*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   05-FEB-03   1NWB              
*TITLE     SOLUTION STRUCTURE OF THE HYPOTHETICAL PROTEIN AQ_1857 FROM           
*TITLE    2 AQUIFEX AEOLICUS: NORTHEAST STRUCTURAL GENOMICS CONSORTIUM           
*TITLE    3 TARGET QR6                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN AQ_1857;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS;                               
*SOURCE   3 GENE: AQ_1857;                                                       
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21                                     
*KEYWDS    QR6, STRUCTURAL GENOMICS, REDUCED DIMENSIONALITY NMR                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    D.XU, G.LIU, R.XIAO, T.ACTON, G.T.MONTELIONE, T.SZYPERSKI             
*REVDAT   1   03-JUN-03 1NWB    0                                              

  1 MET  HA      2 GLN  HN      2.98   # peak      2
  2 GLN  HN      2 GLN  HA      4.02   # peak      8
  2 GLN  HN      2 GLN  HB2     5.35   # peak      9
  2 GLN  HN      3 GLU- HN      5.96   # peak     13
  2 GLN  HA      3 GLU- HN      3.12   # peak     15
  2 GLN  HB2     3 GLU- HN      5.57   # peak     16
  2 GLN  HB3     3 GLU- HN      5.71   # peak     17
  2 GLN  HG3     3 GLU- HN      6.00   # peak     19
  3 GLU- HN      3 GLU- HA      4.13   # peak     21
  3 GLU- HN      3 GLU- HB2     3.73   # peak     22
  3 GLU- HN      3 GLU- HB3     4.16   # peak     23
  3 GLU- HN      3 GLU- QG      6.88   # peak   1295
  3 GLU- HN      4 GLN  HN      4.96   # peak     26
  3 GLU- HA      4 GLN  HN      3.01   # peak     28
  3 GLU- HB2     4 GLN  HN      4.56   # peak     29
  3 GLU- HB3     4 GLN  HN      4.96   # peak     30
  4 GLN  HN      4 GLN  HA      3.98   # peak     34
  4 GLN  HN      4 GLN  HB2     4.27   # peak     35
  4 GLN  HN      4 GLN  HB3     4.27   # peak     36
  4 GLN  HN      4 GLN  QG      6.88   # peak   1298
  4 GLN  HN      5 ALA  HN      4.49   # peak     39
  4 GLN  HA      5 ALA  HN      2.76   # peak     41
  4 GLN  HB2     5 ALA  HN      5.46   # peak     42
  4 GLN  HB3     5 ALA  HN      4.60   # peak     43
  4 GLN  HB3    60 ASP- HN      5.60   # peak   1710
  4 GLN  QG      5 ALA  HN      6.88   # peak   1299
  5 ALA  HN      5 ALA  HA      4.34   # peak     47
  5 ALA  HN      5 ALA  QB      3.79   # peak     48
  5 ALA  HN      6 GLN  HN      4.56   # peak     49
  5 ALA  HA      6 GLN  HN      2.69   # peak     51
  5 ALA  QB      6 GLN  HN      4.83   # peak     52
  6 GLN  HN      6 GLN  HA      3.52   # peak     54
  6 GLN  HN      6 GLN  QB      4.25   # peak   1309
  6 GLN  HN      6 GLN  QG      5.44   # peak   1300
  6 GLN  HN      7 GLN  HN      3.98   # peak     59
  6 GLN  HA      7 GLN  HN      2.72   # peak     61
  6 GLN  QB      7 GLN  HN      4.64   # peak     62
