  16   3.918  -0.319  -2.429
   79    HA   SER  16           HA       SER  16   2.732   0.167  -5.069
   80    HB2  SER  16           HB3      SER  16   4.024  -2.372  -4.040
   81    HB3  SER  16           HB2      SER  16   3.597  -1.993  -5.709
   82    HG   SER  16           HG       SER  16   5.213  -0.098  -4.633
   83    H    CYS  17           H        CYS  17   0.723  -0.618  -5.510
   84    HA   CYS  17           HA       CYS  17  -0.894  -1.371  -3.316
   85    HB2  CYS  17           HB3      CYS  17  -1.776  -0.084  -5.210
   86    HB3  CYS  17           HB2      CYS  17  -1.551  -1.481  -6.257
   87    H    THR  18           H        THR  18  -1.162  -3.216  -2.456
   88    HA   THR  18           HA       THR  18  -0.895  -5.676  -4.042
   89    HB   THR  18           HB       THR  18  -0.226  -5.454  -1.092
   90    HG1  THR  18           HG1      THR  18   1.785  -4.937  -1.608
   91   HG21  THR  18          HG21      THR  18   0.631  -7.630  -1.274
   92   HG22  THR  18          HG22      THR  18   0.712  -7.549  -3.033
   93   HG23  THR  18          HG23      THR  18  -0.851  -7.682  -2.228
   94    H    TRP  19           H        TRP  19  -3.151  -4.871  -4.289
   95    HA   TRP  19           HA       TRP  19  -5.169  -4.409  -2.743
   96    HB2  TRP  19           HB3      TRP  19  -5.018  -5.390  -5.252
   97    HB3  TRP  19           HB2      TRP  19  -5.798  -6.745  -4.441
   98    HD1  TRP  19           HD1      TRP  19  -6.465  -3.260  -5.725
   99    HE1  TRP  19           HE1      TRP  19  -8.947  -2.670  -5.370
  100    HE3  TRP  19           HE3      TRP  19  -7.812  -7.192  -2.752
  101    HZ2  TRP  19           HZ2      TRP  19 -11.176  -3.734  -4.000
  102    HZ3  TRP  19           HZ3      TRP  19 -10.126  -7.324  -1.946
  103    HH2  TRP  19           HH2      TRP  19 -11.779  -5.633  -2.562
  104    HA   PRO  20           HA       PRO  20  -6.599  -4.221  -1.776
  105    HB2  PRO  20           HB2      PRO  20  -8.047  -4.166   0.442
  106    HB3  PRO  20           HB3      PRO  20  -8.487  -5.235  -0.893
  107    HG2  PRO  20           HG3      PRO  20  -7.233  -5.891   1.718
  108    HG3  PRO  20           HG2      PRO  20  -8.313  -6.869   0.711
  109    HD2  PRO  20           HD3      PRO  20  -5.461  -6.991   0.842
  110    HD3  PRO  20           HD2      PRO  20  -6.535  -7.900  -0.239
  111    H    ILE  21           H        ILE  21  -3.844  -4.668  -0.465
  112    HA   ILE  21           HA       ILE  21  -3.967  -2.258   1.198
  113    HB   ILE  21           HB       ILE  21  -2.411  -3.224   2.837
  114   HG12  ILE  21          HG13      ILE  21  -2.904  -5.851   1.412
  115   HG13  ILE  21          HG12      ILE  21  -1.404  -4.933   1.335
  116   HG21  ILE  21          HG21      ILE  21  -5.053  -4.587   2.401
  117   HG22  ILE  21          HG22      ILE  21  -4.650  -3.286   3.526
  118   HG23  ILE  21          HG23      ILE  21  -4.056  -4.921   3.820
  119   HD11  ILE  21          HD11      ILE  21  -0.681  -5.859   3.208
  120   HD12  ILE  21          HD12      ILE  21  -2.096  -6.912   3.171
  121   HD13  ILE  21          HD13      ILE  21  -2.149  -5.394   4.067
  122    H    CYS  22           H        CYS  22  -2.302  -0.882   0.946
  123    HA   CYS  22           HA       CYS  22  -0.419  -1.456  -1.190
  124    HB2  CYS  22           HB3      CYS  22  -1.681   0.766  -0.791
  125    HB3  CYS  22           HB2      CYS  22  -0.427   1.084   0.397
  126    H    THR  23           H        THR  23   1.741  -1.510  -1.002
  127    HA   THR  23           HA       THR  23   2.961  -1.480   1.668
  128    HB   THR  23           HB       THR  23   4.177  -3.623   1.038
  129    HG1  THR  23           HG1      THR  23   3.044  -3.289  -1.241
  130   HG21  THR  23          HG21      THR  23   1.338  -3.396   1.837
  131   HG22  THR  23          HG22      THR  23   2.696  -4.140   2.681
  132   HG23  THR  23          HG23      THR  23   1.896  -5.001   1.367
  133    H    ARG  24           H        ARG  24   4.895  -0.423   1.601
  134    HA   ARG  24           HA       ARG  24   6.063   0.075  -1.024
  135    HB2  ARG  24           HB3      ARG  24   7.344   1.811   0.011
  136    HB3  ARG  24           HB2      ARG  24   5.680   1.995   0.515
  137    HG2  ARG  24           HG3      ARG  24   6.148   1.266   2.691
  138    HG3  ARG  24           HG2      ARG  24   7.711   0.593   2.218
  139    HD2  ARG  24           HD3      ARG  24   6.930   3.492   2.459
  140    HD3  ARG  24           HD2      ARG  24   8.168   2.622   3.365
  141    HE   ARG  24           HE       ARG  24   8.522   3.936   0.905
  142   HH11  ARG  24          HH11      ARG  24   9.522   1.020   2.578
  143   HH12  ARG  24          HH12      ARG  24  10.886   0.742   1.532
  144   HH21  ARG  24          HH22      ARG  24  10.356   3.560  -0.443
  145   HH22  ARG  24          HH21      ARG  24  11.342   2.155  -0.165
  146    H    ASP  25           H        ASP  25   7.796  -0.997  -1.701
  147    HA   ASP  25           HA       ASP  25   9.510  -2.493  -1.777
  148    HB2  ASP  25           HB3      ASP  25  10.031  -1.492   1.038
  149    HB3  ASP  25           HB2      ASP  25  11.151  -2.459   0.086
  150    H    GLY  26           H        GLY  26   6.875  -3.299  -0.845
  151    HA2  GLY  26           HA3      GLY  26   5.943  -5.343  -0.303
  152    HA3  GLY  26           HA2      GLY  26   7.549  -5.933   0.095
  153    H    LEU  27           H        LEU  27   6.958  -3.029   1.679
  154    HA   LEU  27           HA       LEU  27   6.308  -4.492   4.144
  155    HB2  LEU  27           HB3      LEU  27   7.604  -1.787   3.795
  156    HB3  LEU  27           HB2      LEU  27   7.291  -2.573   5.330
  157    HG   LEU  27           HG       LEU  27   9.160  -3.612   3.196
  158   HD11  LEU  27          HD11      LEU  27   9.503  -1.675   5.318
  159   HD12  LEU  27          HD12      LEU  27  10.596  -2.123   4.009
  160   HD13  LEU  27          HD13      LEU  27  10.585  -3.055   5.507
  161   HD21  LEU  27          HD21      LEU  27   9.278  -5.522   4.328
  162   HD22  LEU  27          HD22      LEU  27   7.872  -4.986   5.250
  163   HD23  LEU  27          HD23      LEU  27   9.497  -4.672   5.859
  164    HA   PRO  28           HA       PRO  28   2.411  -2.327   3.993
  165    HB2  PRO  28           HB2      PRO  28   1.655  -3.697   6.405
  166    HB3  PRO  28           HB3      PRO  28   1.135  -4.035   4.754
  167    HG2  PRO  28           HG3      PRO  28   2.720  -5.708   6.259
  168    HG3  PRO  28           HG2      PRO  28   2.663  -5.703   4.488
  169    HD2  PRO  28           HD3      PRO  28   4.673  -4.465   6.326
  170    HD3  PRO  28           HD2      PRO  28   4.921  -5.293   4.773
  171    H    VAL  29           H        VAL  29   4.513  -0.876   5.026
  172    HA   VAL  29           HA       VAL  29   3.772   0.013   7.681
  173    HB   VAL  29           HB       VAL  29   6.166  -0.232   7.019
  174   HG11  VAL  29          HG11      VAL  29   5.326   1.633   4.937
  175   HG12  VAL  29          HG12      VAL  29   6.685   0.509   4.980
  176   HG13  VAL  29          HG13      VAL  29   6.823   2.089   5.751
  177   HG21  VAL  29          HG21      VAL  29   5.602   2.634   7.713
  178   HG22  VAL  29          HG22      VAL  29   6.928   1.605   8.257
  179   HG23  VAL  29          HG23      VAL  29   5.290   1.319   8.846
  Start of MODEL    9
    1    H1   CYS   1           H        CYS   1   3.000   0.722   4.309
    2    HA   CYS   1           HA       CYS   1   2.251   3.425   4.567
    3    HB2  CYS   1           HB3      CYS   1   0.815   1.582   2.696
    4    HB3  CYS   1           HB2      CYS   1   1.391   3.225   2.421
    5    H    GLY   2           H        GLY   2   0.490   0.398   4.995
    6    HA2  GLY   2           HA3      GLY   2  -1.342  -0.070   6.311
    7    HA3  GLY   2           HA2      GLY   2  -1.321   1.597   6.859
    8    H    GLU   3           H        GLU   3  -1.523   2.722   4.204
    9    HA   GLU   3           HA       GLU   3  -4.257   3.031   3.998
   10    HB2  GLU   3           HB3      GLU   3  -3.818   4.038   1.783
   11    HB3  GLU   3           HB2      GLU   3  -2.751   4.640   3.043
   12    HG2  GLU   3           HG3      GLU   3  -0.929   3.358   2.230
   13    HG3  GLU   3           HG2      GLU   3  -1.974   2.460   1.128
   14    H    THR   4           H        THR   4  -5.861   2.164   2.874
   15    HA   THR   4           HA       THR   4  -5.460  -0.479   1.739
   16    HB   THR   4           HB       THR   4  -7.989   1.119   2.243
   17    HG1  THR   4           HG1      THR   4  -6.361  -0.328   3.882
   18   HG21  THR   4          HG21      THR   4  -8.669  -1.545   2.283
   19   HG22  THR   4          HG22      THR   4  -7.516  -1.455   0.951
   20   HG23  THR   4          HG23      THR   4  -8.954  -0.432   0.944
   21    H    CYS   5           H        CYS   5  -4.896  -0.539  -0.366
   22    HA   CYS   5           HA       CYS   5  -5.747   1.584  -2.153
   23    HB2  CYS   5           HB3      CYS   5  -4.253   0.537  -3.794
   24    HB3  CYS   5           HB2      CYS   5  -3.424   0.846  -2.273
   25    H    PHE   6           H        PHE   6  -7.971   0.423  -1.426
   26    HA   PHE   6           HA       PHE   6  -8.807  -1.875  -2.774
   27    HB2  PHE   6           HB3      PHE   6 -11.133  -0.965  -2.435
   28    HB3  PHE   6           HB2      PHE   6 -10.149  -1.072  -0.982
   29    HD1  PHE   6           HD2      PHE   6 -11.334   1.319  -3.573
   30    HD2  PHE   6           HD1      PHE   6  -9.840   0.785   0.376
   31    HE1  PHE   6           HE2      PHE   6 -11.810   3.681  -3.077
   32    HE2  PHE   6           HE1      PHE   6 -10.321   3.143   0.881
   33    HZ   PHE   6           HZ       PHE   6 -11.303   4.596  -0.848
   34    H    GLY   7           H        GLY   7  -8.510   1.417  -3.896
   35    HA2  GLY   7           HA3      GLY   7  -9.895   0.776  -6.391
   36    HA3  GLY   7           HA2      GLY   7  -9.340   2.367  -5.894
   37    H    GLY   8           H        GLY   8  -7.055  -0.134  -5.460
   38    HA2  GLY   8           HA3      GLY   8  -5.117  -0.691  -6.553
   39    HA3  GLY   8           HA2      GLY   8  -5.931  -0.258  -8.047
   40    H    THR   9           H        THR   9  -5.221   1.835  -5.289
   41    HA   THR   9           HA       THR   9  -3.086   3.171  -6.739
   42    HB   THR   9           HB       THR   9  -5.346   4.873  -5.716
   43    HG1  THR   9           HG1      THR   9  -5.304   3.332  -8.003
   44   HG21  THR   9          HG21      THR   9  -2.811   5.461  -6.627
   45   HG22  THR   9          HG22      THR   9  -4.158   6.593  -6.515
   46   HG23  THR   9          HG23      THR   9  -3.828   5.763  -8.036
   47    H    CYS  10           H        CYS  10  -1.798   4.485  -5.370
   48    HA   CYS  10           HA       CYS  10  -2.402   4.294  -2.503
   49    HB2  CYS  10           HB3      CYS  10   0.330   3.882  -3.741
   50    HB3  CYS  10           HB2      CYS  10  -0.052   3.828  -2.023
   51    H    ASN  11           H        ASN  11  -1.834   6.014  -1.269
   52    HA   ASN  11           HA       ASN  11  -1.336   8.501  -2.703
   53    HB2  ASN  11           HB3      ASN  11  -3.152   8.369  -1.041
   54    HB3  ASN  11           HB2      ASN  11  -1.980   7.979   0.211
   55   HD21  ASN  11          HD22      ASN  11  -1.343   9.604   1.411
   56   HD22  ASN  11          HD21      ASN  11  -1.364  11.272   0.965
   57    H    THR  12           H        THR  12   0.406   6.217  -0.846
   58    HA   THR  12           HA       THR  12   2.486   8.169  -0.165
   59    HB   THR  12           HB       THR  12   2.430   5.258   0.618
   60    HG1  THR  12           HG1      THR  12   0.522   6.061   1.412
   61   HG21  THR  12          HG21      THR  12   3.807   6.009   2.478
   62   HG22  THR  12          HG22      THR  12   3.680   7.679   1.921
   63   HG23  THR  12          HG23      THR  12   4.538   6.486   0.946
   64    HA   PRO  13           HA       PRO  13   4.817   6.862  -3.751
   65    HB2  PRO  13           HB2      PRO  13   7.024   8.272  -2.388
   66    HB3  PRO  13           HB3      PRO  13   6.312   8.572  -3.976
   67    HG2  PRO  13           HG3      PRO  13   5.894  10.238  -1.920
   68    HG3  PRO  13           HG2      PRO  13   4.630   9.905  -3.120
   69    HD2  PRO  13           HD3      PRO  13   4.951   8.813  -0.349
   70    HD3  PRO  13           HD2      PRO  13   3.477   9.340  -1.190
   71    H    GLY  14           H        GLY  14   6.043   5.094  -4.117
   72    HA2  GLY  14           HA3      GLY  14   7.798   3.580  -3.697
   73    HA3  GLY  14           HA2      GLY  14   7.844   4.128  -2.026
   74    H    CYS  15           H        CYS  15   4.751   3.895  -2.251
   75    HA   CYS  15           HA       CYS  15   4.676   1.174  -1.245
   76    HB2  CYS  15           HB3      CYS  15   2.599   3.370  -1.339
   77    HB3  CYS  15           HB2      CYS  15   2.302   1.770  -0.672
   78    H    SER  16           H        SER  16   3.838  -0.512  -2.282
   79    HA   SER  16           HA       SER  16   2.690  -0.072  -4.950
   80    HB2  SER  16           HB3      SER  16   3.985  -2.586  -3.857
   81    HB3  SER  16           HB2      SER  16   3.519  -2.273  -5.530
   82    HG   SER  16           HG       SER  16   5.275  -0.483  -4.301
   83    H    CYS  17           H        CYS  17   0.667  -0.834  -5.357
   84    HA   CYS  17           HA       CYS  17  -0.971  -1.488  -3.162
   85    HB2  CYS  17           HB3      CYS  17  -1.828  -0.331  -5.148
   86    HB3  CYS  17           HB2      CYS  17  -1.583  -1.792  -6.100
   87    H    THR  18           H        THR  18  -1.284  -3.288  -2.192
   88    HA   THR  18           HA       THR  18  -0.955  -5.840  -3.622
   89    HB   THR  18           HB       THR  18  -0.377  -5.512  -0.673
   90    HG1  THR  18           HG1      THR  18   1.079  -4.507  -2.675
   91   HG21  THR  18          HG21      THR  18   0.984  -7.561  -1.085
   92   HG22  THR  18          HG22      THR  18   0.389  -7.573  -2.744
   93   HG23  THR  18          HG23      THR  18  -0.736  -7.783  -1.403
   94    H    TRP  19           H        TRP  19  -3.233  -5.067  -3.931
   95    HA   TRP  19           HA       TRP  19  -5.260  -4.562  -2.408
   96    HB2  TRP  19           HB3      TRP  19  -5.097  -5.653  -4.867
   97    HB3  TRP  19           HB2      TRP  19  -5.847  -6.986  -3.995
   98    HD1  TRP  19           HD1      TRP  19  -6.594  -3.604  -5.467
   99    HE1  TRP  19           HE1      TRP  19  -9.084  -3.036  -5.125
  100    HE3  TRP  19           HE3      TRP  19  -7.839  -7.358  -2.233
  101    HZ2  TRP  19           HZ2      TRP  19 -11.280  -4.051  -3.667
  102    HZ3  TRP  19           HZ3      TRP  19 -10.143  -7.482  -1.398
  103    HH2  TRP  19           HH2      TRP  19 -11.834  -5.865  -2.104
  104    HA   PRO  20           HA       PRO  20  -6.650  -4.327  -1.417
  105    HB2  PRO  20           HB2      PRO  20  -8.064  -4.180   0.821
  106    HB3  PRO  20           HB3      PRO  20  -8.527  -5.297  -0.467
  107    HG2  PRO  20           HG3      PRO  20  -7.249  -5.858   2.152
  108    HG3  PRO  20           HG2      PRO  20  -8.333  -6.874   1.188
  109    HD2  PRO  20           HD3      PRO  20  -5.476  -6.978   1.302
  110    HD3  PRO  20           HD2      PRO  20  -6.557  -7.941   0.274
  111    H    ILE  21           H        ILE  21  -3.871  -4.720  -0.114
  112    HA   ILE  21           HA       ILE  21  -3.995  -2.236   1.435
  113    HB   ILE  21           HB       ILE  21  -2.423  -3.120   3.110
  114   HG12  ILE  21          HG13      ILE  21  -2.953  -5.816   1.835
  115   HG13  ILE  21          HG12      ILE  21  -1.446  -4.918   1.696
  116   HG21  ILE  21          HG21      ILE  21  -5.079  -4.486   2.774
  117   HG22  ILE  21          HG22      ILE  21  -4.661  -3.119   3.811
  118   HG23  ILE  21          HG23      ILE  21  -4.072  -4.735   4.204
  119   HD11  ILE  21          HD11      ILE  21  -0.840  -6.229   3.413
  120   HD12  ILE  21          HD12      ILE  21  -2.504  -6.515   3.924
  121   HD13  ILE  21          HD13      ILE  21  -1.688  -5.015   4.370
  122    H    CYS  22           H        CYS  22  -2.351  -0.859   1.089
  123    HA   CYS  22           HA       CYS  22  -0.471  -1.549  -1.012
  124    HB2  CYS  22           HB3      CYS  22  -1.687   0.698  -0.745
  125    HB3  CYS  22           HB2      CYS  22  -0.473   1.057   0.472
  126    H    THR  23           H        THR  23   1.686  -1.676  -0.826
  127    HA   THR  23           HA       THR  23   2.870  -1.589   1.868
  128    HB   THR  23           HB       THR  23   4.111  -3.683   1.356
  129    HG1  THR  23           HG1      THR  23   2.290  -4.419  -0.621
  130   HG21  THR  23          HG21      THR  23   1.246  -3.495   1.877
  131   HG22  THR  23          HG22      THR  23   2.482  -4.452   2.692
  132   HG23  THR  23          HG23      THR  23   1.730  -5.056   1.216
  133    H    ARG  24           H        ARG  24   4.799  -0.540   1.904
  134    HA   ARG  24           HA       ARG  24   6.011   0.146  -0.647
  135    HB2  ARG  24           HB3      ARG  24   7.347   1.727   0.569
  136    HB3  ARG  24           HB2      ARG  24   5.681   1.918   1.067
  137    HG2  ARG  24           HG3      ARG  24   6.085   0.980   3.170
  138    HG3  ARG  24           HG2      ARG  24   7.616   0.267   2.653
  139    HD2  ARG  24           HD3      ARG  24   6.991   3.164   3.182
  140    HD3  ARG  24           HD2      ARG  24   8.184   2.142   3.983
  141    HE   ARG  24           HE       ARG  24   8.597   3.690   1.671
  142   HH11  ARG  24          HH11      ARG  24   9.465   0.567   3.019
  143   HH12  ARG  24          HH12      ARG  24  10.814   0.342   1.943
  144   HH21  ARG  24          HH22      ARG  24  10.411   3.375   0.283
  145   HH22  ARG  24          HH21      ARG  24  11.331   1.904   0.404
  146    H    ASP  25           H        ASP  25   7.677  -0.936  -1.434
  147    HA   ASP  25           HA       ASP  25   9.347  -2.465  -1.664
  148    HB2  ASP  25           HB3      ASP  25   9.927  -1.736   1.220
  149    HB3  ASP  25           HB2      ASP  25  11.005  -2.651   0.175
  150    H    GLY  26           H        GLY  26   6.682  -3.273  -0.727
  151    HA2  GLY  26           HA3      GLY  26   5.724  -5.351  -0.375
  152    HA3  GLY  26           HA2      GLY  26   7.322  -6.000  -0.043
  153    H    LEU  27           H        LEU  27   6.737  -3.216   1.759
  154    HA   LEU  27           HA       LEU  27   6.054  -4.856   4.108
  155    HB2  LEU  27           HB3      LEU  27   7.520  -2.220   3.975
  156    HB3  LEU  27           HB2      LEU  27   7.145  -3.097   5.445
  157    HG   LEU  27           HG       LEU  27   8.957  -4.096   3.246
  158   HD11  LEU  27          HD11      LEU  27  10.588  -2.939   4.197
  159   HD12  LEU  27          HD12      LEU  27  10.270  -3.740   5.736
  160   HD13  LEU  27          HD13      LEU  27   9.435  -2.240   5.333
  161   HD21  LEU  27          HD21      LEU  27   7.995  -5.267   5.823
  162   HD22  LEU  27          HD22      LEU  27   9.584  -5.693   5.191
  163   HD23  LEU  27          HD23      LEU  27   8.139  -6.021   4.236
  164    HA   PRO  28           HA       PRO  28   2.237  -2.560   4.145
  165    HB2  PRO  28           HB2      PRO  28   1.222  -3.621   6.413
  166    HB3  PRO  28           HB3      PRO  28   1.296  -4.523   4.895
  167    HG2  PRO  28           HG3      PRO  28   3.124  -4.644   7.261
  168    HG3  PRO  28           HG2      PRO  28   2.473  -5.971   6.282
  169    HD2  PRO  28           HD3      PRO  28   4.990  -4.982   5.966
  170    HD3  PRO  28           HD2      PRO  28   4.057  -5.704   4.641
  171    H    VAL  29           H        VAL  29   4.299  -0.974   4.859
  172    HA   VAL  29           HA       VAL  29   3.883   0.026   7.543
  173    HB   VAL  29           HB       VAL  29   5.688   1.125   5.385
  174   HG11  VAL  29          HG11      VAL  29   5.168   2.721   7.173
  175   HG12  VAL  29          HG12      VAL  29   6.863   2.236   7.201
  176   HG13  VAL  29          HG13      VAL  29   5.732   1.554   8.370
  177   HG21  VAL  29          HG21      VAL  29   7.390  -0.250   6.053
  178   HG22  VAL  29          HG22      VAL  29   6.011  -1.321   6.302
  179   HG23  VAL  29          HG23      VAL  29   6.726  -0.470   7.673
  Start of MODEL   10
    1    H1   CYS   1           H        CYS   1   3.177   0.801   4.280