  6 GLN  QG      7 GLN  HN      6.88   # peak   1301
  7 GLN  HN      7 GLN  HA      4.06   # peak     67
  7 GLN  HN      7 GLN  QB      4.32   # peak   1311
  7 GLN  HN      7 GLN  HG2     4.34   # peak     70
  7 GLN  HN      7 GLN  HG3     5.14   # peak     71
  7 GLN  HN      8 PHE  HN      4.02   # peak     72
  7 GLN  HA      8 PHE  HN      2.76   # peak     74
  7 GLN  QB      8 PHE  HN      4.86   # peak   1310
  7 GLN  HG2     8 PHE  HN      5.46   # peak     77
  7 GLN  HG3     8 PHE  HN      5.28   # peak     78
  7 GLN  HG3     9 ILE  HN      6.00   # peak   1719
  8 PHE  HN      8 PHE  HA      3.66   # peak   1730
  8 PHE  HN      8 PHE  QB      4.93   # peak   1313
  8 PHE  HN      9 ILE  HN      4.74   # peak     86
  8 PHE  HA      9 ILE  HN      2.94   # peak     88
  8 PHE  QB      9 ILE  HN      5.29   # peak   1312
  9 ILE  HN      9 ILE  HA      3.95   # peak     95
  9 ILE  HN      9 ILE  HB      3.44   # peak     96
  9 ILE  HN      9 ILE  QG2     5.37   # peak     97
  9 ILE  HN      9 ILE  HG12    6.00   # peak     98
  9 ILE  HN      9 ILE  HG13    4.56   # peak     99
  9 ILE  HN      9 ILE  QD1     5.19   # peak    100
  9 ILE  HN     10 PHE  HN      6.00   # peak    102
  9 ILE  HN     77 MET  QE      5.77   # peak   1171
  9 ILE  HN     81 ASN  HA      5.32   # peak   1202
  9 ILE  HN     82 GLY  HN      4.60   # peak   1398
  9 ILE  HA     10 PHE  HN      3.01   # peak    103
  9 ILE  HB     10 PHE  HN      5.10   # peak    104
  9 ILE  HB     82 GLY  HN      4.45   # peak   1196
  9 ILE  QG2    10 PHE  HN      5.55   # peak    105
  9 ILE  QG2    11 LYS+ HN      7.03   # peak   1401
  9 ILE  QG2    83 ALA  HN      6.34   # peak   1577
  9 ILE  HG12   10 PHE  HN      6.00   # peak    106
  9 ILE  QD1    10 PHE  HN      5.05   # peak    108
  9 ILE  QD1    82 GLY  HN      7.03   # peak   1575
 10 PHE  HN     10 PHE  HA      4.06   # peak    110
 10 PHE  HN     10 PHE  HB2     4.09   # peak    111
 10 PHE  HN     10 PHE  HB3     4.96   # peak    112
 10 PHE  HN     11 LYS+ HN      6.00   # peak    116
 10 PHE  HA     11 LYS+ HN      3.12   # peak    118
 10 PHE  HA     83 ALA  HN      6.00   # peak   1580
 10 PHE  HB2    11 LYS+ HN      4.56   # peak    119
 10 PHE  HB3    11 LYS+ HN      5.64   # peak    120
 10 PHE  QD     83 ALA  HN      8.12   # peak   1583
 10 PHE  QE     83 ALA  HN      8.12   # peak   1584
 11 LYS+ HN     11 LYS+ HA      3.95   # peak    125
 11 LYS+ HN     11 LYS+ HB2     4.06   # peak    127
 11 LYS+ HN     11 LYS+ HB3     4.16   # peak    126
 11 LYS+ HN     11 LYS+ HG2     4.24   # peak    128
 11 LYS+ HN     11 LYS+ HG3     4.88   # peak    129
 11 LYS+ HN     12 VAL  HN      5.60   # peak    134
 11 LYS+ HN     83 ALA  HN      6.00   # peak   1581
 11 LYS+ HN     84 GLU- HA      4.42   # peak   1203