    2    HA   CYS   1           HA       CYS   1   2.406   3.496   4.546
    3    HB2  CYS   1           HB3      CYS   1   0.925   1.669   2.705
    4    HB3  CYS   1           HB2      CYS   1   1.551   3.290   2.409
    5    H    GLY   2           H        GLY   2   0.643   0.462   4.939
    6    HA2  GLY   2           HA3      GLY   2  -1.171  -0.040   6.264
    7    HA3  GLY   2           HA2      GLY   2  -1.116   1.600   6.882
    8    H    GLU   3           H        GLU   3  -1.365   2.853   4.295
    9    HA   GLU   3           HA       GLU   3  -4.108   3.175   4.166
   10    HB2  GLU   3           HB3      GLU   3  -3.744   4.392   2.093
   11    HB3  GLU   3           HB2      GLU   3  -2.512   4.803   3.278
   12    HG2  GLU   3           HG3      GLU   3  -0.901   3.411   2.155
   13    HG3  GLU   3           HG2      GLU   3  -2.133   2.841   1.029
   14    H    THR   4           H        THR   4  -5.724   2.432   2.923
   15    HA   THR   4           HA       THR   4  -5.357  -0.185   1.726
   16    HB   THR   4           HB       THR   4  -7.852   1.470   2.205
   17    HG1  THR   4           HG1      THR   4  -6.360  -0.232   3.781
   18   HG21  THR   4          HG21      THR   4  -9.060  -0.674   1.874
   19   HG22  THR   4          HG22      THR   4  -7.545  -1.409   1.350
   20   HG23  THR   4          HG23      THR   4  -8.260  -0.096   0.413
   21    H    CYS   5           H        CYS   5  -4.900  -0.343  -0.385
   22    HA   CYS   5           HA       CYS   5  -5.494   1.881  -2.156
   23    HB2  CYS   5           HB3      CYS   5  -4.163   0.629  -3.822
   24    HB3  CYS   5           HB2      CYS   5  -3.279   0.908  -2.328
   25    H    PHE   6           H        PHE   6  -7.816   1.155  -1.489
   26    HA   PHE   6           HA       PHE   6  -9.113  -1.037  -2.545
   27    HB2  PHE   6           HB3      PHE   6 -10.142   0.590  -1.002
   28    HB3  PHE   6           HB2      PHE   6 -10.194   1.780  -2.297
   29    HD1  PHE   6           HD1      PHE   6 -11.144  -1.825  -2.040
   30    HD2  PHE   6           HD2      PHE   6 -12.337   2.143  -3.007
   31    HE1  PHE   6           HE1      PHE   6 -13.360  -2.659  -2.713
   32    HE2  PHE   6           HE2      PHE   6 -14.555   1.318  -3.680
   33    HZ   PHE   6           HZ       PHE   6 -15.068  -1.086  -3.534
   34    H    GLY   7           H        GLY   7  -8.526   2.098  -4.121
   35    HA2  GLY   7           HA3      GLY   7  -9.611   1.042  -6.623
   36    HA3  GLY   7           HA2      GLY   7  -9.174   2.715  -6.309
   37    H    GLY   8           H        GLY   8  -6.987   0.156  -5.445
   38    HA2  GLY   8           HA3      GLY   8  -4.920  -0.435  -6.239
   39    HA3  GLY   8           HA2      GLY   8  -5.546  -0.084  -7.841
   40    H    THR   9           H        THR   9  -5.173   2.182  -5.159
   41    HA   THR   9           HA       THR   9  -2.938   3.471  -6.547
   42    HB   THR   9           HB       THR   9  -5.158   5.158  -5.427
   43    HG1  THR   9           HG1      THR   9  -5.269   3.606  -7.677
   44   HG21  THR   9          HG21      THR   9  -4.210   6.894  -6.674
   45   HG22  THR   9          HG22      THR   9  -3.347   5.783  -7.738
   46   HG23  THR   9          HG23      THR   9  -2.811   6.006  -6.073
   47    H    CYS  10           H        CYS  10  -1.619   4.738  -5.173
   48    HA   CYS  10           HA       CYS  10  -2.181   4.551  -2.300
   49    HB2  CYS  10           HB3      CYS  10   0.509   3.966  -3.561
   50    HB3  CYS  10           HB2      CYS  10   0.136   3.935  -1.840
   51    H    ASN  11           H        ASN  11  -1.551   6.270  -1.108
   52    HA   ASN  11           HA       ASN  11  -0.867   8.688  -2.577
   53    HB2  ASN  11           HB3      ASN  11  -1.634   8.239   0.316
   54    HB3  ASN  11           HB2      ASN  11  -1.387   9.814  -0.428
   55   HD21  ASN  11          HD22      ASN  11  -3.528   7.210   0.065
   56   HD22  ASN  11          HD21      ASN  11  -4.865   7.847  -0.829
   57    H    THR  12           H        THR  12   0.728   6.316  -0.759
   58    HA   THR  12           HA       THR  12   2.875   8.147   0.033
   59    HB   THR  12           HB       THR  12   2.697   5.212   0.697
   60    HG1  THR  12           HG1      THR  12   0.785   6.106   1.457
   61   HG21  THR  12          HG21      THR  12   4.598   5.620   1.779
   62   HG22  THR  12          HG22      THR  12   3.758   6.799   2.787
   63   HG23  THR  12          HG23      THR  12   4.537   7.314   1.291
   64    HA   PRO  13           HA       PRO  13   5.193   6.903  -3.574
   65    HB2  PRO  13           HB2      PRO  13   7.579   7.977  -2.746
   66    HB3  PRO  13           HB3      PRO  13   6.284   8.910  -3.501
   67    HG2  PRO  13           HG3      PRO  13   6.973   8.622  -0.606
   68    HG3  PRO  13           HG2      PRO  13   6.477  10.070  -1.503
   69    HD2  PRO  13           HD3      PRO  13   4.764   8.710   0.067
   70    HD3  PRO  13           HD2      PRO  13   4.238   9.499  -1.434
   71    H    GLY  14           H        GLY  14   6.286   5.088  -4.044
   72    HA2  GLY  14           HA3      GLY  14   7.908   3.419  -3.754
   73    HA3  GLY  14           HA2      GLY  14   8.071   3.897  -2.070
   74    H    CYS  15           H        CYS  15   4.922   3.856  -2.267
   75    HA   CYS  15           HA       CYS  15   4.727   1.142  -1.259
   76    HB2  CYS  15           HB3      CYS  15   2.763   3.438  -1.334
   77    HB3  CYS  15           HB2      CYS  15   2.384   1.850  -0.677
   78    H    SER  16           H        SER  16   3.793  -0.503  -2.270
   79    HA   SER  16           HA       SER  16   2.617  -0.023  -4.920
   80    HB2  SER  16           HB3      SER  16   3.886  -2.569  -3.875
   81    HB3  SER  16           HB2      SER  16   3.379  -2.240  -5.532
   82    HG   SER  16           HG       SER  16   5.201  -0.482  -4.360
   83    H    CYS  17           H        CYS  17   0.598  -0.840  -5.333
   84    HA   CYS  17           HA       CYS  17  -1.043  -1.401  -3.110
   85    HB2  CYS  17           HB3      CYS  17  -1.902  -0.315  -5.133
   86    HB3  CYS  17           HB2      CYS  17  -1.646  -1.802  -6.041
   87    H    THR  18           H        THR  18  -1.424  -3.173  -2.096
   88    HA   THR  18           HA       THR  18  -1.112  -5.771  -3.437
   89    HB   THR  18           HB       THR  18  -0.459  -5.349  -0.514
   90    HG1  THR  18           HG1      THR  18   0.993  -4.547  -2.657
   91   HG21  THR  18          HG21      THR  18  -0.910  -7.643  -1.228
   92   HG22  THR  18          HG22      THR  18   0.793  -7.448  -0.812
   93   HG23  THR  18          HG23      THR  18   0.299  -7.496  -2.504
   94    H    TRP  19           H        TRP  19  -3.380  -4.869  -3.690
   95    HA   TRP  19           HA       TRP  19  -5.354  -4.321  -2.117
   96    HB2  TRP  19           HB3      TRP  19  -5.269  -5.388  -4.595
   97    HB3  TRP  19           HB2      TRP  19  -6.057  -6.700  -3.723
   98    HD1  TRP  19           HD1      TRP  19  -6.692  -3.270  -5.142
   99    HE1  TRP  19           HE1      TRP  19  -9.154  -2.616  -4.760
  100    HE3  TRP  19           HE3      TRP  19  -8.030  -7.022  -1.946
  101    HZ2  TRP  19           HZ2      TRP  19 -11.368  -3.573  -3.285
  102    HZ3  TRP  19           HZ3      TRP  19 -10.325  -7.075  -1.080
  103    HH2  TRP  19           HH2      TRP  19 -11.967  -5.388  -1.740
  104    HA   PRO  20           HA       PRO  20  -6.730  -4.060  -1.099
  105    HB2  PRO  20           HB2      PRO  20  -8.097  -3.904   1.168
  106    HB3  PRO  20           HB3      PRO  20  -8.619  -4.984  -0.128
  107    HG2  PRO  20           HG3      PRO  20  -7.311  -5.628   2.458
  108    HG3  PRO  20           HG2      PRO  20  -8.443  -6.593   1.498
  109    HD2  PRO  20           HD3      PRO  20  -5.590  -6.787   1.559
  110    HD3  PRO  20           HD2      PRO  20  -6.717  -7.700   0.537
  111    H    ILE  21           H        ILE  21  -3.939  -4.503   0.067
  112    HA   ILE  21           HA       ILE  21  -3.943  -2.068   1.690
  113    HB   ILE  21           HB       ILE  21  -2.344  -3.025   3.294
  114   HG12  ILE  21          HG13      ILE  21  -2.952  -5.679   1.965
  115   HG13  ILE  21          HG12      ILE  21  -1.437  -4.798   1.803
  116   HG21  ILE  21          HG21      ILE  21  -4.548  -3.018   4.081
  117   HG22  ILE  21          HG22      ILE  21  -3.984  -4.660   4.387
  118   HG23  ILE  21          HG23      ILE  21  -5.034  -4.331   3.006
  119   HD11  ILE  21          HD11      ILE  21  -1.750  -6.759   3.541
  120   HD12  ILE  21          HD12      ILE  21  -2.366  -5.444   4.541
  121   HD13  ILE  21          HD13      ILE  21  -0.731  -5.362   3.884
  122    H    CYS  22           H        CYS  22  -2.256  -0.732   1.318
  123    HA   CYS  22           HA       CYS  22  -0.476  -1.457  -0.863
  124    HB2  CYS  22           HB3      CYS  22  -1.626   0.812  -0.580
  125    HB3  CYS  22           HB2      CYS  22  -0.392   1.149   0.623
  126    H    THR  23           H        THR  23   1.686  -1.632  -0.747
  127    HA   THR  23           HA       THR  23   2.952  -1.559   1.909
  128    HB   THR  23           HB       THR  23   4.135  -3.678   1.378
  129    HG1  THR  23           HG1      THR  23   2.244  -4.347  -0.571
  130   HG21  THR  23          HG21      THR  23   2.533  -4.951   2.351
  131   HG22  THR  23          HG22      THR  23   1.307  -4.497   1.167
  132   HG23  THR  23          HG23      THR  23   1.696  -3.406   2.497
  133    H    ARG  24           H        ARG  24   4.913  -0.579   1.891
  134    HA   ARG  24           HA       ARG  24   6.064   0.097  -0.692
  135    HB2  ARG  24           HB3      ARG  24   7.493   1.621   0.524
  136    HB3  ARG  24           HB2      ARG  24   5.825   1.891   0.978
  137    HG2  ARG  24           HG3      ARG  24   6.137   0.927   3.096
  138    HG3  ARG  24           HG2      ARG  24   7.671   0.194   2.625
  139    HD2  ARG  24           HD3      ARG  24   7.060   3.077   3.202
  140    HD3  ARG  24           HD2      ARG  24   8.282   2.041   3.937
  141    HE   ARG  24           HE       ARG  24   8.661   3.700   1.724
  142   HH11  ARG  24          HH11      ARG  24   9.444   0.424   2.723
  143   HH12  ARG  24          HH12      ARG  24  10.745   0.261   1.578
  144   HH21  ARG  24          HH22      ARG  24  10.426   3.462   0.259
  145   HH22  ARG  24          HH21      ARG  24  11.290   1.953   0.207
  146    H    ASP  25           H        ASP  25   7.644  -1.056  -1.531
  147    HA   ASP  25           HA       ASP  25   9.234  -2.651  -1.820
  148    HB2  ASP  25           HB3      ASP  25  10.040  -1.742   0.951
  149    HB3  ASP  25           HB2      ASP  25  10.970  -2.895   0.004
  150    H    GLY  26           H        GLY  26   6.641  -3.391  -0.784
  151    HA2  GLY  26           HA3      GLY  26   5.659  -5.431  -0.316
  152    HA3  GLY  26           HA2      GLY  26   7.255  -6.095  -0.009
  153    H    LEU  27           H        LEU  27   6.852  -3.265   1.740
  154    HA   LEU  27           HA       LEU  27   6.198  -4.823   4.148
  155    HB2  LEU  27           HB3      LEU  27   7.652  -2.188   3.896
  156    HB3  LEU  27           HB2      LEU  27   7.335  -3.034   5.398
  157    HG   LEU  27           HG       LEU  27   9.069  -4.073   3.156
  158   HD11  LEU  27          HD11      LEU  27  10.943  -3.581   4.571
  159   HD12  LEU  27          HD12      LEU  27   9.877  -3.022   5.861
  160   HD13  LEU  27          HD13      LEU  27   9.996  -2.109   4.356
  161   HD21  LEU  27          HD21      LEU  27   9.394  -5.984   4.342
  162   HD22  LEU  27          HD22      LEU  27   7.756  -5.616   4.882
  163   HD23  LEU  27          HD23      LEU  27   9.135  -5.195   5.898
  164    HA   PRO  28           HA       PRO  28   2.374  -2.531   4.233
  165    HB2  PRO  28           HB2      PRO  28   1.936  -3.732   6.854
  166    HB3  PRO  28           HB3      PRO  28   1.077  -4.023   5.340
  167    HG2  PRO  28           HG3      PRO  28   2.696  -5.869   6.487
  168    HG3  PRO  28           HG2      PRO  28   2.459  -5.752   4.734
  169    HD2  PRO  28           HD3      PRO  28   4.731  -4.751   6.413
  170    HD3  PRO  28           HD2      PRO  28   4.771  -5.558   4.830
  171    H    VAL  29           H        VAL  29   4.449  -0.923   4.836
  172    HA   VAL  29           HA       VAL  29   4.130   0.133   7.512
  173    HB   VAL  29           HB       VAL  29   5.852   1.180   5.261
  174   HG11  VAL  29          HG11      VAL  29   6.006   2.943   6.640
  175   HG12  VAL  29          HG12      VAL  29   7.079   1.902   7.577
  176   HG13  VAL  29          HG13      VAL  29   5.379   2.045   8.023
  177   HG21  VAL  29          HG21      VAL  29   7.280  -0.114   7.408
  178   HG22  VAL  29          HG22      VAL  29   7.357  -0.405   5.671
  179   HG23  VAL  29          HG23      VAL  29   6.136  -1.219   6.649
  Start of MODEL   11
    1    H1   CYS   1           H        CYS   1   3.122   0.851   4.392
    2    HA   CYS   1           HA       CYS   1   2.851   3.639   4.514
    3    HB2  CYS   1           HB3      CYS   1   0.998   1.946   2.877
    4    HB3  CYS   1           HB2      CYS   1   1.794   3.460   2.449
    5    H    GLY   2           H        GLY   2   0.704   1.023   5.436
    6    HA2  GLY   2           HA3      GLY   2  -1.177   0.988   6.745
    7    HA3  GLY   2           HA2      GLY   2  -0.735   2.601   7.274
    8    H    GLU   3           H        GLU   3  -1.577   1.467   4.022
    9    HA   GLU   3           HA       GLU   3  -4.080   2.948   4.175
   10    HB2  GLU   3           HB3      GLU   3  -3.665   4.171   2.124
   11    HB3  GLU   3           HB2      GLU   3  -2.414   4.545   3.299
   12    HG2  GLU   3           HG3      GLU   3  -0.798   3.326   2.147
   13    HG3  GLU   3           HG2      GLU   3  -2.003   2.435   1.217
   14    H    THR   4           H        THR   4  -5.668   2.217   2.836
   15    HA   THR   4           HA       THR   4  -5.165  -0.369   1.585
   16    HB   THR   4           HB       THR   4  -7.747  -0.338   1.449
   17    HG1  THR   4           HG1      THR   4  -8.539   1.089   3.249
   18   HG21  THR   4          HG21      THR   4  -6.624  -0.268   4.242
   19   HG22  THR   4          HG22      THR   4  -6.280  -1.585   3.119
   20   HG23  THR   4          HG23      THR   4  -7.941  -1.261   3.616
   21    H    CYS   5           H        CYS   5  -4.730  -0.360  -0.542
   22    HA   CYS   5           HA       CYS   5  -5.559   1.901  -2.161
   23    HB2  CYS   5           HB3      CYS   5  -4.154   0.877  -3.926
   24    HB3  CYS   5           HB2      CYS   5  -3.274   1.171  -2.432
   25    H    PHE   6           H        PHE   6  -7.836   0.918  -1.578
   26    HA   PHE   6           HA       PHE   6  -8.828  -1.300  -2.965
   27    HB2  PHE   6           HB3      PHE   6 -10.091   1.174  -1.848
   28    HB3  PHE   6           HB2      PHE   6 -11.050   0.106  -2.864
   29    HD1  PHE   6           HD2      PHE   6  -8.516  -0.529  -0.190
   30    HD2  PHE   6           HD1      PHE   6 -12.498  -1.098  -1.575
   31    HE1  PHE   6           HE2      PHE   6  -8.983  -1.962   1.752
   32    HE2  PHE   6           HE1      PHE   6 -12.972  -2.532   0.367
   33    HZ   PHE   6           HZ       PHE   6 -11.213  -2.967   2.033
   34    H    GLY   7           H        GLY   7  -8.363   2.030  -3.981
   35    HA2  GLY   7           HA3      GLY   7  -9.625   1.536  -6.554
   36    HA3  GLY   7           HA2      GLY   7  -8.946   3.058  -6.002
   37    H    GLY   8           H        GLY   8  -6.931   0.318  -5.570
   38    HA2  GLY   8           HA3      GLY   8  -5.132  -0.511  -6.757
   39    HA3  GLY   8           HA2      GLY   8  -5.693   0.380  -8.161
   40    H    THR   9           H        THR   9  -5.679   2.945  -6.702
   41    HA   THR   9           HA       THR   9  -2.862   3.530  -7.079
   42    HB   THR   9           HB       THR   9  -4.914   5.566  -6.284
   43    HG1  THR   9           HG1      THR   9  -5.093   3.951  -8.423
   44   HG21  THR   9          HG21      THR   9  -3.555   7.081  -7.490
   45   HG22  THR   9          HG22      THR   9  -2.680   5.776  -8.292
   46   HG23  THR   9          HG23      THR   9  -2.437   6.074  -6.571
   47    H    CYS  10           H        CYS  10  -1.569   4.565  -5.538
   48    HA   CYS  10           HA       CYS  10  -2.444   4.215  -2.754
   49    HB2  CYS  10           HB3      CYS  10   0.357   4.097  -3.895
   50    HB3  CYS  10           HB2      CYS  10  -0.048   3.962  -2.186
   51    H    ASN  11           H        ASN  11  -1.844   5.782  -1.243
   52    HA   ASN  11           HA       ASN  11  -1.703   8.465  -2.350
   53    HB2  ASN  11           HB3      ASN  11  -2.111   7.439   0.465
   54    HB3  ASN  11           HB2      ASN  11  -2.119   9.143   0.022
   55   HD21  ASN  11          HD22      ASN  11  -3.864   6.192   0.058
   56   HD22  ASN  11          HD21      ASN  11  -5.351   6.817  -0.573
   57    H    THR  12           H        THR  12   0.324   6.219  -0.614
   58    HA   THR  12           HA       THR  12   2.301   8.342  -0.176
   59    HB   THR  12           HB       THR  12   3.489   6.569   1.203
   60    HG1  THR  12           HG1      THR  12   0.993   5.245   0.750
   61   HG21  THR  12          HG21      THR  12   0.719   7.421   2.054
   62   HG22  THR  12          HG22      THR  12   2.196   8.372   2.221
   63   HG23  THR  12          HG23      THR  12   2.004   6.874   3.132
   64    HA   PRO  13           HA       PRO  13   4.596   6.947  -3.703
   65    HB2  PRO  13           HB2      PRO  13   6.801   8.509  -2.543
   66    HB3  PRO  13           HB3      PRO  13   5.949   8.739  -4.072
   67    HG2  PRO  13           HG3      PRO  13   5.626  10.424  -2.003
   68    HG3  PRO  13           HG2      PRO  13   4.298  10.031  -3.110
   69    HD2  PRO  13           HD3      PRO  13   4.850   8.975  -0.361
   70    HD3  PRO  13           HD2      PRO  13   3.305   9.457  -1.093
   71    H    GLY  14           H        GLY  14   6.017   5.323  -4.111
   72    HA2  GLY  14           HA3      GLY  14   7.915   3.980  -3.687
   73    HA3  GLY  14           HA2      GLY  14   7.856   4.472  -1.999
   74    H    CYS  15           H        CYS  15   4.855   3.983  -2.173
   75    HA   CYS  15           HA       CYS  15   4.997   1.198  -1.383
   76    HB2  CYS  15           HB3      CYS  15   2.780   3.249  -1.233
   77    HB3  CYS  15           HB2      CYS  15   2.638   1.594  -0.648
   78    H    SER  16           H        SER  16   4.028  -0.463  -2.409
   79    HA   SER  16           HA       SER  16   2.899   0.085  -5.067
   80    HB2  SER  16           HB3      SER  16   4.115  -2.493  -4.037
   81    HB3  SER  16           HB2      SER  16   3.648  -2.134  -5.700
   82    HG   SER  16           HG       SER  16   5.413  -0.345  -4.550
   83    H    CYS  17           H        CYS  17   0.850  -0.591  -5.501
   84    HA   CYS  17           HA       CYS  17  -0.823  -1.239  -3.334
   85    HB2  CYS  17           HB3      CYS  17  -1.627  -0.028  -5.317
   86    HB3  CYS  17           HB2      CYS  17  -1.429  -1.490  -6.280
   87    H    THR  18           H        THR  18  -1.305  -3.033  -2.432
   88    HA   THR  18           HA       THR  18  -1.017  -5.582  -3.865
   89    HB   THR  18           HB       THR  18  -0.448  -5.302  -0.910
   90    HG1  THR  18           HG1      THR  18   1.063  -4.341  -2.904
   91   HG21  THR  18          HG21      THR  18   1.000  -7.319  -2.421
   92   HG22  THR  18          HG22      THR  18  -0.747  -7.492  -2.591
   93   HG23  THR  18          HG23      THR  18  -0.013  -7.498  -0.988
   94    H    TRP  19           H        TRP  19  -3.265  -4.708  -4.172
   95    HA   TRP  19           HA       TRP  19  -5.274  -4.134  -2.655
   96    HB2  TRP  19           HB3      TRP  19  -5.148  -5.233  -5.118
   97    HB3  TRP  19           HB2      TRP  19  -5.970  -6.523  -4.245
   98    HD1  TRP  19           HD1      TRP  19  -6.529  -3.088  -5.698
   99    HE1  TRP  19           HE1      TRP  19  -8.990  -2.399  -5.367
  100    HE3  TRP  19           HE3      TRP  19  -7.993  -6.819  -2.527
  101    HZ2  TRP  19           HZ2      TRP  19 -11.247  -3.318  -3.939
  102    HZ3  TRP  19           HZ3      TRP  19 -10.307  -6.834  -1.710
  103    HH2  TRP  19           HH2      TRP  19 -11.907  -5.122  -2.407
  104    HA   PRO  20           HA       PRO  20  -6.682  -3.856  -1.687
  105    HB2  PRO  20           HB2      PRO  20  -8.107  -3.656   0.537
  106    HB3  PRO  20           HB3      PRO  20  -8.592  -4.768  -0.748
  107    HG2  PRO  20           HG3      PRO  20  -7.336  -5.349   1.881
  108    HG3  PRO  20           HG2      PRO  20  -8.459  -6.332   0.929
  109    HD2  PRO  20           HD3      PRO  20  -5.613  -6.549   1.040
  110    HD3  PRO  20           HD2      PRO  20  -6.728  -7.464   0.007
  111    H    ILE  21           H        ILE  21  -3.926  -4.329  -0.368
  112    HA   ILE  21           HA       ILE  21  -3.956  -1.832   1.164
  113    HB   ILE  21           HB       ILE  21  -2.453  -2.763   2.868
  114   HG12  ILE  21          HG13      ILE  21  -3.035  -5.447   1.589
  115   HG13  ILE  21          HG12      ILE  21  -1.502  -4.590   1.473
  116   HG21  ILE  21          HG21      ILE  21  -5.142  -4.053   2.494
  117   HG22  ILE  21          HG22      ILE  21  -4.697  -2.704   3.543
  118   HG23  ILE  21          HG23      ILE  21  -4.162  -4.339   3.935
  119   HD11  ILE  21          HD11      ILE  21  -1.752  -4.671   4.132
  120   HD12  ILE  21          HD12      ILE  21  -0.979  -5.947   3.192
  121   HD13  ILE  21          HD13      ILE  21  -2.656  -6.125   3.708
  122    H    CYS  22           H        CYS  22  -2.194  -0.558   0.883
  123    HA   CYS  22           HA       CYS  22  -0.349  -1.325  -1.225
  124    HB2  CYS  22           HB3      CYS  22  -1.470   0.988  -0.895
  125    HB3  CYS  22           HB2      CYS  22  -0.188   1.264   0.272
  126    H    THR  23           H        THR  23   1.833  -1.497  -1.010
  127    HA   THR  23           HA       THR  23   2.951  -1.513   1.709
  128    HB   THR  23           HB       THR  23   4.093  -3.666   1.210
  129    HG1  THR  23           HG1      THR  23   2.271  -4.277  -0.814
  130   HG21  THR  23          HG21      THR  23   2.408  -4.896   2.098
  131   HG22  THR  23          HG22      THR  23   1.250  -4.386   0.870
  132   HG23  THR  23          HG23      THR  23   1.620  -3.324   2.230
  133    H    ARG  24           H        ARG  24   4.928  -0.576   1.801
  134    HA   ARG  24           HA       ARG  24   6.277   0.013  -0.714
  135    HB2  ARG  24           HB3      ARG  24   7.651   1.539   0.556
  136    HB3  ARG  24           HB2      ARG  24   5.968   1.854   0.920
  137    HG2  ARG  24           HG3      ARG  24   6.151   0.951   3.070
  138    HG3  ARG  24           HG2      ARG  24   7.667   0.129   2.691
  139    HD2  ARG  24           HD3      ARG  24   7.193   3.076   3.092
  140    HD3  ARG  24           HD2      ARG  24   8.244   2.005   4.019
  141    HE   ARG  24           HE       ARG  24   8.951   3.445   1.708
  142   HH11  ARG  24          HH11      ARG  24   9.490   0.317   3.209
  143   HH12  ARG  24          HH12      ARG  24  10.906  -0.028   2.259
  144   HH21  ARG  24          HH22      ARG  24  10.849   2.969   0.490
  145   HH22  ARG  24          HH21      ARG  24  11.652   1.445   0.726
  146    H    ASP  25           H        ASP  25   7.950  -1.171  -1.376
  147    HA   ASP  25           HA       ASP  25   9.556  -2.781  -1.462
  148    HB2  ASP  25           HB3      ASP  25   9.958  -2.044   1.451
  149    HB3  ASP  25           HB2      ASP  25  11.056  -3.037   0.503
  150    H    GLY  26           H        GLY  26   6.788  -3.425  -0.714
  151    HA2  GLY  26           HA3      GLY  26   5.676  -5.427  -0.396
  152    HA3  GLY  26           HA2      GLY  26   7.210  -6.177   0.022
  153    H    LEU  27           H        LEU  27   6.695  -3.349   1.788
  154    HA   LEU  27           HA       LEU  27   5.737  -4.928   4.084
  155    HB2  LEU  27           HB3      LEU  27   7.506  -2.481   4.062
  156    HB3  LEU  27           HB2      LEU  27   6.937  -3.302   5.502
  157    HG   LEU  27           HG       LEU  27   8.752  -4.516   3.416
  158   HD11  LEU  27          HD11      LEU  27  10.449  -4.384   5.226
  159   HD12  LEU  27          HD12      LEU  27   9.318  -3.400   6.156
  160   HD13  LEU  27          HD13      LEU  27   9.936  -2.812   4.612
  161   HD21  LEU  27          HD21      LEU  27   8.790  -5.861   5.921
  162   HD22  LEU  27          HD22      LEU  27   8.304  -6.482   4.343
  163   HD23  LEU  27          HD23      LEU  27   7.113  -5.714   5.394
  164    HA   PRO  28           HA       PRO  28   2.230  -2.178   3.916
  165    HB2  PRO  28           HB2      PRO  28   0.896  -3.197   6.027
  166    HB3  PRO  28           HB3      PRO  28   1.008  -4.050   4.482
  167    HG2  PRO  28           HG3      PRO  28   2.574  -4.469   6.998
  168    HG3  PRO  28           HG2      PRO  28   1.877  -5.673   5.900
  169    HD2  PRO  28           HD3      PRO  28   4.512  -4.954   5.875
  170    HD3  PRO  28           HD2      PRO  28   3.645  -5.550   4.446
  171    H    VAL  29           H        VAL  29   4.405  -0.897   4.884
  172    HA   VAL  29           HA       VAL  29   3.879   0.033   7.578
  173    HB   VAL  29           HB       VAL  29   5.981   1.027   5.648
  174   HG11  VAL  29          HG11      VAL  29   6.498   1.074   8.534
  175   HG12  VAL  29          HG12      VAL  29   5.201   2.142   7.999
  176   HG13  VAL  29          HG13      VAL  29   6.813   2.295   7.302
  177   HG21  VAL  29          HG21      VAL  29   5.867  -1.527   6.470
  178   HG22  VAL  29          HG22      VAL  29   6.746  -0.815   7.822
  179   HG23  VAL  29          HG23      VAL  29   7.379  -0.665   6.183
  Start of MODEL   12
    1    H1   CYS   1           H        CYS   1   3.428   2.141   3.948
    2    HA   CYS   1           HA       CYS   1   2.468   4.792   4.484
    3    HB2  CYS   1           HB3      CYS   1   1.448   2.736   2.510
    4    HB3  CYS   1           HB2      CYS   1   1.024   4.445   2.532
    5    H    GLY   2           H        GLY   2   1.288   1.513   4.891
    6    HA2  GLY   2           HA3      GLY   2  -0.409   0.632   6.148
    7    HA3  GLY   2           HA2      GLY   2  -0.334   2.111   7.090
    8    H    GLU   3           H        GLU   3  -1.119   1.921   3.668
    9    HA   GLU   3           HA       GLU   3  -3.835   2.826   4.334
   10    HB2  GLU   3           HB3      GLU   3  -3.829   3.983   2.145
   11    HB3  GLU   3           HB2      GLU   3  -2.602   4.594   3.248
   12    HG2  GLU   3           HG3      GLU   3  -0.869   3.516   2.071
   13    HG3  GLU   3           HG2      GLU   3  -2.009   2.545   1.139
   14    H    THR   4           H        THR   4  -5.553   2.039   3.118
   15    HA   THR   4           HA       THR   4  -5.068  -0.585   1.954
   16    HB   THR   4           HB       THR   4  -7.587  -0.735   2.009
   17    HG1  THR   4           HG1      THR   4  -7.715   1.701   2.085
   18   HG21  THR   4          HG21      THR   4  -5.807  -1.214   3.975
   19   HG22  THR   4          HG22      THR   4  -7.538  -1.508   4.142
   20   HG23  THR   4          HG23      THR   4  -6.831  -0.023   4.778
   21    H    CYS   5           H        CYS   5  -4.846  -0.773  -0.203
   22    HA   CYS   5           HA       CYS   5  -5.819   1.355  -1.929
   23    HB2  CYS   5           HB3      CYS   5  -4.644   0.087  -3.743
   24    HB3  CYS   5           HB2      CYS   5  -3.599   0.630  -2.437
   25    H    PHE   6           H        PHE   6  -8.004   0.533  -1.065
   26    HA   PHE   6           HA       PHE   6  -9.205  -1.807  -1.962
   27    HB2  PHE   6           HB3      PHE   6 -10.213  -0.248  -0.322
   28    HB3  PHE   6           HB2      PHE   6 -10.497   0.912  -1.614
   29    HD1  PHE   6           HD2      PHE   6 -11.099  -2.755  -1.222
   30    HD2  PHE   6           HD1      PHE   6 -12.716   1.075  -2.129
   31    HE1  PHE   6           HE2      PHE   6 -13.290  -3.787  -1.658
   32    HE2  PHE   6           HE1      PHE   6 -14.909   0.051  -2.565
   33    HZ   PHE   6           HZ       PHE   6 -15.199  -2.384  -2.331
   34    H    GLY   7           H        GLY   7  -8.841   1.319  -3.569
   35    HA2  GLY   7           HA3      GLY   7 -10.175   0.310  -5.961
   36    HA3  GLY   7           HA2      GLY   7  -9.640   1.961  -5.689
   37    H    GLY   8           H        GLY   8  -7.437  -0.629  -5.005
   38    HA2  GLY   8           HA3      GLY   8  -5.624  -1.467  -6.156
   39    HA3  GLY   8           HA2      GLY   8  -6.253  -0.728  -7.616
   40    H    THR   9           H        THR   9  -6.301   1.970  -6.567
   41    HA   THR   9           HA       THR   9  -3.481   2.560  -6.930
   42    HB   THR   9           HB       THR   9  -5.586   4.655  -6.550
   43    HG1  THR   9           HG1      THR   9  -5.683   2.703  -8.390
   44   HG21  THR   9          HG21      THR   9  -3.440   4.680  -8.623
   45   HG22  THR   9          HG22      THR   9  -3.004   4.974  -6.939
   46   HG23  THR   9          HG23      THR   9  -4.169   6.025  -7.745
   47    H    CYS  10           H        CYS  10  -2.250   3.814  -5.540
   48    HA   CYS  10           HA       CYS  10  -3.184   3.902  -2.755
   49    HB2  CYS  10           HB3      CYS  10  -0.328   3.891  -3.771
   50    HB3  CYS  10           HB2      CYS  10  -0.831   3.838  -2.085
   51    H    ASN  11           H        ASN  11  -2.619   5.749  -1.499
   52    HA   ASN  11           HA       ASN  11  -2.683   8.206  -3.056
   53    HB2  ASN  11           HB3      ASN  11  -4.224   7.959  -1.169
   54    HB3  ASN  11           HB2      ASN  11  -2.871   7.705  -0.073
   55   HD21  ASN  11          HD22      ASN  11  -2.243   9.405   1.028
   56   HD22  ASN  11          HD21      ASN  11  -2.489  11.056   0.585
   57    H    THR  12           H        THR  12  -0.516   6.382  -1.034
   58    HA   THR  12           HA       THR  12   1.451   8.560  -1.077
   59    HB   THR  12           HB       THR  12   1.730   5.947   0.390
   60    HG1  THR  12           HG1      THR  12  -0.172   6.759   1.170
   61   HG21  THR  12          HG21      THR  12   3.749   6.997   0.575
   62   HG22  THR  12          HG22      THR  12   2.917   7.723   1.950
   63   HG23  THR  12          HG23      THR  12   3.051   8.610   0.431
   64    HA   PRO  13           HA       PRO  13   3.396   6.326  -4.446
   65    HB2  PRO  13           HB2      PRO  13   5.459   8.400  -4.241
   66    HB3  PRO  13           HB3      PRO  13   4.369   8.040  -5.583
   67    HG2  PRO  13           HG3      PRO  13   4.119  10.269  -4.080
   68    HG3  PRO  13           HG2      PRO  13   2.723   9.443  -4.796
   69    HD2  PRO  13           HD3      PRO  13   3.745   9.347  -1.981
   70    HD3  PRO  13           HD2      PRO  13   2.070   9.437  -2.570
   71    H    GLY  14           H        GLY  14   4.891   4.770  -4.441
   72    HA2  GLY  14           HA3      GLY  14   7.178   4.113  -3.873
   73    HA3  GLY  14           HA2      GLY  14   6.885   4.796  -2.278
   74    H    CYS  15           H        CYS  15   4.168   3.787  -2.141
   75    HA   CYS  15           HA       CYS  15   4.826   1.065  -1.328
   76    HB2  CYS  15           HB3      CYS  15   2.514   2.903  -0.775
   77    HB3  CYS  15           HB2      CYS  15   2.393   1.178  -0.442
   78    H    SER  16           H        SER  16   4.177  -0.708  -2.341
   79    HA   SER  16           HA       SER  16   2.738  -0.408  -4.847
   80    HB2  SER  16           HB3      SER  16   3.977  -2.894  -3.632
   81    HB3  SER  16           HB2      SER  16   3.459  -2.679  -5.306
   82    HG   SER  16           HG       SER  16   5.739  -2.403  -5.000
   83    H    CYS  17           H        CYS  17   0.684  -1.160  -5.182
   84    HA   CYS  17           HA       CYS  17  -0.916  -1.617  -2.901
   85    HB2  CYS  17           HB3      CYS  17  -1.905  -0.587  -4.843
   86    HB3  CYS  17           HB2      CYS  17  -1.554  -2.006  -5.824
   87    H    THR  18           H        THR  18  -1.008  -3.315  -1.776
   88    HA   THR  18           HA       THR  18  -0.781  -5.971  -3.022
   89    HB   THR  18           HB       THR  18  -0.147  -5.423  -0.123
   90    HG1  THR  18           HG1      THR  18   1.184  -4.323  -2.052
   91   HG21  THR  18          HG21      THR  18   0.125  -7.666  -2.019
   92   HG22  THR  18          HG22      THR  18  -0.105  -7.683  -0.270
   93   HG23  THR  18          HG23      THR  18   1.502  -7.409  -0.946
   94    H    TRP  19           H        TRP  19  -3.058  -5.266  -3.348
   95    HA   TRP  19           HA       TRP  19  -5.052  -4.614  -1.855
   96    HB2  TRP  19           HB3      TRP  19  -4.955  -5.943  -4.180
   97    HB3  TRP  19           HB2      TRP  19  -5.632  -7.208  -3.160
   98    HD1  TRP  19           HD1      TRP  19  -6.551  -4.032  -4.946
   99    HE1  TRP  19           HE1      TRP  19  -9.043  -3.503  -4.560
  100    HE3  TRP  19           HE3      TRP  19  -7.539  -7.430  -1.261
  101    HZ2  TRP  19           HZ2      TRP  19 -11.144  -4.411  -2.909
  102    HZ3  TRP  19           HZ3      TRP  19  -9.804  -7.530  -0.321
  103    HH2  TRP  19           HH2      TRP  19 -11.574  -6.053  -1.131
  104    HA   PRO  20           HA       PRO  20  -6.376  -4.248  -0.855
  105    HB2  PRO  20           HB2      PRO  20  -7.758  -3.857   1.364
  106    HB3  PRO  20           HB3      PRO  20  -8.232  -5.120   0.227
  107    HG2  PRO  20           HG3      PRO  20  -6.901  -5.360   2.871
  108    HG3  PRO  20           HG2      PRO  20  -8.005  -6.483   2.060
  109    HD2  PRO  20           HD3      PRO  20  -5.144  -6.571   2.118
  110    HD3  PRO  20           HD2      PRO  20  -6.247  -7.652   1.241
  111    H    ILE  21           H        ILE  21  -3.559  -4.448   0.355
  112    HA   ILE  21           HA       ILE  21  -3.650  -1.831   1.668
  113    HB   ILE  21           HB       ILE  21  -2.044  -2.554   3.402
  114   HG12  ILE  21          HG13      ILE  21  -2.668  -5.358   2.447
  115   HG13  ILE  21          HG12      ILE  21  -1.144  -4.522   2.178
  116   HG21  ILE  21          HG21      ILE  21  -4.722  -3.923   3.293
  117   HG22  ILE  21          HG22      ILE  21  -4.294  -2.414   4.105
  118   HG23  ILE  21          HG23      ILE  21  -3.691  -3.951   4.727
  119   HD11  ILE  21          HD11      ILE  21  -2.267  -5.119   4.901
  120   HD12  ILE  21          HD12      ILE  21  -0.655  -4.518   4.510
  121   HD13  ILE  21          HD13      ILE  21  -1.122  -6.157   4.050
  122    H    CYS  22           H        CYS  22  -2.017  -0.502   1.163
  123    HA   CYS  22           HA       CYS  22  -0.120  -1.340  -0.870
  124    HB2  CYS  22           HB3      CYS  22  -0.320   1.341   0.502
  125    HB3  CYS  22           HB2      CYS  22   0.527   0.984  -0.993
  126    H    THR  23           H        THR  23   1.945  -1.818  -0.575
  127    HA   THR  23           HA       THR  23   3.303  -1.078   1.904
  128    HB   THR  23           HB       THR  23   4.244  -3.365   2.114
  129    HG1  THR  23           HG1      THR  23   2.192  -4.232   0.353
  130   HG21  THR  23          HG21      THR  23   1.732  -4.389   2.559
  131   HG22  THR  23          HG22      THR  23   1.469  -2.647   2.647
  132   HG23  THR  23          HG23      THR  23   2.660  -3.414   3.699
  133    H    ARG  24           H        ARG  24   5.470  -0.599   1.558
  134    HA   ARG  24           HA       ARG  24   6.368  -0.861  -1.202
  135    HB2  ARG  24           HB3      ARG  24   8.038   0.756  -0.708
  136    HB3  ARG  24           HB2      ARG  24   6.526   1.368  -0.078
  137    HG2  ARG  24           HG3      ARG  24   7.190   1.075   2.127
  138    HG3  ARG  24           HG2      ARG  24   8.450  -0.084   1.695
  139    HD2  ARG  24           HD3      ARG  24   8.443   2.900   1.287
  140    HD3  ARG  24           HD2      ARG  24   9.566   1.935   2.244
  141    HE   ARG  24           HE       ARG  24   9.795   2.543  -0.501
  142   HH11  ARG  24          HH11      ARG  24  10.401  -0.072   1.763
  143   HH12  ARG  24          HH12      ARG  24  11.498  -0.898   0.696
  144   HH21  ARG  24          HH22      ARG  24  11.272   1.433  -1.877
  145   HH22  ARG  24          HH21      ARG  24  11.969  -0.071  -1.346
  146    H    ASP  25           H        ASP  25   7.660  -2.464  -1.734
  147    HA   ASP  25           HA       ASP  25   9.010  -4.293  -1.609
  148    HB2  ASP  25           HB3      ASP  25  10.212  -2.781   0.728
  149    HB3  ASP  25           HB2      ASP  25  10.927  -4.202  -0.023
  150    H    GLY  26           H        GLY  26   6.476  -4.220  -0.165
  151    HA2  GLY  26           HA3      GLY  26   5.314  -5.858   0.999
  152    HA3  GLY  26           HA2      GLY  26   6.845  -6.609   1.421
  153    H    LEU  27           H        LEU  27   7.130  -3.396   2.152
  154    HA   LEU  27           HA       LEU  27   6.566  -3.937   4.975
  155    HB2  LEU  27           HB3      LEU  27   8.142  -1.704   3.694
  156    HB3  LEU  27           HB2      LEU  27   7.957  -1.956   5.419
  157    HG   LEU  27           HG       LEU  27   9.331  -3.868   3.527
  158   HD11  LEU  27          HD11      LEU  27  10.552  -1.754   3.839
  159   HD12  LEU  27          HD12      LEU  27  11.392  -3.130   4.554
  160   HD13  LEU  27          HD13      LEU  27  10.506  -2.004   5.584
  161   HD21  LEU  27          HD21      LEU  27   9.422  -3.908   6.526
  162   HD22  LEU  27          HD22      LEU  27   9.879  -5.175   5.387
  163   HD23  LEU  27          HD23      LEU  27   8.179  -4.776   5.626
  164    HA   PRO  28           HA       PRO  28   2.980  -1.303   4.600
  165    HB2  PRO  28           HB2      PRO  28   2.086  -1.629   7.118
  166    HB3  PRO  28           HB3      PRO  28   1.952  -2.909   5.906
  167    HG2  PRO  28           HG3      PRO  28   3.936  -2.593   8.120
  168    HG3  PRO  28           HG2      PRO  28   3.120  -4.058   7.546
  169    HD2  PRO  28           HD3      PRO  28   5.689  -3.357   6.869
  170    HD3  PRO  28           HD2      PRO  28   4.647  -4.397   5.879
  171    H    VAL  29           H        VAL  29   4.812   0.396   4.457
  172    HA   VAL  29           HA       VAL  29   5.253   1.885   6.889
  173    HB   VAL  29           HB       VAL  29   6.089   2.572   4.070
  174   HG11  VAL  29          HG11      VAL  29   7.154   3.609   6.694
  175   HG12  VAL  29          HG12      VAL  29   6.041   4.482   5.640
  176   HG13  VAL  29          HG13      VAL  29   7.667   4.094   5.078
  177   HG21  VAL  29          HG21      VAL  29   8.376   1.827   5.243
  178   HG22  VAL  29          HG22      VAL  29   7.346   0.709   4.349
  179   HG23  VAL  29          HG23      VAL  29   7.255   0.776   6.109
  Start of MODEL   13
    1    H1   CYS   1           H        CYS   1   3.345   1.438   4.141
    2    HA   CYS   1           HA       CYS   1   2.527   4.105   4.726
    3    HB2  CYS   1           HB3      CYS   1   1.624   2.189   2.569
    4    HB3  CYS   1           HB2      CYS   1   1.140   3.880   2.661
    5    H    GLY   2           H        GLY   2   0.976   0.947   4.859
    6    HA2  GLY   2           HA3      GLY   2  -0.779   0.239   6.172
    7    HA3  GLY   2           HA2      GLY   2  -0.850   1.847   6.868
    8    H    GLU   3           H        GLU   3  -1.212   3.156   4.279
    9    HA   GLU   3           HA       GLU   3  -3.963   3.327   4.207
   10    HB2  GLU   3           HB3      GLU   3  -3.717   4.526   2.103
   11    HB3  GLU   3           HB2      GLU   3  -2.484   5.024   3.252
   12    HG2  GLU   3           HG3      GLU   3  -0.819   3.730   2.118
   13    HG3  GLU   3           HG2      GLU   3  -2.034   3.027   1.050
   14    H    THR   4           H        THR   4  -5.576   2.430   3.086
   15    HA   THR   4           HA       THR   4  -5.060  -0.145   1.860
   16    HB   THR   4           HB       THR   4  -7.575  -0.289   1.841
   17    HG1  THR   4           HG1      THR   4  -7.684   2.158   1.919
   18   HG21  THR   4          HG21      THR   4  -6.095   0.233   4.410
   19   HG22  THR   4          HG22      THR   4  -6.513  -1.318   3.682
   20   HG23  THR   4          HG23      THR   4  -7.774  -0.307   4.385
   21    H    CYS   5           H        CYS   5  -4.843  -0.361  -0.288
   22    HA   CYS   5           HA       CYS   5  -5.661   1.825  -2.018
   23    HB2  CYS   5           HB3      CYS   5  -4.466   0.582  -3.797
   24    HB3  CYS   5           HB2      CYS   5  -3.450   0.946  -2.410
   25    H    PHE   6           H        PHE   6  -7.906   1.099  -1.210
   26    HA   PHE   6           HA       PHE   6  -9.224  -1.152  -2.129
   27    HB2  PHE   6           HB3      PHE   6 -10.182   0.472  -0.539
   28    HB3  PHE   6           HB2      PHE   6 -10.342   1.647  -1.838
   29    HD1  PHE   6           HD2      PHE   6 -11.216  -1.966  -1.456
   30    HD2  PHE   6           HD1      PHE   6 -12.525   1.964  -2.433
   31    HE1  PHE   6           HE2      PHE   6 -13.458  -2.842  -1.961
   32    HE2  PHE   6           HE1      PHE   6 -14.770   1.094  -2.938
   33    HZ   PHE   6           HZ       PHE   6 -15.239  -1.311  -2.704
   34    H    GLY   7           H        GLY   7  -8.745   1.955  -3.782
   35    HA2  GLY   7           HA3      GLY   7 -10.038   0.911  -6.183
   36    HA3  GLY   7           HA2      GLY   7  -9.506   2.564  -5.928
   37    H    GLY   8           H        GLY   8  -7.323  -0.010  -5.160
   38    HA2  GLY   8           HA3      GLY   8  -5.357  -0.706  -6.111
   39    HA3  GLY   8           HA2      GLY   8  -6.109  -0.390  -7.667
   40    H    THR   9           H        THR   9  -5.380   1.928  -5.091
   41    HA   THR   9           HA       THR   9  -3.180   3.042  -6.639
   42    HB   THR   9           HB       THR   9  -5.340   4.925  -5.732
   43    HG1  THR   9           HG1      THR   9  -5.440   3.185  -7.864
   44   HG21  THR   9          HG21      THR   9  -4.262   6.508  -7.013
   45   HG22  THR   9          HG22      THR   9  -3.561   5.307  -8.098
   46   HG23  THR   9          HG23      THR   9  -2.900   5.525  -6.477
   47    H    CYS  10           H        CYS  10  -1.808   4.357  -5.390
   48    HA   CYS  10           HA       CYS  10  -2.362   4.388  -2.502
   49    HB2  CYS  10           HB3      CYS  10   0.355   3.961  -3.769
   50    HB3  CYS  10           HB2      CYS  10  -0.018   3.932  -2.049
   51    H    ASN  11           H        ASN  11  -1.754   6.198  -1.392
   52    HA   ASN  11           HA       ASN  11  -1.333   8.581  -3.007
   53    HB2  ASN  11           HB3      ASN  11  -1.845   8.215  -0.044
   54    HB3  ASN  11           HB2      ASN  11  -1.747   9.771  -0.862
   55   HD21  ASN  11          HD22      ASN  11  -3.672   7.027  -0.165
   56   HD22  ASN  11          HD21      ASN  11  -5.117   7.574  -0.948
   57    H    THR  12           H        THR  12   0.418   6.461  -0.941
   58    HA   THR  12           HA       THR  12   2.617   8.381  -0.662
   59    HB   THR  12           HB       THR  12   2.475   5.638   0.577
   60    HG1  THR  12           HG1      THR  12   0.615   6.679   1.263
   61   HG21  THR  12          HG21      THR  12   3.972   6.593   2.222
   62   HG22  THR  12          HG22      THR  12   3.848   8.177   1.457
   63   HG23  THR  12          HG23      THR  12   4.630   6.845   0.606
   64    HA   PRO  13           HA       PRO  13   4.571   6.307  -4.120
   65    HB2  PRO  13           HB2      PRO  13   6.874   7.982  -3.368
   66    HB3  PRO  13           HB3      PRO  13   5.969   7.938  -4.884
   67    HG2  PRO  13           HG3      PRO  13   5.770  10.006  -3.183
   68    HG3  PRO  13           HG2      PRO  13   4.385   9.443  -4.136
   69    HD2  PRO  13           HD3      PRO  13   5.034   8.940  -1.255
   70    HD3  PRO  13           HD2      PRO  13   3.467   9.306  -2.010
   71    H    GLY  14           H        GLY  14   5.905   4.586  -4.276
   72    HA2  GLY  14           HA3      GLY  14   7.876   3.378  -3.651
   73    HA3  GLY  14           HA2      GLY  14   7.704   4.023  -2.024
   74    H    CYS  15           H        CYS  15   4.797   3.546  -2.026
   75    HA   CYS  15           HA       CYS  15   4.939   0.741  -1.278
   76    HB2  CYS  15           HB3      CYS  15   2.982   2.945  -0.744
   77    HB3  CYS  15           HB2      CYS  15   2.488   1.267  -0.550
   78    H    SER  16           H        SER  16   4.122  -0.862  -2.392
   79    HA   SER  16           HA       SER  16   2.746  -0.279  -4.897
   80    HB2  SER  16           HB3      SER  16   3.836  -2.910  -3.858
   81    HB3  SER  16           HB2      SER  16   3.278  -2.579  -5.499
   82    HG   SER  16           HG       SER  16   5.654  -2.463  -4.988
   83    H    CYS  17           H        CYS  17   0.656  -0.929  -5.283
   84    HA   CYS  17           HA       CYS  17  -0.989  -1.342  -3.031
   85    HB2  CYS  17           HB3      CYS  17  -1.891  -0.237  -4.978
   86    HB3  CYS  17           HB2      CYS  17  -1.605  -1.663  -5.968
   87    H    THR  18           H        THR  18  -1.206  -3.056  -1.926
   88    HA   THR  18           HA       THR  18  -1.108  -5.700  -3.219
   89    HB   THR  18           HB       THR  18  -0.434  -5.240  -0.313
   90    HG1  THR  18           HG1      THR  18   0.953  -4.214  -2.266
   91   HG21  THR  18          HG21      THR  18  -0.076  -7.436  -2.314
   92   HG22  THR  18          HG22      THR  18  -0.689  -7.515  -0.663
   93   HG23  THR  18          HG23      THR  18   1.039  -7.311  -0.953
   94    H    TRP  19           H        TRP  19  -3.359  -4.930  -3.523
   95    HA   TRP  19           HA       TRP  19  -5.310  -4.203  -1.996
   96    HB2  TRP  19           HB3      TRP  19  -5.280  -5.545  -4.329
   97    HB3  TRP  19           HB2      TRP  19  -6.032  -6.756  -3.295
   98    HD1  TRP  19           HD1      TRP  19  -6.735  -3.501  -5.062
   99    HE1  TRP  19           HE1      TRP  19  -9.194  -2.827  -4.691
  100    HE3  TRP  19           HE3      TRP  19  -7.969  -6.899  -1.450
  101    HZ2  TRP  19           HZ2      TRP  19 -11.365  -3.635  -3.076
  102    HZ3  TRP  19           HZ3      TRP  19 -10.246  -6.876  -0.536
  103    HH2  TRP  19           HH2      TRP  19 -11.915  -5.279  -1.334
  104    HA   PRO  20           HA       PRO  20  -6.625  -3.808  -0.990
  105    HB2  PRO  20           HB2      PRO  20  -7.971  -3.377   1.245
  106    HB3  PRO  20           HB3      PRO  20  -8.496  -4.618   0.105
  107    HG2  PRO  20           HG3      PRO  20  -7.153  -4.918   2.736
  108    HG3  PRO  20           HG2      PRO  20  -8.296  -6.001   1.927
  109    HD2  PRO  20           HD3      PRO  20  -5.440  -6.177   1.965
  110    HD3  PRO  20           HD2      PRO  20  -6.581  -7.220   1.090
  111    H    ILE  21           H        ILE  21  -3.801  -4.135   0.304
  112    HA   ILE  21           HA       ILE  21  -3.810  -1.462   1.485
  113    HB   ILE  21           HB       ILE  21  -2.404  -2.052   3.352
  114   HG12  ILE  21          HG13      ILE  21  -1.327  -4.053   2.182
  115   HG13  ILE  21          HG12      ILE  21  -1.651  -4.223   3.902
  116   HG21  ILE  21          HG21      ILE  21  -4.984  -3.538   3.088
  117   HG22  ILE  21          HG22      ILE  21  -4.613  -2.086   4.020
  118   HG23  ILE  21          HG23      ILE  21  -4.027  -3.656   4.567
  119   HD11  ILE  21          HD11      ILE  21  -2.175  -6.191   2.360
  120   HD12  ILE  21          HD12      ILE  21  -3.576  -5.248   1.852
  121   HD13  ILE  21          HD13      ILE  21  -3.396  -5.719   3.543
  122    H    CYS  22           H        CYS  22  -2.004  -0.269   1.149
  123    HA   CYS  22           HA       CYS  22  -0.199  -1.188  -0.920
  124    HB2  CYS  22           HB3      CYS  22  -0.212   1.425   0.589
  125    HB3  CYS  22           HB2      CYS  22   0.717   1.076  -0.857
  126    H    THR  23           H        THR  23   1.841  -1.825  -0.693
  127    HA   THR  23           HA       THR  23   3.161  -1.510   1.914
  128    HB   THR  23           HB       THR  23   4.043  -3.790   1.772
  129    HG1  THR  23           HG1      THR  23   2.222  -4.479  -0.256
  130   HG21  THR  23          HG21      THR  23   1.291  -3.130   2.231
  131   HG22  THR  23          HG22      THR  23   2.297  -4.329   3.044
  132   HG23  THR  23          HG23      THR  23   1.411  -4.765   1.582
  133    H    ARG  24           H        ARG  24   5.274  -0.868   1.751
  134    HA   ARG  24           HA       ARG  24   6.362  -0.630  -0.937
  135    HB2  ARG  24           HB3      ARG  24   8.032   0.818   0.029
  136    HB3  ARG  24           HB2      ARG  24   6.439   1.364   0.511
  137    HG2  ARG  24           HG3      ARG  24   6.743   0.640   2.719
  138    HG3  ARG  24           HG2      ARG  24   8.126  -0.369   2.287
  139    HD2  ARG  24           HD3      ARG  24   7.973   2.621   2.520
  140    HD3  ARG  24           HD2      ARG  24   9.074   1.506   3.327
  141    HE   ARG  24           HE       ARG  24   9.563   2.824   0.919
  142   HH11  ARG  24          HH11      ARG  24   9.912  -0.407   2.260
  143   HH12  ARG  24          HH12      ARG  24  11.103  -0.889   1.086
  144   HH21  ARG  24          HH22      ARG  24  11.177   2.158  -0.585
  145   HH22  ARG  24          HH21      ARG  24  11.801   0.537  -0.501
  146    H    ASP  25           H        ASP  25   7.668  -2.129  -1.672
  147    HA   ASP  25           HA       ASP  25   9.003  -3.964  -1.808
  148    HB2  ASP  25           HB3      ASP  25  10.148  -2.799   0.742
  149    HB3  ASP  25           HB2      ASP  25  10.845  -4.177  -0.100
  150    H    GLY  26           H        GLY  26   6.427  -4.152  -0.496
  151    HA2  GLY  26           HA3      GLY  26   5.253  -5.992   0.307
  152    HA3  GLY  26           HA2      GLY  26   6.779  -6.754   0.724
  153    H    LEU  27           H        LEU  27   6.957  -3.718   1.972
  154    HA   LEU  27           HA       LEU  27   6.145  -4.695   4.614
  155    HB2  LEU  27           HB3      LEU  27   7.835  -2.310   3.855
  156    HB3  LEU  27           HB2      LEU  27   7.502  -2.842   5.492
  157    HG   LEU  27           HG       LEU  27   9.029  -4.433   3.428
  158   HD11  LEU  27          HD11      LEU  27  10.125  -2.335   4.330
  159   HD12  LEU  27          HD12      LEU  27  11.007  -3.845   4.562
  160   HD13  LEU  27          HD13      LEU  27  10.117  -3.128   5.906
  161   HD21  LEU  27          HD21      LEU  27   9.000  -6.174   4.826
  162   HD22  LEU  27          HD22      LEU  27   7.661  -5.359   5.633
  163   HD23  LEU  27          HD23      LEU  27   9.307  -5.157   6.232
  164    HA   PRO  28           HA       PRO  28   2.588  -2.000   4.326
  165    HB2  PRO  28           HB2      PRO  28   1.958  -2.870   7.027
  166    HB3  PRO  28           HB3      PRO  28   1.121  -3.248   5.520
  167    HG2  PRO  28           HG3      PRO  28   2.518  -5.094   6.947
  168    HG3  PRO  28           HG2      PRO  28   2.313  -5.175   5.188
  169    HD2  PRO  28           HD3      PRO  28   4.660  -4.209   6.782
  170    HD3  PRO  28           HD2      PRO  28   4.631  -5.207   5.310
  171    H    VAL  29           H        VAL  29   4.583  -0.413   4.641
  172    HA   VAL  29           HA       VAL  29   4.674   0.767   7.274
  173    HB   VAL  29           HB       VAL  29   6.028   1.684   4.735
  174   HG11  VAL  29          HG11      VAL  29   7.403   3.065   6.081
  175   HG12  VAL  29          HG12      VAL  29   6.783   2.351   7.570
  176   HG13  VAL  29          HG13      VAL  29   5.742   3.377   6.584
  177   HG21  VAL  29          HG21      VAL  29   7.174   0.047   6.993
  178   HG22  VAL  29          HG22      VAL  29   8.011   0.561   5.529
  179   HG23  VAL  29          HG23      VAL  29   6.684  -0.598   5.425
  Start of MODEL   14
    1    H1   CYS   1           H        CYS   1   3.056   0.968   4.467
    2    HA   CYS   1           HA       CYS   1   2.461   3.716   4.524
    3    HB2  CYS   1           HB3      CYS   1   0.945   1.784   2.798
    4    HB3  CYS   1           HB2      CYS   1   1.521   3.403   2.408
    5    H    GLY   2           H        GLY   2   0.544   0.851   5.247
    6    HA2  GLY   2           HA3      GLY   2  -1.299   0.634   6.620
    7    HA3  GLY   2           HA2      GLY   2  -1.233   2.363   6.918
    8    H    GLU   3           H        GLU   3  -1.375   3.168   4.196
    9    HA   GLU   3           HA       GLU   3  -4.134   3.380   3.860
   10    HB2  GLU   3           HB3      GLU   3  -3.607   4.312   1.640
   11    HB3  GLU   3           HB2      GLU   3  -2.608   5.001   2.912
   12    HG2  GLU   3           HG3      GLU   3  -0.713   3.804   2.223
   13    HG3  GLU   3           HG2      GLU   3  -1.668   2.715   1.215
   14    H    THR   4           H        THR   4  -5.606   2.404   2.583
   15    HA   THR   4           HA       THR   4  -4.906  -0.237   1.569
   16    HB   THR   4           HB       THR   4  -7.454  -0.412   1.336
   17    HG1  THR   4           HG1      THR   4  -8.238   1.272   3.113
   18   HG21  THR   4          HG21      THR   4  -7.726  -0.544   3.904
   19   HG22  THR   4          HG22      THR   4  -6.012  -0.128   3.953
   20   HG23  THR   4          HG23      THR   4  -6.541  -1.596   3.130
   21    H    CYS   5           H        CYS   5  -4.633  -0.556  -0.581
   22    HA   CYS   5           HA       CYS   5  -5.241   1.641  -2.373
   23    HB2  CYS   5           HB3      CYS   5  -4.021   0.309  -4.075
   24    HB3  CYS   5           HB2      CYS   5  -3.065   0.637  -2.635
   25    H    PHE   6           H        PHE   6  -7.560   1.001  -1.643
   26    HA   PHE   6           HA       PHE   6  -8.913  -1.172  -2.743
   27    HB2  PHE   6           HB3      PHE   6  -9.871   0.366  -1.059
   28    HB3  PHE   6           HB2      PHE   6  -9.955   1.635  -2.276
   29    HD1  PHE   6           HD2      PHE   6 -10.952  -1.966  -2.166
   30    HD2  PHE   6           HD1      PHE   6 -12.103   2.059  -2.924
   31    HE1  PHE   6           HE2      PHE   6 -13.202  -2.733  -2.798
   32    HE2  PHE   6           HE1      PHE   6 -14.357   1.301  -3.555
   33    HZ   PHE   6           HZ       PHE   6 -14.908  -1.098  -3.494
   34    H    GLY   7           H        GLY   7  -8.121   1.979  -4.107
   35    HA2  GLY   7           HA3      GLY   7  -9.423   1.307  -6.629
   36    HA3  GLY   7           HA2      GLY   7  -8.693   2.850  -6.214
   37    H    GLY   8           H        GLY   8  -6.889  -0.045  -5.606
   38    HA2  GLY   8           HA3      GLY   8  -5.144  -1.054  -6.728
   39    HA3  GLY   8           HA2      GLY   8  -5.581  -0.140  -8.159
   40    H    THR   9           H        THR   9  -5.311   2.465  -6.956
   41    HA   THR   9           HA       THR   9  -2.420   2.644  -7.096
   42    HB   THR   9           HB       THR   9  -3.693   4.183  -8.466
   43    HG1  THR   9           HG1      THR   9  -2.601   5.824  -6.450
   44   HG21  THR   9          HG21      THR   9  -5.315   4.452  -6.159
   45   HG22  THR   9          HG22      THR   9  -5.567   5.151  -7.758
   46   HG23  THR   9          HG23      THR   9  -4.654   6.043  -6.541
   47    H    CYS  10           H        CYS  10  -1.302   4.177  -5.692
   48    HA   CYS  10           HA       CYS  10  -2.323   4.153  -2.931
   49    HB2  CYS  10           HB3      CYS  10   0.552   3.689  -3.766
   50    HB3  CYS  10           HB2      CYS  10  -0.049   3.737  -2.111
   51    H    ASN  11           H        ASN  11  -1.639   5.899  -1.625
   52    HA   ASN  11           HA       ASN  11  -1.207   8.340  -3.147
   53    HB2  ASN  11           HB3      ASN  11  -2.976   8.258  -1.443
   54    HB3  ASN  11           HB2      ASN  11  -1.778   7.898  -0.206
   55   HD21  ASN  11          HD22      ASN  11  -1.088   9.550   0.931
   56   HD22  ASN  11          HD21      ASN  11  -1.130  11.207   0.450
   57    H    THR  12           H        THR  12   0.570   6.202  -1.105
   58    HA   THR  12           HA       THR  12   2.670   8.198  -0.671
   59    HB   THR  12           HB       THR  12   2.555   5.393   0.434
   60    HG1  THR  12           HG1      THR  12   0.708   6.380   1.168
   61   HG21  THR  12          HG21      THR  12   4.570   5.960   1.200
   62   HG22  THR  12          HG22      THR  12   3.752   7.116   2.250
   63   HG23  THR  12          HG23      THR  12   4.373   7.635   0.683
   64    HA   PRO  13           HA       PRO  13   4.991   6.480  -4.087
   65    HB2  PRO  13           HB2      PRO  13   7.211   8.008  -2.884
   66    HB3  PRO  13           HB3      PRO  13   6.501   8.142  -4.495
   67    HG2  PRO  13           HG3      PRO  13   6.103  10.026  -2.631
   68    HG3  PRO  13           HG2      PRO  13   4.834   9.578  -3.787
   69    HD2  PRO  13           HD3      PRO  13   5.150   8.785  -0.917
   70    HD3  PRO  13           HD2      PRO  13   3.680   9.240  -1.805
   71    H    GLY  14           H        GLY  14   6.225   4.681  -4.255
   72    HA2  GLY  14           HA3      GLY  14   7.988   3.233  -3.637
   73    HA3  GLY  14           HA2      GLY  14   7.954   3.921  -2.018
   74    H    CYS  15           H        CYS  15   4.895   3.678  -2.294
   75    HA   CYS  15           HA       CYS  15   4.767   1.026  -1.125
   76    HB2  CYS  15           HB3      CYS  15   2.692   3.212  -1.416
   77    HB3  CYS  15           HB2      CYS  15   2.408   1.676  -0.606
   78    H    SER  16           H        SER  16   3.912  -0.712  -2.081
   79    HA   SER  16           HA       SER  16   2.874  -0.407  -4.812
   80    HB2  SER  16           HB3      SER  16   4.068  -2.875  -3.523
   81    HB3  SER  16           HB2      SER  16   3.670  -2.657  -5.228
   82    HG   SER  16           HG       SER  16   5.411  -0.816  -4.063
   83    H    CYS  17           H        CYS  17   0.891  -1.251  -5.311
   84    HA   CYS  17           HA       CYS  17  -0.894  -1.689  -3.172
   85    HB2  CYS  17           HB3      CYS  17  -1.608  -0.712  -5.314
   86    HB3  CYS  17           HB2      CYS  17  -1.325  -2.261  -6.104
   87    H    THR  18           H        THR  18  -1.445  -3.394  -2.144
   88    HA   THR  18           HA       THR  18  -1.042  -6.066  -3.286
   89    HB   THR  18           HB       THR  18  -0.610  -5.484  -0.349
   90    HG1  THR  18           HG1      THR  18   1.014  -4.794  -2.398
   91   HG21  THR  18          HG21      THR  18   0.323  -7.628  -0.239
   92   HG22  THR  18          HG22      THR  18   0.597  -7.701  -1.979
   93   HG23  THR  18          HG23      THR  18  -1.041  -7.832  -1.338
   94    H    TRP  19           H        TRP  19  -3.259  -5.069  -3.746
   95    HA   TRP  19           HA       TRP  19  -5.319  -4.393  -2.365
   96    HB2  TRP  19           HB3      TRP  19  -5.106  -5.574  -4.772
   97    HB3  TRP  19           HB2      TRP  19  -5.987  -6.828  -3.904
   98    HD1  TRP  19           HD1      TRP  19  -6.428  -3.440  -5.497
   99    HE1  TRP  19           HE1      TRP  19  -8.894  -2.713  -5.315
  100    HE3  TRP  19           HE3      TRP  19  -8.091  -7.030  -2.265
  101    HZ2  TRP  19           HZ2      TRP  19 -11.231  -3.558  -3.970
  102    HZ3  TRP  19           HZ3      TRP  19 -10.442  -6.995  -1.567
  103    HH2  TRP  19           HH2      TRP  19 -11.986  -5.296  -2.406
  104    HA   PRO  20           HA       PRO  20  -6.768  -4.034  -1.493
  105    HB2  PRO  20           HB2      PRO  20  -8.305  -3.693   0.636
  106    HB3  PRO  20           HB3      PRO  20  -8.755  -4.849  -0.620
  107    HG2  PRO  20           HG3      PRO  20  -7.653  -5.341   2.096
  108    HG3  PRO  20           HG2      PRO  20  -8.761  -6.332   1.134
  109    HD2  PRO  20           HD3      PRO  20  -5.936  -6.640   1.399
  110    HD3  PRO  20           HD2      PRO  20  -7.028  -7.559   0.345
  111    H    ILE  21           H        ILE  21  -4.100  -4.515  -0.046
  112    HA   ILE  21           HA       ILE  21  -4.135  -1.982   1.430
  113    HB   ILE  21           HB       ILE  21  -2.689  -2.892   3.184
  114   HG12  ILE  21          HG13      ILE  21  -3.197  -5.593   1.912
  115   HG13  ILE  21          HG12      ILE  21  -1.674  -4.716   1.830
  116   HG21  ILE  21          HG21      ILE  21  -4.944  -2.863   3.806
  117   HG22  ILE  21          HG22      ILE  21  -4.414  -4.499   4.200
  118   HG23  ILE  21          HG23      ILE  21  -5.354  -4.204   2.734
  119   HD11  ILE  21          HD11      ILE  21  -2.575  -5.020   4.556
  120   HD12  ILE  21          HD12      ILE  21  -1.044  -5.481   3.812
  121   HD13  ILE  21          HD13      ILE  21  -2.426  -6.574   3.735
  122    H    CYS  22           H        CYS  22  -2.328  -0.741   1.193
  123    HA   CYS  22           HA       CYS  22  -0.462  -1.585  -0.881
  124    HB2  CYS  22           HB3      CYS  22  -1.614   0.712  -0.749
  125    HB3  CYS  22           HB2      CYS  22  -0.414   1.091   0.474
  126    H    THR  23           H        THR  23   1.701  -1.729  -0.637
  127    HA   THR  23           HA       THR  23   2.820  -1.545   2.079
  128    HB   THR  23           HB       THR  23   4.033  -3.695   1.678
  129    HG1  THR  23           HG1      THR  23   2.158  -4.475  -0.240
  130   HG21  THR  23          HG21      THR  23   2.434  -4.494   3.012
  131   HG22  THR  23          HG22      THR  23   1.496  -4.905   1.576
  132   HG23  THR  23          HG23      THR  23   1.265  -3.344   2.363
  133    H    ARG  24           H        ARG  24   4.756  -0.508   2.088
  134    HA   ARG  24           HA       ARG  24   6.047  -0.021  -0.469
  135    HB2  ARG  24           HB3      ARG  24   7.369   1.628   0.666
  136    HB3  ARG  24           HB2      ARG  24   5.694   1.869   1.112
  137    HG2  ARG  24           HG3      ARG  24   6.044   1.070   3.281
  138    HG3  ARG  24           HG2      ARG  24   7.581   0.316   2.850
  139    HD2  ARG  24           HD3      ARG  24   6.963   3.244   3.164
  140    HD3  ARG  24           HD2      ARG  24   8.129   2.275   4.063
  141    HE   ARG  24           HE       ARG  24   8.610   3.655   1.659
  142   HH11  ARG  24          HH11      ARG  24   9.422   0.632   3.245
  143   HH12  ARG  24          HH12      ARG  24  10.793   0.323   2.219
  144   HH21  ARG  24          HH22      ARG  24  10.452   3.233   0.341
  145   HH22  ARG  24          HH21      ARG  24  11.359   1.770   0.587
  146    H    ASP  25           H        ASP  25   7.725  -1.164  -1.137
  147    HA   ASP  25           HA       ASP  25   9.381  -2.722  -1.218
  148    HB2  ASP  25           HB3      ASP  25   9.893  -1.804   1.626
  149    HB3  ASP  25           HB2      ASP  25  10.989  -2.798   0.674
  150    H    GLY  26           H        GLY  26   6.690  -3.448  -0.318
  151    HA2  GLY  26           HA3      GLY  26   5.686  -5.474   0.162
  152    HA3  GLY  26           HA2      GLY  26   7.267  -6.129   0.556
  153    H    LEU  27           H        LEU  27   6.641  -3.216   2.158
  154    HA   LEU  27           HA       LEU  27   5.911  -4.694   4.599
  155    HB2  LEU  27           HB3      LEU  27   7.458  -2.115   4.327
  156    HB3  LEU  27           HB2      LEU  27   7.036  -2.888   5.843
  157    HG   LEU  27           HG       LEU  27   8.845  -4.079   3.737
  158   HD11  LEU  27          HD11      LEU  27   9.362  -2.085   5.667
  159   HD12  LEU  27          HD12      LEU  27  10.515  -2.936   4.638
  160   HD13  LEU  27          HD13      LEU  27  10.120  -3.572   6.235
  161   HD21  LEU  27          HD21      LEU  27   8.696  -5.059   6.539
  162   HD22  LEU  27          HD22      LEU  27   9.085  -5.928   5.055
  163   HD23  LEU  27          HD23      LEU  27   7.409  -5.521   5.426
  164    HA   PRO  28           HA       PRO  28   2.176  -2.266   4.438
  165    HB2  PRO  28           HB2      PRO  28   1.075  -3.176   6.726
  166    HB3  PRO  28           HB3      PRO  28   1.161  -4.165   5.263
  167    HG2  PRO  28           HG3      PRO  28   2.921  -4.203   7.685
  168    HG3  PRO  28           HG2      PRO  28   2.257  -5.564   6.761
  169    HD2  PRO  28           HD3      PRO  28   4.811  -4.652   6.466
  170    HD3  PRO  28           HD2      PRO  28   3.900  -5.441   5.164
  171    H    VAL  29           H        VAL  29   4.296  -0.735   5.127
  172    HA   VAL  29           HA       VAL  29   3.854   0.420   7.744
  173    HB   VAL  29           HB       VAL  29   5.766   1.327   5.588
  174   HG11  VAL  29          HG11      VAL  29   5.956   3.099   6.944
  175   HG12  VAL  29          HG12      VAL  29   6.869   2.012   7.990
  176   HG13  VAL  29          HG13      VAL  29   5.151   2.281   8.283
  177   HG21  VAL  29          HG21      VAL  29   7.152  -0.331   6.106
  178   HG22  VAL  29          HG22      VAL  29   5.842  -1.057   7.038
  179   HG23  VAL  29          HG23      VAL  29   7.003   0.008   7.831
  Start of MODEL   15
    1    H1   CYS   1           H        CYS   1   3.232   1.526   4.202
    2    HA   CYS   1           HA       CYS   1   2.288   4.169   4.783
    3    HB2  CYS   1           HB3      CYS   1   1.477   2.192   2.641
    4    HB3  CYS   1           HB2      CYS   1   0.875   3.845   2.746
    5    H    GLY   2           H        GLY   2   0.971   0.906   4.943
    6    HA2  GLY   2           HA3      GLY   2  -0.698   0.072   6.301
    7    HA3  GLY   2           HA2      GLY   2  -0.894   1.679   6.979
    8    H    GLU   3           H        GLU   3  -1.386   2.961   4.449
    9    HA   GLU   3           HA       GLU   3  -4.138   2.901   4.343
   10    HB2  GLU   3           HB3      GLU   3  -3.895   4.053   2.141
   11    HB3  GLU   3           HB2      GLU   3  -2.942   4.760   3.439
   12    HG2  GLU   3           HG3      GLU   3  -0.937   3.901   2.586
   13    HG3  GLU   3           HG2      GLU   3  -1.777   2.780   1.514
   14    H    THR   4           H        THR   4  -5.660   1.910   3.170
   15    HA   THR   4           HA       THR   4  -4.926  -0.567   1.846
   16    HB   THR   4           HB       THR   4  -7.431  -0.887   1.762
   17    HG1  THR   4           HG1      THR   4  -7.745   1.516   1.974
   18   HG21  THR   4          HG21      THR   4  -7.673  -1.216   4.222
   19   HG22  THR   4          HG22      THR   4  -6.143  -0.367   4.444
   20   HG23  THR   4          HG23      THR   4  -6.185  -1.894   3.563
   21    H    CYS   5           H        CYS   5  -4.666  -0.643  -0.318
   22    HA   CYS   5           HA       CYS   5  -5.573   1.596  -1.924
   23    HB2  CYS   5           HB3      CYS   5  -4.296   0.501  -3.755
   24    HB3  CYS   5           HB2      CYS   5  -3.319   0.844  -2.332
   25    H    PHE   6           H        PHE   6  -7.790   0.723  -1.198
   26    HA   PHE   6           HA       PHE   6  -8.981  -1.528  -2.305
   27    HB2  PHE   6           HB3      PHE   6 -10.023  -0.089  -0.584
   28    HB3  PHE   6           HB2      PHE   6 -10.251   1.173  -1.787
   29    HD1  PHE   6           HD1      PHE   6 -10.924  -2.502  -1.668
   30    HD2  PHE   6           HD2      PHE   6 -12.440   1.409  -2.391
   31    HE1  PHE   6           HE1      PHE   6 -13.112  -3.462  -2.257
   32    HE2  PHE   6           HE2      PHE   6 -14.629   0.456  -2.979
   33    HZ   PHE   6           HZ       PHE   6 -14.969  -1.983  -2.912
   34    H    GLY   7           H        GLY   7  -8.542   1.704  -3.667
   35    HA2  GLY   7           HA3      GLY   7  -9.832   0.896  -6.156
   36    HA3  GLY   7           HA2      GLY   7  -9.269   2.511  -5.752
   37    H    GLY   8           H        GLY   8  -7.114  -0.137  -5.190
   38    HA2  GLY   8           HA3      GLY   8  -5.286  -0.928  -6.356
   39    HA3  GLY   8           HA2      GLY   8  -5.882  -0.100  -7.782
   40    H    THR   9           H        THR   9  -5.944   2.521  -6.502
   41    HA   THR   9           HA       THR   9  -3.130   3.148  -6.838
   42    HB   THR   9           HB       THR   9  -5.250   5.188  -6.265
   43    HG1  THR   9           HG1      THR   9  -5.335   3.408  -8.268
   44   HG21  THR   9          HG21      THR   9  -3.146   5.466  -8.349
   45   HG22  THR   9          HG22      THR   9  -2.644   5.523  -6.659
   46   HG23  THR   9          HG23      THR   9  -3.830   6.678  -7.267
   47    H    CYS  10           H        CYS  10  -1.904   4.322  -5.357
   48    HA   CYS  10           HA       CYS  10  -2.851   4.234  -2.573
   49    HB2  CYS  10           HB3      CYS  10   0.018   4.083  -3.541
   50    HB3  CYS  10           HB2      CYS  10  -0.529   3.951  -1.873
   51    H    ASN  11           H        ASN  11  -2.212   5.978  -1.213
   52    HA   ASN  11           HA       ASN  11  -2.066   8.506  -2.645
   53    HB2  ASN  11           HB3      ASN  11  -3.680   8.271  -0.824
   54    HB3  ASN  11           HB2      ASN  11  -2.386   7.871   0.299
   55   HD21  ASN  11          HD22      ASN  11  -1.614   9.462   1.474
   56   HD22  ASN  11          HD21      ASN  11  -1.762  11.147   1.126
   57    H    THR  12           H        THR  12  -0.069   6.455  -0.677
   58    HA   THR  12           HA       THR  12   1.995   8.527  -0.496
   59    HB   THR  12           HB       THR  12   2.024   5.796   0.786
   60    HG1  THR  12           HG1      THR  12   0.201   6.806   1.571
   61   HG21  THR  12          HG21      THR  12   3.761   8.140   0.813
   62   HG22  THR  12          HG22      THR  12   4.095   6.477   1.292
   63   HG23  THR  12          HG23      THR  12   3.317   7.583   2.426
   64    HA   PRO  13           HA       PRO  13   4.044   6.590  -3.973
   65    HB2  PRO  13           HB2      PRO  13   6.232   8.426  -3.274
   66    HB3  PRO  13           HB3      PRO  13   5.286   8.327  -4.761
   67    HG2  PRO  13           HG3      PRO  13   5.000  10.364  -3.032
   68    HG3  PRO  13           HG2      PRO  13   3.632   9.720  -3.959
   69    HD2  PRO  13           HD3      PRO  13   4.383   9.231  -1.100
   70    HD3  PRO  13           HD2      PRO  13   2.778   9.504  -1.813
   71    H    GLY  14           H        GLY  14   5.585   5.024  -4.190
   72    HA2  GLY  14           HA3      GLY  14   7.650   3.987  -3.568
   73    HA3  GLY  14           HA2      GLY  14   7.408   4.580  -1.930
   74    H    CYS  15           H        CYS  15   4.566   3.834  -1.976
   75    HA   CYS  15           HA       CYS  15   4.931   1.046  -1.251
   76    HB2  CYS  15           HB3      CYS  15   2.822   3.108  -0.740
   77    HB3  CYS  15           HB2      CYS  15   2.405   1.404  -0.597
   78    H    SER  16           H        SER  16   4.003  -0.648  -2.237
   79    HA   SER  16           HA       SER  16   2.792  -0.151  -4.858
   80    HB2  SER  16           HB3      SER  16   3.963  -2.725  -3.767
   81    HB3  SER  16           HB2      SER  16   3.510  -2.390  -5.440
   82    HG   SER  16           HG       SER  16   5.254  -0.548  -4.453
   83    H    CYS  17           H        CYS  17   0.789  -1.023  -5.355
   84    HA   CYS  17           HA       CYS  17  -0.897  -1.523  -3.124
   85    HB2  CYS  17           HB3      CYS  17  -1.732  -0.364  -5.108
   86    HB3  CYS  17           HB2      CYS  17  -1.503  -1.825  -6.062
   87    H    THR  18           H        THR  18  -1.019  -3.287  -2.093
   88    HA   THR  18           HA       THR  18  -0.842  -5.865  -3.499
   89    HB   THR  18           HB       THR  18  -0.197  -5.403  -0.571
   90    HG1  THR  18           HG1      THR  18   1.566  -4.503  -1.383
   91   HG21  THR  18          HG21      THR  18   0.765  -7.687  -2.254
   92   HG22  THR  18          HG22      THR  18  -0.865  -7.715  -1.580
   93   HG23  THR  18          HG23      THR  18   0.531  -7.607  -0.507
   94    H    TRP  19           H        TRP  19  -3.079  -5.077  -3.851
   95    HA   TRP  19           HA       TRP  19  -5.109  -4.472  -2.360
   96    HB2  TRP  19           HB3      TRP  19  -4.964  -5.572  -4.798
   97    HB3  TRP  19           HB2      TRP  19  -5.707  -6.914  -3.931
   98    HD1  TRP  19           HD1      TRP  19  -6.470  -3.515  -5.372
   99    HE1  TRP  19           HE1      TRP  19  -8.970  -2.980  -5.049
  100    HE3  TRP  19           HE3      TRP  19  -7.711  -7.327  -2.204
  101    HZ2  TRP  19           HZ2      TRP  19 -11.171  -4.042  -3.635
  102    HZ3  TRP  19           HZ3      TRP  19 -10.023  -7.491  -1.400
  103    HH2  TRP  19           HH2      TRP  19 -11.723  -5.883  -2.104
  104    HA   PRO  20           HA       PRO  20  -6.543  -4.204  -1.439
  105    HB2  PRO  20           HB2      PRO  20  -8.048  -3.994   0.728
  106    HB3  PRO  20           HB3      PRO  20  -8.458  -5.153  -0.538
  107    HG2  PRO  20           HG3      PRO  20  -7.271  -5.625   2.144
  108    HG3  PRO  20           HG2      PRO  20  -8.334  -6.666   1.186
  109    HD2  PRO  20           HD3      PRO  20  -5.485  -6.791   1.387
  110    HD3  PRO  20           HD2      PRO  20  -6.542  -7.772   0.353
  111    H    ILE  21           H        ILE  21  -3.815  -4.561  -0.077
  112    HA   ILE  21           HA       ILE  21  -3.954  -2.070   1.460
  113    HB   ILE  21           HB       ILE  21  -2.414  -2.945   3.160
  114   HG12  ILE  21          HG13      ILE  21  -2.867  -5.641   1.857
  115   HG13  ILE  21          HG12      ILE  21  -1.374  -4.715   1.758
  116   HG21  ILE  21          HG21      ILE  21  -4.671  -2.992   3.813
  117   HG22  ILE  21          HG22      ILE  21  -4.048  -4.591   4.221
  118   HG23  ILE  21          HG23      ILE  21  -5.032  -4.372   2.772
  119   HD11  ILE  21          HD11      ILE  21  -1.111  -4.897   4.182
  120   HD12  ILE  21          HD12      ILE  21  -1.196  -6.478   3.406
  121   HD13  ILE  21          HD13      ILE  21  -2.598  -5.840   4.265
  122    H    CYS  22           H        CYS  22  -2.285  -0.703   1.156
  123    HA   CYS  22           HA       CYS  22  -0.373  -1.380  -0.929
  124    HB2  CYS  22           HB3      CYS  22  -1.654   0.866  -0.601
  125    HB3  CYS  22           HB2      CYS  22  -0.358   1.233   0.520
  126    H    THR  23           H        THR  23   1.738  -1.579  -0.684
  127    HA   THR  23           HA       THR  23   2.994  -1.228   1.936
  128    HB   THR  23           HB       THR  23   4.023  -3.567   1.645
  129    HG1  THR  23           HG1      THR  23   2.470  -4.997   0.516
  130   HG21  THR  23          HG21      THR  23   1.208  -4.120   2.193
  131   HG22  THR  23          HG22      THR  23   1.823  -2.710   3.056
  132   HG23  THR  23          HG23      THR  23   2.617  -4.273   3.244
  133    H    ARG  24           H        ARG  24   5.104  -0.564   1.746
  134    HA   ARG  24           HA       ARG  24   6.193  -0.438  -0.952
  135    HB2  ARG  24           HB3      ARG  24   7.791   1.131  -0.093
  136    HB3  ARG  24           HB2      ARG  24   6.199   1.615   0.449
  137    HG2  ARG  24           HG3      ARG  24   6.639   0.992   2.657
  138    HG3  ARG  24           HG2      ARG  24   8.031   0.008   2.194
  139    HD2  ARG  24           HD3      ARG  24   7.802   3.009   2.244
  140    HD3  ARG  24           HD2      ARG  24   8.910   1.986   3.157
  141    HE   ARG  24           HE       ARG  24   9.360   3.055   0.594
  142   HH11  ARG  24          HH11      ARG  24   9.921   0.117   2.431
  143   HH12  ARG  24          HH12      ARG  24  11.161  -0.459   1.354
  144   HH21  ARG  24          HH22      ARG  24  11.029   2.276  -0.791
  145   HH22  ARG  24          HH21      ARG  24  11.766   0.737  -0.455
  146    H    ASP  25           H        ASP  25   7.660  -1.848  -1.630
  147    HA   ASP  25           HA       ASP  25   9.113  -3.604  -1.670
  148    HB2  ASP  25           HB3      ASP  25  10.001  -2.480   1.004
  149    HB3  ASP  25           HB2      ASP  25  10.883  -3.674   0.062
  150    H    GLY  26           H        GLY  26   6.468  -3.892  -0.517
  151    HA2  GLY  26           HA3      GLY  26   5.260  -5.681   0.303
  152    HA3  GLY  26           HA2      GLY  26   6.775  -6.504   0.639
  153    H    LEU  27           H        LEU  27   6.800  -3.412   1.960
  154    HA   LEU  27           HA       LEU  27   6.183  -4.519   4.610
  155    HB2  LEU  27           HB3      LEU  27   7.798  -2.079   3.866
  156    HB3  LEU  27           HB2      LEU  27   7.531  -2.664   5.497
  157    HG   LEU  27           HG       LEU  27   9.017  -4.165   3.338
  158   HD11  LEU  27          HD11      LEU  27  11.016  -3.526   4.350
  159   HD12  LEU  27          HD12      LEU  27  10.208  -2.972   5.816
  160   HD13  LEU  27          HD13      LEU  27  10.065  -2.042   4.324
  161   HD21  LEU  27          HD21      LEU  27   9.715  -5.263   5.731
  162   HD22  LEU  27          HD22      LEU  27   8.500  -5.920   4.635
  163   HD23  LEU  27          HD23      LEU  27   8.008  -4.900   5.987
  164    HA   PRO  28           HA       PRO  28   2.583  -1.907   4.655
  165    HB2  PRO  28           HB2      PRO  28   1.772  -2.489   7.157
  166    HB3  PRO  28           HB3      PRO  28   1.625  -3.646   5.829
  167    HG2  PRO  28           HG3      PRO  28   3.684  -3.498   7.994
  168    HG3  PRO  28           HG2      PRO  28   2.863  -4.920   7.324
  169    HD2  PRO  28           HD3      PRO  28   5.390  -4.149   6.613
  170    HD3  PRO  28           HD2      PRO  28   4.305  -5.067   5.551
  171    H    VAL  29           H        VAL  29   4.556  -0.241   4.702
  172    HA   VAL  29           HA       VAL  29   4.816   1.085   7.255
  173    HB   VAL  29           HB       VAL  29   5.918   1.909   4.566
  174   HG11  VAL  29          HG11      VAL  29   7.531   2.853   6.660
  175   HG12  VAL  29          HG12      VAL  29   5.867   3.229   7.110
  176   HG13  VAL  29          HG13      VAL  29   6.514   3.797   5.571
  177   HG21  VAL  29          HG21      VAL  29   6.617  -0.327   5.974
  178   HG22  VAL  29          HG22      VAL  29   7.775   0.862   6.568
  179   HG23  VAL  29          HG23      VAL  29   7.661   0.529   4.840
  Start of MODEL   16
    1    H1   CYS   1           H        CYS   1   2.965   0.640   4.420
    2    HA   CYS   1           HA       CYS   1   2.384   3.395   4.542
    3    HB2  CYS   1           HB3      CYS   1   0.924   1.480   2.735
    4    HB3  CYS   1           HB2      CYS   1   1.418   3.139   2.409
    5    H    GLY   2           H        GLY   2   0.483   0.507   5.162
    6    HA2  GLY   2           HA3      GLY   2  -1.362   0.207   6.498
    7    HA3  GLY   2           HA2      GLY   2  -1.283   1.909   6.913
    8    H    GLU   3           H        GLU   3  -1.480   2.882   4.231
    9    HA   GLU   3           HA       GLU   3  -4.250   3.115   4.017
   10    HB2  GLU   3           HB3      GLU   3  -3.864   4.287   1.943
   11    HB3  GLU   3           HB2      GLU   3  -2.645   4.758   3.117
   12    HG2  GLU   3           HG3      GLU   3  -0.985   3.443   2.045
   13    HG3  GLU   3           HG2      GLU   3  -2.183   2.673   1.005
   14    H    THR   4           H        THR   4  -5.784   2.171   2.833
   15    HA   THR   4           HA       THR   4  -5.173  -0.411   1.654
   16    HB   THR   4           HB       THR   4  -7.690  -0.564   1.483
   17    HG1  THR   4           HG1      THR   4  -7.846   1.860   1.579
   18   HG21  THR   4          HG21      THR   4  -6.820   0.104   4.287
   19   HG22  THR   4          HG22      THR   4  -6.276  -1.355   3.459
   20   HG23  THR   4          HG23      THR   4  -7.995  -1.102   3.761
   21    H    CYS   5           H        CYS   5  -4.770  -0.554  -0.485
   22    HA   CYS   5           HA       CYS   5  -5.494   1.667  -2.202
   23    HB2  CYS   5           HB3      CYS   5  -4.131   0.516  -3.914
   24    HB3  CYS   5           HB2      CYS   5  -3.245   0.806  -2.422
   25    H    PHE   6           H        PHE   6  -7.818   0.793  -1.579
   26    HA   PHE   6           HA       PHE   6  -8.891  -1.418  -2.921
   27    HB2  PHE   6           HB3      PHE   6 -10.061   1.118  -1.841
   28    HB3  PHE   6           HB2      PHE   6 -11.060   0.075  -2.845
   29    HD1  PHE   6           HD2      PHE   6  -8.538  -0.680  -0.194
   30    HD2  PHE   6           HD1      PHE   6 -12.572  -1.003  -1.508
   31    HE1  PHE   6           HE2      PHE   6  -9.061  -2.072   1.765
   32    HE2  PHE   6           HE1      PHE   6 -13.102  -2.394   0.449
   33    HZ   PHE   6           HZ       PHE   6 -11.345  -2.931   2.088
   34    H    GLY   7           H        GLY   7  -8.300   1.878  -3.972
   35    HA2  GLY   7           HA3      GLY   7  -9.548   1.396  -6.556
   36    HA3  GLY   7           HA2      GLY   7  -8.836   2.906  -6.007
   37    H    GLY   8           H        GLY   8  -6.946   0.066  -5.556
   38    HA2  GLY   8           HA3      GLY   8  -5.155  -0.825  -6.695
   39    HA3  GLY   8           HA2      GLY   8  -5.649   0.084  -8.109
   40    H    THR   9           H        THR   9  -5.517   2.671  -6.729
   41    HA   THR   9           HA       THR   9  -2.655   3.044  -7.000
   42    HB   THR   9           HB       THR   9  -4.109   4.589  -8.180
   43    HG1  THR   9           HG1      THR   9  -3.081   6.286  -6.233
   44   HG21  THR   9          HG21      THR   9  -5.375   4.845  -5.543
   45   HG22  THR   9          HG22      THR   9  -6.063   5.050  -7.155
   46   HG23  THR   9          HG23      THR   9  -5.150   6.364  -6.411
   47    H    CYS  10           H        CYS  10  -1.568   4.563  -5.539
   48    HA   CYS  10           HA       CYS  10  -2.455   4.325  -2.746
   49    HB2  CYS  10           HB3      CYS  10   0.374   3.877  -3.731
   50    HB3  CYS  10           HB2      CYS  10  -0.135   3.885  -2.046
   51    H    ASN  11           H        ASN  11  -1.854   6.013  -1.402
   52    HA   ASN  11           HA       ASN  11  -1.340   8.521  -2.786
   53    HB2  ASN  11           HB3      ASN  11  -2.061   7.926   0.092
   54    HB3  ASN  11           HB2      ASN  11  -1.931   9.538  -0.604
   55   HD21  ASN  11          HD22      ASN  11  -3.874   6.768  -0.190
   56   HD22  ASN  11          HD21      ASN  11  -5.260   7.336  -1.057
   57    H    THR  12           H        THR  12   0.385   6.224  -0.946
   58    HA   THR  12           HA       THR  12   2.435   8.177  -0.183
   59    HB   THR  12           HB       THR  12   2.405   5.249   0.534
   60    HG1  THR  12           HG1      THR  12   0.442   6.066   1.259
   61   HG21  THR  12          HG21      THR  12   3.950   5.778   2.156
   62   HG22  THR  12          HG22      THR  12   3.424   7.458   2.264
   63   HG23  THR  12          HG23      THR  12   4.396   6.923   0.892
   64    HA   PRO  13           HA       PRO  13   4.815   6.957  -3.765
   65    HB2  PRO  13           HB2      PRO  13   7.117   8.234  -2.991
   66    HB3  PRO  13           HB3      PRO  13   5.758   9.041  -3.781
   67    HG2  PRO  13           HG3      PRO  13   6.469   8.927  -0.880
   68    HG3  PRO  13           HG2      PRO  13   5.868  10.295  -1.835
   69    HD2  PRO  13           HD3      PRO  13   4.262   8.880  -0.200
   70    HD3  PRO  13           HD2      PRO  13   3.676   9.570  -1.727
   71    H    GLY  14           H        GLY  14   6.014   5.186  -4.141
   72    HA2  GLY  14           HA3      GLY  14   7.787   3.684  -3.753
   73    HA3  GLY  14           HA2      GLY  14   7.840   4.212  -2.077
   74    H    CYS  15           H        CYS  15   4.751   3.948  -2.238
   75    HA   CYS  15           HA       CYS  15   4.730   1.205  -1.293
   76    HB2  CYS  15           HB3      CYS  15   2.605   3.359  -1.311
   77    HB3  CYS  15           HB2      CYS  15   2.363   1.745  -0.655
   78    H    SER  16           H        SER  16   3.860  -0.471  -2.328
   79    HA   SER  16           HA       SER  16   2.690  -0.001  -4.982
   80    HB2  SER  16           HB3      SER  16   4.008  -2.520  -3.931
   81    HB3  SER  16           HB2      SER  16   3.514  -2.197  -5.594
   82    HG   SER  16           HG       SER  16   5.274  -0.398  -4.390
   83    H    CYS  17           H        CYS  17   0.697  -0.856  -5.431
   84    HA   CYS  17           HA       CYS  17  -0.970  -1.457  -3.248
   85    HB2  CYS  17           HB3      CYS  17  -1.794  -0.412  -5.320
   86    HB3  CYS  17           HB2      CYS  17  -1.524  -1.927  -6.177
   87    H    THR  18           H        THR  18  -1.470  -3.220  -2.281
   88    HA   THR  18           HA       THR  18  -1.048  -5.831  -3.552
   89    HB   THR  18           HB       THR  18  -0.488  -5.361  -0.616
   90    HG1  THR  18           HG1      THR  18   1.029  -4.582  -2.727
   91   HG21  THR  18          HG21      THR  18   0.968  -7.434  -1.081
   92   HG22  THR  18          HG22      THR  18   0.058  -7.565  -2.586
   93   HG23  THR  18          HG23      THR  18  -0.782  -7.650  -1.038
   94    H    TRP  19           H        TRP  19  -3.305  -4.880  -3.871
   95    HA   TRP  19           HA       TRP  19  -5.319  -4.307  -2.383
   96    HB2  TRP  19           HB3      TRP  19  -5.164  -5.451  -4.832
   97    HB3  TRP  19           HB2      TRP  19  -6.030  -6.703  -3.947
   98    HD1  TRP  19           HD1      TRP  19  -6.486  -3.283  -5.478
   99    HE1  TRP  19           HE1      TRP  19  -8.937  -2.536  -5.202
  100    HE3  TRP  19           HE3      TRP  19  -8.082  -6.921  -2.263
  101    HZ2  TRP  19           HZ2      TRP  19 -11.237  -3.379  -3.794
  102    HZ3  TRP  19           HZ3      TRP  19 -10.408  -6.870  -1.483
  103    HH2  TRP  19           HH2      TRP  19 -11.959  -5.139  -2.238
  104    HA   PRO  20           HA       PRO  20  -6.735  -4.009  -1.431
  105    HB2  PRO  20           HB2      PRO  20  -8.163  -3.771   0.791
  106    HB3  PRO  20           HB3      PRO  20  -8.659  -4.887  -0.485
  107    HG2  PRO  20           HG3      PRO  20  -7.420  -5.461   2.152
  108    HG3  PRO  20           HG2      PRO  20  -8.547  -6.441   1.201
  109    HD2  PRO  20           HD3      PRO  20  -5.705  -6.685   1.332
  110    HD3  PRO  20           HD2      PRO  20  -6.822  -7.597   0.299
  111    H    ILE  21           H        ILE  21  -3.992  -4.494  -0.092
  112    HA   ILE  21           HA       ILE  21  -4.014  -1.990   1.431
  113    HB   ILE  21           HB       ILE  21  -2.494  -2.914   3.116
  114   HG12  ILE  21          HG13      ILE  21  -3.030  -5.597   1.814
  115   HG13  ILE  21          HG12      ILE  21  -1.515  -4.707   1.694
  116   HG21  ILE  21          HG21      ILE  21  -5.170  -4.221   2.733
  117   HG22  ILE  21          HG22      ILE  21  -4.716  -2.915   3.831
  118   HG23  ILE  21          HG23      ILE  21  -4.177  -4.563   4.153
  119   HD11  ILE  21          HD11      ILE  21  -2.703  -5.639   4.293
  120   HD12  ILE  21          HD12      ILE  21  -1.090  -4.980   4.020
  121   HD13  ILE  21          HD13      ILE  21  -1.522  -6.557   3.360
  122    H    CYS  22           H        CYS  22  -2.232  -0.723   1.176
  123    HA   CYS  22           HA       CYS  22  -0.442  -1.472  -0.994
  124    HB2  CYS  22           HB3      CYS  22  -1.600   0.815  -0.679
  125    HB3  CYS  22           HB2      CYS  22  -0.309   1.138   0.467
  126    H    THR  23           H        THR  23   1.724  -1.629  -0.851
  127    HA   THR  23           HA       THR  23   2.973  -1.552   1.811
  128    HB   THR  23           HB       THR  23   4.151  -3.679   1.305
  129    HG1  THR  23           HG1      THR  23   2.277  -4.355  -0.660
  130   HG21  THR  23          HG21      THR  23   2.403  -4.106   2.748
  131   HG22  THR  23          HG22      THR  23   1.980  -5.152   1.393
  132   HG23  THR  23          HG23      THR  23   1.180  -3.593   1.585
  133    H    ARG  24           H        ARG  24   4.924  -0.510   1.758
  134    HA   ARG  24           HA       ARG  24   6.057   0.040  -0.868
  135    HB2  ARG  24           HB3      ARG  24   7.356   1.745   0.165
  136    HB3  ARG  24           HB2      ARG  24   5.719   1.914   0.754
  137    HG2  ARG  24           HG3      ARG  24   6.288   1.142   2.884
  138    HG3  ARG  24           HG2      ARG  24   7.812   0.449   2.319
  139    HD2  ARG  24           HD3      ARG  24   7.107   3.358   2.655
  140    HD3  ARG  24           HD2      ARG  24   8.361   2.444   3.491
  141    HE   ARG  24           HE       ARG  24   8.641   3.796   1.041
  142   HH11  ARG  24          HH11      ARG  24   9.643   0.826   2.616
  143   HH12  ARG  24          HH12      ARG  24  10.959   0.543   1.513
  144   HH21  ARG  24          HH22      ARG  24  10.416   3.413  -0.380
  145   HH22  ARG  24          HH21      ARG  24  11.382   1.982  -0.169
  146    H    ASP  25           H        ASP  25   7.714  -1.075  -1.613
  147    HA   ASP  25           HA       ASP  25   9.394  -2.599  -1.772
  148    HB2  ASP  25           HB3      ASP  25  10.049  -1.636   1.027
  149    HB3  ASP  25           HB2      ASP  25  11.107  -2.621   0.027
  150    H    GLY  26           H        GLY  26   6.773  -3.361  -0.714
  151    HA2  GLY  26           HA3      GLY  26   5.870  -5.435  -0.199
  152    HA3  GLY  26           HA2      GLY  26   7.479  -6.006   0.214
  153    H    LEU  27           H        LEU  27   6.999  -3.119   1.788
  154    HA   LEU  27           HA       LEU  27   6.320  -4.542   4.264
  155    HB2  LEU  27           HB3      LEU  27   7.542  -1.808   3.873
  156    HB3  LEU  27           HB2      LEU  27   7.262  -2.588   5.417
  157    HG   LEU  27           HG       LEU  27   9.144  -3.596   3.281
  158   HD11  LEU  27          HD11      LEU  27  10.830  -2.484   4.259
  159   HD12  LEU  27          HD12      LEU  27  10.186  -2.731   5.883
  160   HD13  LEU  27          HD13      LEU  27   9.549  -1.437   4.869
  161   HD21  LEU  27          HD21      LEU  27   8.928  -4.520   6.133
  162   HD22  LEU  27          HD22      LEU  27   9.804  -5.270   4.798
  163   HD23  LEU  27          HD23      LEU  27   8.041  -5.291   4.816
  164    HA   PRO  28           HA       PRO  28   2.354  -2.495   4.000
  165    HB2  PRO  28           HB2      PRO  28   1.215  -3.724   6.107
  166    HB3  PRO  28           HB3      PRO  28   1.496  -4.563   4.577
  167    HG2  PRO  28           HG3      PRO  28   3.081  -4.661   7.111
  168    HG3  PRO  28           HG2      PRO  28   2.638  -5.982   6.016
  169    HD2  PRO  28           HD3      PRO  28   5.091  -4.754   6.024
  170    HD3  PRO  28           HD2      PRO  28   4.391  -5.560   4.607
  171    H    VAL  29           H        VAL  29   4.386  -0.960   5.035
  172    HA   VAL  29           HA       VAL  29   3.583  -0.064   7.669
  173    HB   VAL  29           HB       VAL  29   5.993  -0.224   7.069
  174   HG11  VAL  29          HG11      VAL  29   6.529   0.471   5.018
  175   HG12  VAL  29          HG12      VAL  29   6.588   2.081   5.739
  176   HG13  VAL  29          HG13      VAL  29   5.129   1.539   4.909
  177   HG21  VAL  29          HG21      VAL  29   6.514   2.232   7.804
  178   HG22  VAL  29          HG22      VAL  29   5.711   1.117   8.909
  179   HG23  VAL  29          HG23      VAL  29   4.766   2.317   8.027
  Start of MODEL   17
    1    H1   CYS   1           H        CYS   1   3.123   0.819   4.285
    2    HA   CYS   1           HA       CYS   1   2.353   3.519   4.493
    3    HB2  CYS   1           HB3      CYS   1   0.858   1.634   2.718
    4    HB3  CYS   1           HB2      CYS   1   1.442   3.261   2.379
    5    H    GLY   2           H        GLY   2   0.586   0.496   4.977
    6    HA2  GLY   2           HA3      GLY   2  -1.223   0.039   6.333
    7    HA3  GLY   2           HA2      GLY   2  -1.162   1.700   6.897
    8    H    GLU   3           H        GLU   3  -1.394   2.864   4.275
    9    HA   GLU   3           HA       GLU   3  -4.119   3.237   4.107
   10    HB2  GLU   3           HB3      GLU   3  -3.674   4.256   1.894
   11    HB3  GLU   3           HB2      GLU   3  -2.586   4.820   3.154
   12    HG2  GLU   3           HG3      GLU   3  -0.806   3.469   2.320
   13    HG3  GLU   3           HG2      GLU   3  -1.885   2.658   1.184
   14    H    THR   4           H        THR   4  -5.754   2.462   2.931
   15    HA   THR   4           HA       THR   4  -5.449  -0.195   1.803
   16    HB   THR   4           HB       THR   4  -7.923   1.500   2.241
   17    HG1  THR   4           HG1      THR   4  -6.406  -0.070   3.912
   18   HG21  THR   4          HG21      THR   4  -8.215  -0.250   0.523
   19   HG22  THR   4          HG22      THR   4  -9.187  -0.553   1.962
   20   HG23  THR   4          HG23      THR   4  -7.700  -1.462   1.695
   21    H    CYS   5           H        CYS   5  -4.952  -0.358  -0.305
   22    HA   CYS   5           HA       CYS   5  -5.586   1.827  -2.108
   23    HB2  CYS   5           HB3      CYS   5  -4.227   0.585  -3.751
   24    HB3  CYS   5           HB2      CYS   5  -3.355   0.878  -2.252
   25    H    PHE   6           H        PHE   6  -7.899   1.070  -1.440
   26    HA   PHE   6           HA       PHE   6  -9.149  -1.154  -2.497
   27    HB2  PHE   6           HB3      PHE   6 -10.211   0.440  -0.944
   28    HB3  PHE   6           HB2      PHE   6 -10.287   1.638  -2.231
   29    HD1  PHE   6           HD2      PHE   6 -11.175  -1.983  -1.975
   30    HD2  PHE   6           HD1      PHE   6 -12.427   1.963  -2.961
   31    HE1  PHE   6           HE2      PHE   6 -13.377  -2.853  -2.645
   32    HE2  PHE   6           HE1      PHE   6 -14.631   1.100  -3.629
   33    HZ   PHE   6           HZ       PHE   6 -15.108  -1.311  -3.473
   34    H    GLY   7           H        GLY   7  -8.582   1.989  -4.057
   35    HA2  GLY   7           HA3      GLY   7  -9.684   0.956  -6.560
   36    HA3  GLY   7           HA2      GLY   7  -9.231   2.622  -6.238
   37    H    GLY   8           H        GLY   8  -7.042   0.063  -5.392
   38    HA2  GLY   8           HA3      GLY   8  -4.987  -0.538  -6.209
   39    HA3  GLY   8           HA2      GLY   8  -5.633  -0.194  -7.805
   40    H    THR   9           H        THR   9  -5.173   2.062  -5.119
   41    HA   THR   9           HA       THR   9  -2.950   3.325  -6.540
   42    HB   THR   9           HB       THR   9  -5.161   5.059  -5.474
   43    HG1  THR   9           HG1      THR   9  -5.257   3.469  -7.705
   44   HG21  THR   9          HG21      THR   9  -3.542   6.540  -5.981
   45   HG22  THR   9          HG22      THR   9  -4.077   6.299  -7.644
   46   HG23  THR   9          HG23      THR   9  -2.691   5.401  -7.024
   47    H    CYS  10           H        CYS  10  -1.623   4.598  -5.184
   48    HA   CYS  10           HA       CYS  10  -2.213   4.484  -2.313
   49    HB2  CYS  10           HB3      CYS  10   0.487   3.849  -3.527
   50    HB3  CYS  10           HB2      CYS  10   0.085   3.842  -1.813
   51    H    ASN  11           H        ASN  11  -1.539   6.212  -1.140
   52    HA   ASN  11           HA       ASN  11  -0.850   8.598  -2.658
   53    HB2  ASN  11           HB3      ASN  11  -2.689   8.638  -1.004
   54    HB3  ASN  11           HB2      ASN  11  -1.538   8.254   0.271
   55   HD21  ASN  11          HD22      ASN  11  -0.816   9.908   1.383
   56   HD22  ASN  11          HD21      ASN  11  -0.748  11.547   0.846
   57    H    THR  12           H        THR  12   0.753   6.255  -0.782
   58    HA   THR  12           HA       THR  12   2.921   8.101  -0.083
   59    HB   THR  12           HB       THR  12   2.720   5.191   0.679
   60    HG1  THR  12           HG1      THR  12   0.854   6.103   1.475
   61   HG21  THR  12          HG21      THR  12   3.860   6.828   2.687
   62   HG22  THR  12          HG22      THR  12   4.615   7.270   1.157
   63   HG23  THR  12          HG23      THR  12   4.652   5.595   1.706
   64    HA   PRO  13           HA       PRO  13   5.208   6.755  -3.670
   65    HB2  PRO  13           HB2      PRO  13   7.606   7.836  -2.886
   66    HB3  PRO  13           HB3      PRO  13   6.308   8.756  -3.654
   67    HG2  PRO  13           HG3      PRO  13   7.019   8.535  -0.758
   68    HG3  PRO  13           HG2      PRO  13   6.521   9.963  -1.686
   69    HD2  PRO  13           HD3      PRO  13   4.816   8.649  -0.071
   70    HD3  PRO  13           HD2      PRO  13   4.280   9.402  -1.587
   71    H    GLY  14           H        GLY  14   6.171   4.874  -4.076
   72    HA2  GLY  14           HA3      GLY  14   7.820   3.214  -3.796
   73    HA3  GLY  14           HA2      GLY  14   8.024   3.726  -2.127
   74    H    CYS  15           H        CYS  15   4.852   3.713  -2.355
   75    HA   CYS  15           HA       CYS  15   4.629   1.052  -1.216
   76    HB2  CYS  15           HB3      CYS  15   2.684   3.354  -1.438
   77    HB3  CYS  15           HB2      CYS  15   2.273   1.799  -0.724
   78    H    SER  16           H        SER  16   3.750  -0.641  -2.188
   79    HA   SER  16           HA       SER  16   2.626  -0.283  -4.878
   80    HB2  SER  16           HB3      SER  16   3.818  -2.799  -3.685
   81    HB3  SER  16           HB2      SER  16   3.403  -2.512  -5.376
   82    HG   SER  16           HG       SER  16   5.113  -0.637  -4.371
   83    H    CYS  17           H        CYS  17   0.594  -1.050  -5.275
   84    HA   CYS  17           HA       CYS  17  -1.050  -1.579  -3.027
   85    HB2  CYS  17           HB3      CYS  17  -1.902  -0.384  -4.980
   86    HB3  CYS  17           HB2      CYS  17  -1.698  -1.830  -5.963
   87    H    THR  18           H        THR  18  -1.357  -3.364  -2.041
   88    HA   THR  18           HA       THR  18  -1.215  -5.919  -3.486
   89    HB   THR  18           HB       THR  18  -0.444  -5.533  -0.577
   90    HG1  THR  18           HG1      THR  18   1.554  -5.140  -1.208
   91   HG21  THR  18          HG21      THR  18  -1.232  -7.796  -1.370
   92   HG22  THR  18          HG22      THR  18   0.396  -7.766  -0.689
   93   HG23  THR  18          HG23      THR  18   0.172  -7.828  -2.438
   94    H    TRP  19           H        TRP  19  -3.442  -5.079  -3.743
   95    HA   TRP  19           HA       TRP  19  -5.411  -4.459  -2.174
   96    HB2  TRP  19           HB3      TRP  19  -5.343  -5.548  -4.636
   97    HB3  TRP  19           HB2      TRP  19  -6.132  -6.853  -3.754
   98    HD1  TRP  19           HD1      TRP  19  -6.754  -3.410  -5.165
   99    HE1  TRP  19           HE1      TRP  19  -9.218  -2.757  -4.797
  100    HE3  TRP  19           HE3      TRP  19  -8.120  -7.190  -2.013
  101    HZ2  TRP  19           HZ2      TRP  19 -11.445  -3.726  -3.347
  102    HZ3  TRP  19           HZ3      TRP  19 -10.421  -7.250  -1.166
  103    HH2  TRP  19           HH2      TRP  19 -12.055  -5.555  -1.824
  104    HA   PRO  20           HA       PRO  20  -6.816  -4.183  -1.192
  105    HB2  PRO  20           HB2      PRO  20  -8.236  -3.993   1.037
  106    HB3  PRO  20           HB3      PRO  20  -8.723  -5.103  -0.248
  107    HG2  PRO  20           HG3      PRO  20  -7.468  -5.687   2.379
  108    HG3  PRO  20           HG2      PRO  20  -8.576  -6.677   1.415
  109    HD2  PRO  20           HD3      PRO  20  -5.722  -6.854   1.538
  110    HD3  PRO  20           HD2      PRO  20  -6.825  -7.794   0.513
  111    H    ILE  21           H        ILE  21  -4.053  -4.618   0.059
  112    HA   ILE  21           HA       ILE  21  -4.098  -2.157   1.644
  113    HB   ILE  21           HB       ILE  21  -2.535  -3.094   3.295
  114   HG12  ILE  21          HG13      ILE  21  -3.114  -5.763   1.983
  115   HG13  ILE  21          HG12      ILE  21  -1.594  -4.885   1.850
  116   HG21  ILE  21          HG21      ILE  21  -4.200  -4.708   4.376
  117   HG22  ILE  21          HG22      ILE  21  -5.216  -4.411   2.963
  118   HG23  ILE  21          HG23      ILE  21  -4.763  -3.074   4.023
  119   HD11  ILE  21          HD11      ILE  21  -1.630  -5.010   4.453
  120   HD12  ILE  21          HD12      ILE  21  -1.113  -6.399   3.498
  121   HD13  ILE  21          HD13      ILE  21  -2.742  -6.349   4.171
  122    H    CYS  22           H        CYS  22  -2.403  -0.826   1.310
  123    HA   CYS  22           HA       CYS  22  -0.578  -1.550  -0.830
  124    HB2  CYS  22           HB3      CYS  22  -1.722   0.730  -0.548
  125    HB3  CYS  22           HB2      CYS  22  -0.497   1.047   0.671
  126    H    THR  23           H        THR  23   1.570  -1.717  -0.679
  127    HA   THR  23           HA       THR  23   2.811  -1.682   1.990
  128    HB   THR  23           HB       THR  23   4.026  -3.825   1.280
  129    HG1  THR  23           HG1      THR  23   2.852  -3.484  -0.942
  130   HG21  THR  23          HG21      THR  23   1.061  -3.932   1.862
  131   HG22  THR  23          HG22      THR  23   2.361  -3.849   3.052
  132   HG23  THR  23          HG23      THR  23   2.178  -5.284   2.042
  133    H    ARG  24           H        ARG  24   4.712  -0.625   1.956
  134    HA   ARG  24           HA       ARG  24   5.915  -0.045  -0.629
  135    HB2  ARG  24           HB3      ARG  24   6.676   1.861   0.271
  136    HB3  ARG  24           HB2      ARG  24   5.496   1.558   1.527
  137    HG2  ARG  24           HG3      ARG  24   7.271   1.949   2.855
  138    HG3  ARG  24           HG2      ARG  24   7.589   0.238   2.557
  139    HD2  ARG  24           HD3      ARG  24   9.596   1.624   2.242
  140    HD3  ARG  24           HD2      ARG  24   9.111   0.805   0.757
  141    HE   ARG  24           HE       ARG  24   7.976   3.399   0.897
  142   HH11  ARG  24          HH11      ARG  24  10.961   1.694   0.195
  143   HH12  ARG  24          HH12      ARG  24  11.596   2.979  -0.787
  144   HH21  ARG  24          HH22      ARG  24   8.802   5.078  -0.412
  145   HH22  ARG  24          HH21      ARG  24  10.373   4.907  -1.126
  146    H    ASP  25           H        ASP  25   7.683  -0.994  -1.332
  147    HA   ASP  25           HA       ASP  25   9.361  -2.523  -1.515
  148    HB2  ASP  25           HB3      ASP  25   9.905  -1.677   1.343
  149    HB3  ASP  25           HB2      ASP  25  11.027  -2.564   0.318
  150    H    GLY  26           H        GLY  26   6.740  -3.421  -0.611
  151    HA2  GLY  26           HA3      GLY  26   5.836  -5.501  -0.174
  152    HA3  GLY  26           HA2      GLY  26   7.456  -6.098   0.149
  153    H    LEU  27           H        LEU  27   6.676  -3.282   1.885
  154    HA   LEU  27           HA       LEU  27   6.071  -4.899   4.274
  155    HB2  LEU  27           HB3      LEU  27   7.575  -2.287   4.090
  156    HB3  LEU  27           HB2      LEU  27   7.189  -3.128   5.579
  157    HG   LEU  27           HG       LEU  27   8.978  -4.204   3.397
  158   HD11  LEU  27          HD11      LEU  27   9.486  -2.610   5.844
  159   HD12  LEU  27          HD12      LEU  27  10.341  -2.628   4.301
  160   HD13  LEU  27          HD13      LEU  27  10.608  -3.919   5.472
  161   HD21  LEU  27          HD21      LEU  27   9.580  -5.868   5.165
  162   HD22  LEU  27          HD22      LEU  27   7.935  -6.017   4.549
  163   HD23  LEU  27          HD23      LEU  27   8.224  -5.262   6.116
  164    HA   PRO  28           HA       PRO  28   2.305  -2.540   4.391
  165    HB2  PRO  28           HB2      PRO  28   1.381  -3.436   6.762
  166    HB3  PRO  28           HB3      PRO  28   1.397  -4.448   5.313
  167    HG2  PRO  28           HG3      PRO  28   3.311  -4.400   7.613
  168    HG3  PRO  28           HG2      PRO  28   2.626  -5.793   6.757
  169    HD2  PRO  28           HD3      PRO  28   5.131  -4.821   6.280
  170    HD3  PRO  28           HD2      PRO  28   4.158  -5.657   5.055
  171    H    VAL  29           H        VAL  29   4.388  -0.911   4.890
  172    HA   VAL  29           HA       VAL  29   4.128   0.250   7.526
  173    HB   VAL  29           HB       VAL  29   5.795   1.217   5.201
  174   HG11  VAL  29          HG11      VAL  29   5.836   1.894   8.136
  175   HG12  VAL  29          HG12      VAL  29   5.493   2.977   6.787
  176   HG13  VAL  29          HG13      VAL  29   7.118   2.330   7.006
  177   HG21  VAL  29          HG21      VAL  29   6.183  -1.165   6.258
  178   HG22  VAL  29          HG22      VAL  29   6.977  -0.224   7.520
  179   HG23  VAL  29          HG23      VAL  29   7.539  -0.112   5.853
  Start of MODEL   18
    1    H1   CYS   1           H        CYS   1   3.524   1.448   4.107
    2    HA   CYS   1           HA       CYS   1   2.767   4.155   4.656
    3    HB2  CYS   1           HB3      CYS   1   1.641   2.215   2.624
    4    HB3  CYS   1           HB2      CYS   1   1.338   3.950   2.664
    5    H    GLY   2           H        GLY   2   1.254   0.993   4.938
    6    HA2  GLY   2           HA3      GLY   2  -0.581   0.261   6.101
    7    HA3  GLY   2           HA2      GLY   2  -0.353   1.672   7.120
    8    H    GLU   3           H        GLU   3  -1.088   1.656   3.676
    9    HA   GLU   3           HA       GLU   3  -3.667   2.917   4.311
   10    HB2  GLU   3           HB3      GLU   3  -3.445   4.138   2.174
   11    HB3  GLU   3           HB2      GLU   3  -2.162   4.530   3.313
   12    HG2  GLU   3           HG3      GLU   3  -0.576   3.271   2.122
   13    HG3  GLU   3           HG2      GLU   3  -1.820   2.470   1.161
   14    H    THR   4           H        THR   4  -5.418   2.472   2.936
   15    HA   THR   4           HA       THR   4  -5.260  -0.168   1.699
   16    HB   THR   4           HB       THR   4  -7.588   1.542   2.596
   17    HG1  THR   4           HG1      THR   4  -6.549  -0.971   3.447
   18   HG21  THR   4          HG21      THR   4  -9.106  -0.190   1.901
   19   HG22  THR   4          HG22      THR   4  -7.771  -1.198   1.342
   20   HG23  THR   4          HG23      THR   4  -8.152   0.305   0.502
   21    H    CYS   5           H        CYS   5  -5.021  -0.303  -0.436
   22    HA   CYS   5           HA       CYS   5  -5.620   1.993  -2.117
   23    HB2  CYS   5           HB3      CYS   5  -4.622   0.548  -3.935
   24    HB3  CYS   5           HB2      CYS   5  -3.529   0.969  -2.622
   25    H    PHE   6           H        PHE   6  -7.910   1.472  -1.291
   26    HA   PHE   6           HA       PHE   6  -9.428  -0.646  -2.229
   27    HB2  PHE   6           HB3      PHE   6 -10.087   1.230  -0.608
   28    HB3  PHE   6           HB2      PHE   6 -10.478   2.175  -2.041
   29    HD1  PHE   6           HD1      PHE   6 -11.089  -1.335  -0.925
   30    HD2  PHE   6           HD2      PHE   6 -12.727   2.285  -2.452
   31    HE1  PHE   6           HE1      PHE   6 -13.318  -2.374  -0.985
   32    HE2  PHE   6           HE2      PHE   6 -14.959   1.250  -2.515
   33    HZ   PHE   6           HZ       PHE   6 -15.257  -1.081  -1.781
   34    H    GLY   7           H        GLY   7  -8.602   2.405  -3.805
   35    HA2  GLY   7           HA3      GLY   7 -10.039   1.619  -6.220
   36    HA3  GLY   7           HA2      GLY   7  -9.270   3.172  -5.927
   37    H    GLY   8           H        GLY   8  -7.485   0.280  -5.239
   38    HA2  GLY   8           HA3      GLY   8  -5.820  -0.825  -6.399
   39    HA3  GLY   8           HA2      GLY   8  -6.277   0.063  -7.842
   40    H    THR   9           H        THR   9  -5.915   2.692  -6.768
   41    HA   THR   9           HA       THR   9  -3.018   2.807  -6.959
   42    HB   THR   9           HB       THR   9  -4.755   5.227  -6.685
   43    HG1  THR   9           HG1      THR   9  -5.085   3.315  -8.541
   44   HG21  THR   9          HG21      THR   9  -2.085   4.929  -7.056
   45   HG22  THR   9          HG22      THR   9  -3.006   6.336  -7.589
   46   HG23  THR   9          HG23      THR   9  -2.642   5.039  -8.727
   47    H    CYS  10           H        CYS  10  -1.680   3.807  -5.478
   48    HA   CYS  10           HA       CYS  10  -2.743   4.022  -2.750
   49    HB2  CYS  10           HB3      CYS  10   0.132   3.668  -3.643
   50    HB3  CYS  10           HB2      CYS  10  -0.436   3.689  -1.978
   51    H    ASN  11           H        ASN  11  -1.989   5.769  -1.427
   52    HA   ASN  11           HA       ASN  11  -1.735   8.240  -2.937
   53    HB2  ASN  11           HB3      ASN  11  -3.347   8.132  -1.099
   54    HB3  ASN  11           HB2      ASN  11  -2.063   7.716   0.029
   55   HD21  ASN  11          HD22      ASN  11  -1.310   9.319   1.190
   56   HD22  ASN  11          HD21      ASN  11  -1.356  10.994   0.771
   57    H    THR  12           H        THR  12   0.202   6.133  -0.977
   58    HA   THR  12           HA       THR  12   2.354   8.125  -0.855
   59    HB   THR  12           HB       THR  12   2.383   5.409   0.443
   60    HG1  THR  12           HG1      THR  12   0.538   6.332   1.244
   61   HG21  THR  12          HG21      THR  12   4.089   7.743   0.421
   62   HG22  THR  12          HG22      THR  12   4.400   6.128   1.056
   63   HG23  THR  12          HG23      THR  12   3.587   7.328   2.060
   64    HA   PRO  13           HA       PRO  13   4.208   6.041  -4.359
   65    HB2  PRO  13           HB2      PRO  13   6.507   7.773  -3.746
   66    HB3  PRO  13           HB3      PRO  13   5.524   7.693  -5.211
   67    HG2  PRO  13           HG3      PRO  13   5.379   9.777  -3.517
   68    HG3  PRO  13           HG2      PRO  13   3.961   9.185  -4.403
   69    HD2  PRO  13           HD3      PRO  13   4.743   8.721  -1.549
   70    HD3  PRO  13           HD2      PRO  13   3.139   9.050  -2.239
   71    H    GLY  14           H        GLY  14   5.568   4.343  -4.545
   72    HA2  GLY  14           HA3      GLY  14   7.584   3.179  -3.991
   73    HA3  GLY  14           HA2      GLY  14   7.487   3.865  -2.373
   74    H    CYS  15           H        CYS  15   4.580   3.329  -2.231
   75    HA   CYS  15           HA       CYS  15   4.828   0.565  -1.372
   76    HB2  CYS  15           HB3      CYS  15   2.906   2.776  -0.831
   77    HB3  CYS  15           HB2      CYS  15   2.316   1.123  -0.689
   78    H    SER  16           H        SER  16   3.977  -1.128  -2.338
   79    HA   SER  16           HA       SER  16   2.640  -0.742  -4.895
   80    HB2  SER  16           HB3      SER  16   3.567  -3.321  -3.606
   81    HB3  SER  16           HB2      SER  16   3.156  -3.064  -5.303
   82    HG   SER  16           HG       SER  16   5.047  -1.313  -4.499
   83    H    CYS  17           H        CYS  17   0.546  -1.427  -5.293
   84    HA   CYS  17           HA       CYS  17  -1.113  -1.646  -2.984
   85    HB2  CYS  17           HB3      CYS  17  -1.970  -0.450  -4.880
   86    HB3  CYS  17           HB2      CYS  17  -1.775  -1.857  -5.916
   87    H    THR  18           H        THR  18  -1.273  -3.365  -1.883
   88    HA   THR  18           HA       THR  18  -1.460  -5.980  -3.218
   89    HB   THR  18           HB       THR  18  -0.658  -5.526  -0.328
   90    HG1  THR  18           HG1      THR  18   1.157  -4.814  -1.197
   91   HG21  THR  18          HG21      THR  18  -1.534  -7.758  -0.916
   92   HG22  THR  18          HG22      THR  18   0.170  -7.814  -0.465
   93   HG23  THR  18          HG23      THR  18  -0.296  -7.901  -2.164
   94    H    TRP  19           H        TRP  19  -3.614  -4.925  -3.491
   95    HA   TRP  19           HA       TRP  19  -5.500  -4.091  -1.926
   96    HB2  TRP  19           HB3      TRP  19  -5.582  -5.221  -4.350
   97    HB3  TRP  19           HB2      TRP  19  -6.410  -6.477  -3.437
   98    HD1  TRP  19           HD1      TRP  19  -6.944  -3.099  -4.971
   99    HE1  TRP  19           HE1      TRP  19  -9.352  -2.301  -4.521
  100    HE3  TRP  19           HE3      TRP  19  -8.315  -6.594  -1.510
  101    HZ2  TRP  19           HZ2      TRP  19 -11.538  -3.058  -2.899
  102    HZ3  TRP  19           HZ3      TRP  19 -10.565  -6.481  -0.542
  103    HH2  TRP  19           HH2      TRP  19 -12.152  -4.752  -1.227
  104    HA   PRO  20           HA       PRO  20  -6.796  -3.636  -0.888
  105    HB2  PRO  20           HB2      PRO  20  -8.123  -3.251   1.374
  106    HB3  PRO  20           HB3      PRO  20  -8.762  -4.330   0.130
  107    HG2  PRO  20           HG3      PRO  20  -7.505  -4.989   2.736
  108    HG3  PRO  20           HG2      PRO  20  -8.730  -5.881   1.819
  109    HD2  PRO  20           HD3      PRO  20  -5.901  -6.333   1.878
  110    HD3  PRO  20           HD2      PRO  20  -7.120  -7.192   0.915
  111    H    ILE  21           H        ILE  21  -4.041  -4.237   0.178
  112    HA   ILE  21           HA       ILE  21  -3.809  -1.802   1.772
  113    HB   ILE  21           HB       ILE  21  -2.200  -2.963   3.335
  114   HG12  ILE  21          HG13      ILE  21  -3.083  -5.526   3.490
  115   HG13  ILE  21          HG12      ILE  21  -3.121  -5.285   1.748
  116   HG21  ILE  21          HG21      ILE  21  -5.117  -3.723   3.355
  117   HG22  ILE  21          HG22      ILE  21  -4.362  -2.326   4.128
  118   HG23  ILE  21          HG23      ILE  21  -4.026  -3.950   4.725
  119   HD11  ILE  21          HD11      ILE  21  -0.723  -4.486   1.964
  120   HD12  ILE  21          HD12      ILE  21  -1.024  -6.206   2.212
  121   HD13  ILE  21          HD13      ILE  21  -0.770  -5.147   3.599
  122    H    CYS  22           H        CYS  22  -2.106  -0.590   1.291
  123    HA   CYS  22           HA       CYS  22  -0.322  -1.464  -0.826
  124    HB2  CYS  22           HB3      CYS  22  -0.367   1.159   0.670
  125    HB3  CYS  22           HB2      CYS  22   0.544   0.818  -0.791
  126    H    THR  23           H        THR  23   1.732  -2.025  -0.636
  127    HA   THR  23           HA       THR  23   3.121  -1.664   1.926
  128    HB   THR  23           HB       THR  23   4.049  -4.051   1.525
  129    HG1  THR  23           HG1      THR  23   2.434  -5.402   0.482
  130   HG21  THR  23          HG21      THR  23   1.394  -3.294   2.648
  131   HG22  THR  23          HG22      THR  23   2.833  -3.903   3.467
  132   HG23  THR  23          HG23      THR  23   1.811  -5.005   2.546
  133    H    ARG  24           H        ARG  24   5.201  -1.007   1.663
  134    HA   ARG  24           HA       ARG  24   6.271  -1.011  -1.056
  135    HB2  ARG  24           HB3      ARG  24   7.899   0.613  -0.218
  136    HB3  ARG  24           HB2      ARG  24   6.259   1.160   0.057
  137    HG2  ARG  24           HG3      ARG  24   6.430   0.944   2.335
  138    HG3  ARG  24           HG2      ARG  24   7.703  -0.276   2.232
  139    HD2  ARG  24           HD3      ARG  24   8.016   2.643   1.536
  140    HD3  ARG  24           HD2      ARG  24   8.552   1.888   3.038
  141    HE   ARG  24           HE       ARG  24   9.717   0.421   1.005
  142   HH11  ARG  24          HH11      ARG  24   9.809   3.765   2.063
  143   HH12  ARG  24          HH12      ARG  24  11.426   4.020   1.505
  144   HH21  ARG  24          HH22      ARG  24  11.795   0.726   0.280
  145   HH22  ARG  24          HH21      ARG  24  12.577   2.273   0.476
  146    H    ASP  25           H        ASP  25   7.868  -2.356  -1.600
  147    HA   ASP  25           HA       ASP  25   9.418  -4.022  -1.472
  148    HB2  ASP  25           HB3      ASP  25  10.095  -2.868   1.248
  149    HB3  ASP  25           HB2      ASP  25  11.133  -3.866   0.238
  150    H    GLY  26           H        GLY  26   6.704  -4.335  -0.397
  151    HA2  GLY  26           HA3      GLY  26   5.519  -6.137   0.431
  152    HA3  GLY  26           HA2      GLY  26   7.045  -6.906   0.841
  153    H    LEU  27           H        LEU  27   6.969  -3.783   2.063
  154    HA   LEU  27           HA       LEU  27   6.208  -4.807   4.715
  155    HB2  LEU  27           HB3      LEU  27   7.999  -2.490   3.985
  156    HB3  LEU  27           HB2      LEU  27   7.604  -2.985   5.619
  157    HG   LEU  27           HG       LEU  27   9.122  -4.659   3.615
  158   HD11  LEU  27          HD11      LEU  27  10.953  -3.590   4.256
  159   HD12  LEU  27          HD12      LEU  27  10.621  -4.006   5.937
  160   HD13  LEU  27          HD13      LEU  27   9.976  -2.514   5.255
  161   HD21  LEU  27          HD21      LEU  27   8.897  -6.389   4.994
  162   HD22  LEU  27          HD22      LEU  27   7.674  -5.457   5.858
  163   HD23  LEU  27          HD23      LEU  27   9.354  -5.414   6.391
  164    HA   PRO  28           HA       PRO  28   2.788  -1.968   4.555
  165    HB2  PRO  28           HB2      PRO  28   2.282  -2.590   7.335
  166    HB3  PRO  28           HB3      PRO  28   1.389  -3.122   5.910
  167    HG2  PRO  28           HG3      PRO  28   2.873  -4.795   7.482
  168    HG3  PRO  28           HG2      PRO  28   2.543  -5.090   5.765
  169    HD2  PRO  28           HD3      PRO  28   5.000  -3.968   7.060
  170    HD3  PRO  28           HD2      PRO  28   4.860  -5.123   5.716
  171    H    VAL  29           H        VAL  29   4.801  -0.393   4.600
  172    HA   VAL  29           HA       VAL  29   5.138   0.943   7.135
  173    HB   VAL  29           HB       VAL  29   6.262   1.691   4.435
  174   HG11  VAL  29          HG11      VAL  29   6.803   3.589   5.487
  175   HG12  VAL  29          HG12      VAL  29   7.993   2.617   6.353
  176   HG13  VAL  29          HG13      VAL  29   6.412   2.925   7.073
  177   HG21  VAL  29          HG21      VAL  29   6.926  -0.462   6.189
  178   HG22  VAL  29          HG22      VAL  29   8.265   0.685   6.148
  179   HG23  VAL  29          HG23      VAL  29   7.660  -0.019   4.648
  Start of MODEL   19
    1    H1   CYS   1           H        CYS   1   3.515   0.820   4.221
    2    HA   CYS   1           HA       CYS   1   2.864   3.548   4.545
    3    HB2  CYS   1           HB3      CYS   1   1.118   1.847   2.850
    4    HB3  CYS   1           HB2      CYS   1   1.914   3.372   2.469
    5    H    GLY   2           H        GLY   2   1.108   0.553   5.146
    6    HA2  GLY   2           HA3      GLY   2  -0.749   0.073   6.398
    7    HA3  GLY   2           HA2      GLY   2  -0.379   1.535   7.299
    8    H    GLU   3           H        GLU   3  -1.216   1.304   3.878
    9    HA   GLU   3           HA       GLU   3  -3.714   2.722   4.489
   10    HB2  GLU   3           HB3      GLU   3  -3.414   3.965   2.355
   11    HB3  GLU   3           HB2      GLU   3  -2.195   4.334   3.565
   12    HG2  GLU   3           HG3      GLU   3  -0.562   3.028   2.436
   13    HG3  GLU   3           HG2      GLU   3  -1.770   2.366   1.334
   14    H    THR   4           H        THR   4  -5.500   2.206   3.320
   15    HA   THR   4           HA       THR   4  -5.425  -0.351   1.945
   16    HB   THR   4           HB       THR   4  -7.758   1.423   2.717
   17    HG1  THR   4           HG1      THR   4  -6.755  -0.953   3.935
   18   HG21  THR   4          HG21      THR   4  -7.596  -1.023   1.134
   19   HG22  THR   4          HG22      THR   4  -8.926   0.121   1.314
   20   HG23  THR   4          HG23      THR   4  -8.696  -1.158   2.505
   21    H    CYS   5           H        CYS   5  -4.982  -0.311  -0.177
   22    HA   CYS   5           HA       CYS   5  -5.675   2.021  -1.764
   23    HB2  CYS   5           HB3      CYS   5  -4.410   0.884  -3.568
   24    HB3  CYS   5           HB2      CYS   5  -3.463   1.103  -2.102
   25    H    PHE   6           H        PHE   6  -7.967   1.232  -1.072
   26    HA   PHE   6           HA       PHE   6  -9.275  -0.899  -2.245
   27    HB2  PHE   6           HB3      PHE   6 -10.260   0.580  -0.532
   28    HB3  PHE   6           HB2      PHE   6 -10.381   1.870  -1.723
   29    HD1  PHE   6           HD1      PHE   6 -11.282  -1.757  -1.697
   30    HD2  PHE   6           HD2      PHE   6 -12.546   2.255  -2.338
   31    HE1  PHE   6           HE1      PHE   6 -13.513  -2.567  -2.341
   32    HE2  PHE   6           HE2      PHE   6 -14.781   1.451  -2.982
   33    HZ   PHE   6           HZ       PHE   6 -15.267  -0.963  -2.984
   34    H    GLY   7           H        GLY   7  -8.780   2.363  -3.576
   35    HA2  GLY   7           HA3      GLY   7  -9.983   1.529  -6.103
   36    HA3  GLY   7           HA2      GLY   7  -9.492   3.162  -5.676
   37    H    GLY   8           H        GLY   8  -7.304   0.530  -5.113
   38    HA2  GLY   8           HA3      GLY   8  -5.292  -0.032  -6.059
   39    HA3  GLY   8           HA2      GLY   8  -5.997   0.439  -7.598
   40    H    THR   9           H        THR   9  -5.504   2.541  -4.819
   41    HA   THR   9           HA       THR   9  -3.326   3.901  -6.236
   42    HB   THR   9           HB       THR   9  -5.409   5.521  -4.813
   43    HG1  THR   9           HG1      THR   9  -5.778   4.117  -7.132
   44   HG21  THR   9          HG21      THR   9  -3.896   7.075  -5.384
   45   HG22  THR   9          HG22      THR   9  -4.526   6.899  -7.022
   46   HG23  THR   9          HG23      THR   9  -3.095   5.996  -6.527
   47    H    CYS  10           H        CYS  10  -1.870   4.991  -4.868
   48    HA   CYS  10           HA       CYS  10  -2.233   4.545  -1.988
   49    HB2  CYS  10           HB3      CYS  10   0.361   4.162  -3.502
   50    HB3  CYS  10           HB2      CYS  10   0.129   3.957  -1.769
   51    H    ASN  11           H        ASN  11  -1.523   6.136  -0.663
   52    HA   ASN  11           HA       ASN  11  -0.998   8.711  -1.917
   53    HB2  ASN  11           HB3      ASN  11  -2.702   8.497  -0.128
   54    HB3  ASN  11           HB2      ASN  11  -1.441   8.000   0.994
   55   HD21  ASN  11          HD22      ASN  11  -0.674   9.536   2.238
   56   HD22  ASN  11          HD21      ASN  11  -0.674  11.227   1.891
   57    H    THR  12           H        THR  12   0.736   6.190  -0.410
   58    HA   THR  12           HA       THR  12   2.969   7.962   0.274
   59    HB   THR  12           HB       THR  12   2.824   5.000   0.803
   60    HG1  THR  12           HG1      THR  12   1.003   5.803   1.794
   61   HG21  THR  12          HG21      THR  12   4.452   5.401   2.458
   62   HG22  THR  12          HG22      THR  12   4.178   7.144   2.421
   63   HG23  THR  12          HG23      THR  12   4.974   6.347   1.064
   64    HA   PRO  13           HA       PRO  13   4.915   6.863  -3.598
   65    HB2  PRO  13           HB2      PRO  13   7.303   8.050  -2.336
   66    HB3  PRO  13           HB3      PRO  13   6.465   8.521  -3.818
   67    HG2  PRO  13           HG3      PRO  13   6.322  10.014  -1.597
   68    HG3  PRO  13           HG2      PRO  13   4.941   9.844  -2.695
   69    HD2  PRO  13           HD3      PRO  13   5.455   8.493  -0.072
   70    HD3  PRO  13           HD2      PRO  13   3.940   9.162  -0.718
   71    H    GLY  14           H        GLY  14   6.009   5.090  -4.228
   72    HA2  GLY  14           HA3      GLY  14   7.699   3.461  -4.127
   73    HA3  GLY  14           HA2      GLY  14   7.969   3.876  -2.440
   74    H    CYS  15           H        CYS  15   4.828   3.762  -2.385
   75    HA   CYS  15           HA       CYS  15   4.768   1.002  -1.498
   76    HB2  CYS  15           HB3      CYS  15   2.740   3.239  -1.327
   77    HB3  CYS  15           HB2      CYS  15   2.477   1.619  -0.689
   78    H    SER  16           H        SER  16   3.754  -0.618  -2.479
   79    HA   SER  16           HA       SER  16   2.474  -0.073  -5.064
   80    HB2  SER  16           HB3      SER  16   3.622  -2.694  -4.073
   81    HB3  SER  16           HB2      SER  16   3.136  -2.295  -5.721
   82    HG   SER  16           HG       SER  16   4.969  -0.546  -4.710
   83    H    CYS  17           H        CYS  17   0.405  -0.777  -5.410
   84    HA   CYS  17           HA       CYS  17  -1.146  -1.359  -3.103
   85    HB2  CYS  17           HB3      CYS  17  -2.069  -0.030  -4.917
   86    HB3  CYS  17           HB2      CYS  17  -1.934  -1.399  -6.013
   87    H    THR  18           H        THR  18  -1.315  -3.189  -2.180
   88    HA   THR  18           HA       THR  18  -1.323  -5.673  -3.759
   89    HB   THR  18           HB       THR  18  -0.592  -5.471  -0.826
   90    HG1  THR  18           HG1      THR  18   1.453  -5.103  -1.367
   91   HG21  THR  18          HG21      THR  18   0.602  -7.655  -1.475
   92   HG22  THR  18          HG22      THR  18  -0.390  -7.608  -2.931
   93   HG23  THR  18          HG23      THR  18  -1.157  -7.690  -1.345
   94    H    TRP  19           H        TRP  19  -3.542  -4.755  -3.968
   95    HA   TRP  19           HA       TRP  19  -5.487  -4.174  -2.359
   96    HB2  TRP  19           HB3      TRP  19  -5.472  -5.120  -4.872
   97    HB3  TRP  19           HB2      TRP  19  -6.264  -6.468  -4.061
   98    HD1  TRP  19           HD1      TRP  19  -6.878  -2.960  -5.285
   99    HE1  TRP  19           HE1      TRP  19  -9.327  -2.299  -4.832
  100    HE3  TRP  19           HE3      TRP  19  -8.221  -6.860  -2.271
  101    HZ2  TRP  19           HZ2      TRP  19 -11.532  -3.307  -3.382
  102    HZ3  TRP  19           HZ3      TRP  19 -10.505  -6.933  -1.380
  103    HH2  TRP  19           HH2      TRP  19 -12.133  -5.194  -1.928
  104    HA   PRO  20           HA       PRO  20  -6.866  -3.909  -1.344
  105    HB2  PRO  20           HB2      PRO  20  -8.235  -3.782   0.920
  106    HB3  PRO  20           HB3      PRO  20  -8.779  -4.817  -0.402
  107    HG2  PRO  20           HG3      PRO  20  -7.477  -5.553   2.165
  108    HG3  PRO  20           HG2      PRO  20  -8.648  -6.462   1.197
  109    HD2  PRO  20           HD3      PRO  20  -5.808  -6.758   1.225
  110    HD3  PRO  20           HD2      PRO  20  -6.972  -7.593   0.177
  111    H    ILE  21           H        ILE  21  -4.091  -4.490  -0.166
  112    HA   ILE  21           HA       ILE  21  -4.037  -2.099   1.527
  113    HB   ILE  21           HB       ILE  21  -2.460  -3.153   3.097
  114   HG12  ILE  21          HG13      ILE  21  -3.171  -5.749   1.709
  115   HG13  ILE  21          HG12      ILE  21  -1.629  -4.916   1.541
  116   HG21  ILE  21          HG21      ILE  21  -5.190  -4.369   2.777
  117   HG22  ILE  21          HG22      ILE  21  -4.675  -3.082   3.870
  118   HG23  ILE  21          HG23      ILE  21  -4.155  -4.743   4.156
  119   HD11  ILE  21          HD11      ILE  21  -1.297  -5.179   3.987
  120   HD12  ILE  21          HD12      ILE  21  -1.372  -6.701   3.100
  121   HD13  ILE  21          HD13      ILE  21  -2.765  -6.155   4.033
  122    H    CYS  22           H        CYS  22  -2.390  -0.762   1.137
  123    HA   CYS  22           HA       CYS  22  -0.567  -1.445  -1.019
  124    HB2  CYS  22           HB3      CYS  22  -1.725   0.817  -0.701
  125    HB3  CYS  22           HB2      CYS  22  -0.515   1.126   0.532
  126    H    THR  23           H        THR  23   1.577  -1.613  -0.880
  127    HA   THR  23           HA       THR  23   2.897  -1.508   1.738
  128    HB   THR  23           HB       THR  23   3.969  -3.763   1.164
  129    HG1  THR  23           HG1      THR  23   2.583  -3.498  -1.012
  130   HG21  THR  23          HG21      THR  23   2.629  -4.564   2.760
  131   HG22  THR  23          HG22      THR  23   1.263  -4.606   1.645
  132   HG23  THR  23          HG23      THR  23   1.609  -3.139   2.560
  133    H    ARG  24           H        ARG  24   4.969  -0.733   1.570
  134    HA   ARG  24           HA       ARG  24   5.993  -0.357  -1.132
  135    HB2  ARG  24           HB3      ARG  24   7.705   1.087  -0.037
  136    HB3  ARG  24           HB2      ARG  24   6.062   1.655   0.140
  137    HG2  ARG  24           HG3      ARG  24   6.919   2.044   2.225
  138    HG3  ARG  24           HG2      ARG  24   6.191   0.455   2.447
  139    HD2  ARG  24           HD3      ARG  24   8.596   0.927   3.334
  140    HD3  ARG  24           HD2      ARG  24   8.228  -0.612   2.565
  141    HE   ARG  24           HE       ARG  24   9.818  -0.123   1.024
  142   HH11  ARG  24          HH11      ARG  24   8.674   2.956   2.277
  143   HH12  ARG  24          HH12      ARG  24   9.755   3.884   1.297
  144   HH21  ARG  24          HH22      ARG  24  11.225   1.067  -0.233
  145   HH22  ARG  24          HH21      ARG  24  11.218   2.808  -0.142
  146    H    ASP  25           H        ASP  25   7.588  -1.527  -1.944
  147    HA   ASP  25           HA       ASP  25   9.122  -3.197  -2.169
  148    HB2  ASP  25           HB3      ASP  25   9.929  -2.451   0.656
  149    HB3  ASP  25           HB2      ASP  25  10.919  -3.293  -0.530
  150    H    GLY  26           H        GLY  26   6.472  -3.765  -1.028
  151    HA2  GLY  26           HA3      GLY  26   5.379  -5.711  -0.434
  152    HA3  GLY  26           HA2      GLY  26   6.943  -6.488  -0.238
  153    H    LEU  27           H        LEU  27   6.695  -3.557   1.446
  154    HA   LEU  27           HA       LEU  27   6.208  -5.023   3.952
  155    HB2  LEU  27           HB3      LEU  27   7.797  -2.495   3.500
  156    HB3  LEU  27           HB2      LEU  27   7.546  -3.273   5.051
  157    HG   LEU  27           HG       LEU  27   9.031  -4.493   2.721
  158   HD11  LEU  27          HD11      LEU  27  10.671  -3.127   3.379
  159   HD12  LEU  27          HD12      LEU  27  10.803  -4.186   4.782
  160   HD13  LEU  27          HD13      LEU  27   9.847  -2.707   4.880
  161   HD21  LEU  27          HD21      LEU  27   8.079  -6.239   4.020
  162   HD22  LEU  27          HD22      LEU  27   8.507  -5.438   5.531
  163   HD23  LEU  27          HD23      LEU  27   9.771  -6.110   4.501
  164    HA   PRO  28           HA       PRO  28   2.583  -2.475   4.332
  165    HB2  PRO  28           HB2      PRO  28   2.286  -3.546   7.013
  166    HB3  PRO  28           HB3      PRO  28   1.327  -3.889   5.572
  167    HG2  PRO  28           HG3      PRO  28   2.975  -5.717   6.740
  168    HG3  PRO  28           HG2      PRO  28   2.587  -5.718   5.011
  169    HD2  PRO  28           HD3      PRO  28   5.031  -4.688   6.405
  170    HD3  PRO  28           HD2      PRO  28   4.899  -5.603   4.886
  171    H    VAL  29           H        VAL  29   4.767  -0.955   4.670
  172    HA   VAL  29           HA       VAL  29   4.799   0.163   7.337
  173    HB   VAL  29           HB       VAL  29   6.292   1.089   4.880
  174   HG11  VAL  29          HG11      VAL  29   6.223   2.859   6.468
  175   HG12  VAL  29          HG12      VAL  29   7.820   2.121   6.583
  176   HG13  VAL  29          HG13      VAL  29   6.594   1.761   7.799
  177   HG21  VAL  29          HG21      VAL  29   7.112  -1.056   5.230
  178   HG22  VAL  29          HG22      VAL  29   6.965  -0.932   6.983
  179   HG23  VAL  29          HG23      VAL  29   8.236  -0.046   6.140
  Start of MODEL   20
    1    H1   CYS   1           H        CYS   1   3.274   1.543   4.298
    2    HA   CYS   1           HA       CYS   1   2.393   4.207   4.943
    3    HB2  CYS   1           HB3      CYS   1   1.469   2.365   2.724
    4    HB3  CYS   1           HB2      CYS   1   1.136   4.090   2.844
    5    H    GLY   2           H        GLY   2   1.039   0.966   4.897
    6    HA2  GLY   2           HA3      GLY   2  -0.810   0.045   5.880
    7    HA3  GLY   2           HA2      GLY   2  -0.729   1.380   7.017
    8    H    GLU   3           H        GLU   3  -1.223   1.767   3.567
    9    HA   GLU   3           HA       GLU   3  -3.879   2.847   4.168
   10    HB2  GLU   3           HB3      GLU   3  -3.651   4.011   1.959
   11    HB3  GLU   3           HB2      GLU   3  -2.493   4.516   3.182
   12    HG2  GLU   3           HG3      GLU   3  -0.743   3.291   2.145
   13    HG3  GLU   3           HG2      GLU   3  -1.871   2.496   1.047
   14    H    THR   4           H        THR   4  -5.658   2.270   2.969
   15    HA   THR   4           HA       THR   4  -5.502  -0.354   1.735
   16    HB   THR   4           HB       THR   4  -7.904   1.403   2.315
   17    HG1  THR   4           HG1      THR   4  -6.614  -0.647   3.797
   18   HG21  THR   4          HG21      THR   4  -9.001  -0.971   2.266
   19   HG22  THR   4          HG22      THR   4  -7.608  -1.381   1.264
   20   HG23  THR   4          HG23      THR   4  -8.713  -0.103   0.758
   21    H    CYS   5           H        CYS   5  -4.969  -0.390  -0.368
   22    HA   CYS   5           HA       CYS   5  -5.710   1.821  -2.098
   23    HB2  CYS   5           HB3      CYS   5  -4.335   0.661  -3.797
   24    HB3  CYS   5           HB2      CYS   5  -3.449   0.984  -2.312
   25    H    PHE   6           H        PHE   6  -7.987   0.985  -1.451
   26    HA   PHE   6           HA       PHE   6  -9.163  -1.265  -2.549
   27    HB2  PHE   6           HB3      PHE   6 -10.271   0.245  -0.947
   28    HB3  PHE   6           HB2      PHE   6 -10.395   1.478  -2.196
   29    HD1  PHE   6           HD1      PHE   6 -11.164  -2.177  -2.037
   30    HD2  PHE   6           HD2      PHE   6 -12.546   1.751  -2.914
   31    HE1  PHE   6           HE1      PHE   6 -13.338  -3.100  -2.727
   32    HE2  PHE   6           HE2      PHE   6 -14.722   0.835  -3.605
   33    HZ   PHE   6           HZ       PHE   6 -15.121  -1.593  -3.512
   34    H    GLY   7           H        GLY   7  -8.685   1.925  -4.033
   35    HA2  GLY   7           HA3      GLY   7  -9.870   1.015  -6.528
   36    HA3  GLY   7           HA2      GLY   7  -9.270   2.629  -6.188
   37    H    GLY   8           H        GLY   8  -7.168   0.028  -5.384
   38    HA2  GLY   8           HA3      GLY   8  -5.208  -0.728  -6.307
   39    HA3  GLY   8           HA2      GLY   8  -5.909  -0.371  -7.877
   40    H    THR   9           H        THR   9  -5.291   1.936  -5.290
   41    HA   THR   9           HA       THR   9  -2.976   3.010  -6.691
   42    HB   THR   9           HB       THR   9  -5.172   4.918  -5.935
   43    HG1  THR   9           HG1      THR   9  -5.149   3.172  -8.061
   44   HG21  THR   9          HG21      THR   9  -3.679   5.693  -8.221
   45   HG22  THR   9          HG22      THR   9  -2.541   5.140  -6.991
   46   HG23  THR   9          HG23      THR   9  -3.687   6.427  -6.617
   47    H    CYS  10           H        CYS  10  -1.677   4.317  -5.352
   48    HA   CYS  10           HA       CYS  10  -2.412   4.285  -2.504
   49    HB2  CYS  10           HB3      CYS  10   0.385   4.006  -3.627
   50    HB3  CYS  10           HB2      CYS  10  -0.084   3.908  -1.932
   51    H    ASN  11           H        ASN  11  -1.855   6.048  -1.281
   52    HA   ASN  11           HA       ASN  11  -1.505   8.521  -2.775
   53    HB2  ASN  11           HB3      ASN  11  -3.246   8.393  -1.048
   54    HB3  ASN  11           HB2      ASN  11  -2.030   8.012   0.166
   55   HD21  ASN  11          HD22      ASN  11  -1.314   9.639   1.326
   56   HD22  ASN  11          HD21      ASN  11  -1.383  11.307   0.889
   57    H    THR  12           H        THR  12   0.303   6.370  -0.781
   58    HA   THR  12           HA       THR  12   2.418   8.363  -0.392
   59    HB   THR  12           HB       THR  12   2.414   5.576   0.735
   60    HG1  THR  12           HG1      THR  12   0.478   6.380   1.442
   61   HG21  THR  12          HG21      THR  12   4.394   7.261   0.802
   62   HG22  THR  12          HG22      THR  12   3.956   6.381   2.265
   63   HG23  THR  12          HG23      THR  12   3.442   8.055   2.058
   64    HA   PRO  13           HA       PRO  13   4.561   6.547  -3.880
   65    HB2  PRO  13           HB2      PRO  13   6.797   8.206  -2.912
   66    HB3  PRO  13           HB3      PRO  13   5.969   8.240  -4.470
   67    HG2  PRO  13           HG3      PRO  13   5.643  10.196  -2.663
   68    HG3  PRO  13           HG2      PRO  13   4.316   9.663  -3.712
   69    HD2  PRO  13           HD3      PRO  13   4.843   9.005  -0.837
   70    HD3  PRO  13           HD2      PRO  13   3.305   9.380  -1.644
   71    H    GLY  14           H        GLY  14   5.953   4.864  -4.098
   72    HA2  GLY  14           HA3      GLY  14   7.875   3.601  -3.486
   73    HA3  GLY  14           HA2      GLY  14   7.709   4.204  -1.842
   74    H    CYS  15           H        CYS  15   4.789   3.730  -1.908
   75    HA   CYS  15           HA       CYS  15   4.896   0.934  -1.141
   76    HB2  CYS  15           HB3      CYS  15   3.055   3.214  -0.639
   77    HB3  CYS  15           HB2      CYS  15   2.348   1.603  -0.633
   78    H    SER  16           H        SER  16   3.916  -0.701  -2.150
   79    HA   SER  16           HA       SER  16   2.726  -0.142  -4.772
   80    HB2  SER  16           HB3      SER  16   3.843  -2.759  -3.735
   81    HB3  SER  16           HB2      SER  16   3.409  -2.372  -5.401
   82    HG   SER  16           HG       SER  16   5.187  -0.597  -4.351
   83    H    CYS  17           H        CYS  17   0.697  -0.924  -5.258
   84    HA   CYS  17           HA       CYS  17  -0.994  -1.453  -3.041
   85    HB2  CYS  17           HB3      CYS  17  -1.821  -0.222  -4.968
   86    HB3  CYS  17           HB2      CYS  17  -1.584  -1.634  -5.992
   87    H    THR  18           H        THR  18  -1.076  -3.253  -2.038
   88    HA   THR  18           HA       THR  18  -0.970  -5.790  -3.525
   89    HB   THR  18           HB       THR  18  -0.345  -5.432  -0.578
   90    HG1  THR  18           HG1      THR  18   1.445  -4.537  -1.323
   91   HG21  THR  18          HG21      THR  18  -0.067  -7.686  -2.548
   92   HG22  THR  18          HG22      THR  18  -0.868  -7.685  -0.977
   93   HG23  THR  18          HG23      THR  18   0.892  -7.635  -1.069
   94    H    TRP  19           H        TRP  19  -3.202  -4.969  -3.867
   95    HA   TRP  19           HA       TRP  19  -5.238  -4.391  -2.371
   96    HB2  TRP  19           HB3      TRP  19  -5.078  -5.440  -4.838
   97    HB3  TRP  19           HB2      TRP  19  -5.857  -6.782  -4.006
   98    HD1  TRP  19           HD1      TRP  19  -6.539  -3.351  -5.402
   99    HE1  TRP  19           HE1      TRP  19  -9.028  -2.764  -5.086
  100    HE3  TRP  19           HE3      TRP  19  -7.879  -7.174  -2.289
  101    HZ2  TRP  19           HZ2      TRP  19 -11.259  -3.793  -3.693
  102    HZ3  TRP  19           HZ3      TRP  19 -10.198  -7.295  -1.497
  103    HH2  TRP  19           HH2      TRP  19 -11.859  -5.641  -2.189
  104    HA   PRO  20           HA       PRO  20  -6.676  -4.137  -1.438
  105    HB2  PRO  20           HB2      PRO  20  -8.149  -3.959   0.754
  106    HB3  PRO  20           HB3      PRO  20  -8.595  -5.078  -0.538
  107    HG2  PRO  20           HG3      PRO  20  -7.376  -5.641   2.114
  108    HG3  PRO  20           HG2      PRO  20  -8.477  -6.636   1.147
  109    HD2  PRO  20           HD3      PRO  20  -5.634  -6.835   1.299
  110    HD3  PRO  20           HD2      PRO  20  -6.726  -7.749   0.241
  111    H    ILE  21           H        ILE  21  -3.944  -4.589  -0.092
  112    HA   ILE  21           HA       ILE  21  -4.037  -2.115   1.474
  113    HB   ILE  21           HB       ILE  21  -2.509  -3.045   3.167
  114   HG12  ILE  21          HG13      ILE  21  -3.089  -5.722   1.874
  115   HG13  ILE  21          HG12      ILE  21  -1.559  -4.859   1.747
  116   HG21  ILE  21          HG21      ILE  21  -5.190  -4.352   2.781
  117   HG22  ILE  21          HG22      ILE  21  -4.763  -2.994   3.825
  118   HG23  ILE  21          HG23      ILE  21  -4.213  -4.621   4.227
  119   HD11  ILE  21          HD11      ILE  21  -1.552  -4.950   4.318
  120   HD12  ILE  21          HD12      ILE  21  -1.171  -6.415   3.413
  121   HD13  ILE  21          HD13      ILE  21  -2.773  -6.208   4.121
  122    H    CYS  22           H        CYS  22  -2.420  -0.751   1.098
  123    HA   CYS  22           HA       CYS  22  -0.458  -1.470  -0.919
  124    HB2  CYS  22           HB3      CYS  22  -1.701   0.752  -0.791
  125    HB3  CYS  22           HB2      CYS  22  -0.604   1.165   0.515
  126    H    THR  23           H        THR  23   1.654  -1.649  -0.635
  127    HA   THR  23           HA       THR  23   2.868  -1.264   1.996
  128    HB   THR  23           HB       THR  23   3.893  -3.620   1.741
  129    HG1  THR  23           HG1      THR  23   2.259  -5.039   0.663
  130   HG21  THR  23          HG21      THR  23   1.622  -4.656   2.612
  131   HG22  THR  23          HG22      THR  23   1.135  -2.962   2.651
  132   HG23  THR  23          HG23      THR  23   2.533  -3.499   3.584
  133    H    ARG  24           H        ARG  24   5.011  -0.682   1.849
  134    HA   ARG  24           HA       ARG  24   6.143  -0.580  -0.837
  135    HB2  ARG  24           HB3      ARG  24   7.785   0.946   0.078
  136    HB3  ARG  24           HB2      ARG  24   6.178   1.498   0.497
  137    HG2  ARG  24           HG3      ARG  24   6.512   1.203   2.712
  138    HG3  ARG  24           HG2      ARG  24   7.559  -0.200   2.481
  139    HD2  ARG  24           HD3      ARG  24   8.309   2.685   2.007
  140    HD3  ARG  24           HD2      ARG  24   8.829   1.683   3.363
  141    HE   ARG  24           HE       ARG  24   9.531   0.407   0.943
  142   HH11  ARG  24          HH11      ARG  24  10.446   3.203   2.853
  143   HH12  ARG  24          HH12      ARG  24  12.079   3.207   2.283
  144   HH21  ARG  24          HH22      ARG  24  11.639   0.396   0.194
  145   HH22  ARG  24          HH21      ARG  24  12.770   1.594   0.755
  146    H    ASP  25           H        ASP  25   7.652  -1.979  -1.463
  147    HA   ASP  25           HA       ASP  25   9.123  -3.723  -1.443
  148    HB2  ASP  25           HB3      ASP  25   9.873  -2.763   1.335
  149    HB3  ASP  25           HB2      ASP  25  10.852  -3.754   0.264
  150    H    GLY  26           H        GLY  26   6.402  -3.972  -0.352
  151    HA2  GLY  26           HA3      GLY  26   5.149  -5.765   0.395
  152    HA3  GLY  26           HA2      GLY  26   6.644  -6.620   0.746
  153    H    LEU  27           H        LEU  27   6.671  -3.545   2.106
  154    HA   LEU  27           HA       LEU  27   5.964  -4.669   4.729
  155    HB2  LEU  27           HB3      LEU  27   7.718  -2.304   4.058
  156    HB3  LEU  27           HB2      LEU  27   7.379  -2.890   5.675
  157    HG   LEU  27           HG       LEU  27   8.849  -4.440   3.540
  158   HD11  LEU  27          HD11      LEU  27  10.738  -3.502   4.229
  159   HD12  LEU  27          HD12      LEU  27  10.339  -3.800   5.921
  160   HD13  LEU  27          HD13      LEU  27   9.761  -2.337   5.123
  161   HD21  LEU  27          HD21      LEU  27   9.457  -5.799   5.662
  162   HD22  LEU  27          HD22      LEU  27   7.897  -6.067   4.884
  163   HD23  LEU  27          HD23      LEU  27   7.998  -5.072   6.338
  164    HA   PRO  28           HA       PRO  28   2.511  -1.873   4.739
  165    HB2  PRO  28           HB2      PRO  28   1.640  -2.401   7.232
  166    HB3  PRO  28           HB3      PRO  28   1.457  -3.559   5.910
  167    HG2  PRO  28           HG3      PRO  28   3.483  -3.494   8.108
  168    HG3  PRO  28           HG2      PRO  28   2.614  -4.881   7.426
  169    HD2  PRO  28           HD3      PRO  28   5.187  -4.215   6.761
  170    HD3  PRO  28           HD2      PRO  28   4.087  -5.105   5.690
  171    H    VAL  29           H        VAL  29   4.533  -0.281   4.790
  172    HA   VAL  29           HA       VAL  29   4.847   1.028   7.345
  173    HB   VAL  29           HB       VAL  29   5.975   1.807   4.653
  174   HG11  VAL  29          HG11      VAL  29   5.783   3.433   6.782
  175   HG12  VAL  29          HG12      VAL  29   7.121   3.491   5.634
  176   HG13  VAL  29          HG13      VAL  29   7.305   2.625   7.158
  177   HG21  VAL  29          HG21      VAL  29   6.963  -0.010   6.809
  178   HG22  VAL  29          HG22      VAL  29   8.115   0.891   5.824
  179   HG23  VAL  29          HG23      VAL  29   6.986  -0.227   5.058