 11 LYS+ HN     85 LEU  HN      4.60   # peak   1403
 11 LYS+ HA     12 VAL  HN      2.72   # peak    136
 11 LYS+ HB2    12 VAL  HN      4.42   # peak    138
 11 LYS+ HB3    12 VAL  HN      3.73   # peak    137
 11 LYS+ HG2    12 VAL  HN      6.00   # peak    139
 11 LYS+ HG3    12 VAL  HN      5.96   # peak    140
 11 LYS+ QE     12 VAL  HN      6.34   # peak   1317
 12 VAL  HN     12 VAL  HA      3.73   # peak    146
 12 VAL  HN     12 VAL  HB      3.59   # peak    147
 12 VAL  HN     12 VAL  QG1     4.40   # peak    149
 12 VAL  HN     12 VAL  QG2     4.54   # peak    148
 12 VAL  HN     13 THR  HN      4.52   # peak    150
 12 VAL  HA     13 THR  HN      2.83   # peak    152
 12 VAL  HA     85 LEU  HN      3.73   # peak   1230
 12 VAL  HB     13 THR  HN      4.52   # peak    153
 12 VAL  QG1    13 THR  HN      4.29   # peak    155
 12 VAL  QG2    13 THR  HN      5.95   # peak    154
 12 VAL  QG2    16 ALA  HN      5.59   # peak   1421
 12 VAL  QG2    17 VAL  HN      4.80   # peak   1269
 12 VAL  QG2    85 LEU  HN      5.62   # peak   1280
 13 THR  HN     13 THR  HA      3.73   # peak    157
 13 THR  HN     13 THR  HB      4.88   # peak    158
 13 THR  HN     13 THR  QG2     3.61   # peak    159
 13 THR  HN     13 THR  HG1     4.67   # peak   1206
 13 THR  HN     14 ASP- HN      4.85   # peak    160
 13 THR  HN     16 ALA  QB      4.26   # peak   1172
 13 THR  HN     85 LEU  HN      4.24   # peak   1244
 13 THR  HN     85 LEU  HB3     6.00   # peak   1412
 13 THR  HN     86 ASP- HA      4.06   # peak   1205
 13 THR  HA     14 ASP- HN      2.90   # peak    162
 13 THR  HA     15 LYS+ HN      4.85   # peak   1731
 13 THR  HB     14 ASP- HN      3.34   # peak    163
 13 THR  HB     15 LYS+ HN      3.66   # peak   1207
 13 THR  QG2    14 ASP- HN      5.37   # peak    164
 13 THR  QG2    15 LYS+ HN      5.88   # peak   1173
 13 THR  QG2    16 ALA  HN      5.41   # peak   1176
 13 THR  QG2    86 ASP- HN      6.88   # peak   1594
 13 THR  QG2    87 TYR  HN      7.03   # peak   1198
 13 THR  HG1    14 ASP- HN      6.00   # peak   1418
 13 THR  HG1    15 LYS+ HN      4.74   # peak   1208
 13 THR  HG1    16 ALA  HN      3.48   # peak   1209
 13 THR  HG1    87 TYR  HN      3.59   # peak   1231
 14 ASP- HN     14 ASP- HA      3.55   # peak    166
 14 ASP- HN     14 ASP- HB2     3.37   # peak    167
 14 ASP- HN     14 ASP- HB3     3.70   # peak    168
 14 ASP- HN     15 LYS+ HN      3.26   # peak    169
 14 ASP- HN     16 ALA  HN      4.31   # peak   1245
 14 ASP- HA     15 LYS+ HN      3.66   # peak    171
 14 ASP- HA     17 VAL  HN      4.24   # peak   1210
 14 ASP- HA     18 GLU- HN      4.92   # peak   1212
 14 ASP- HB2    15 LYS+ HN      3.41   # peak    172
 14 ASP- HB3    15 LYS+ HN      3.80   # peak    173
 15 LYS+ HN     15 LYS+ HA      3.19   # peak    175
 15 LYS+ HN     15 LYS+ HB2     3.26   # peak    176
 15 LYS+ HN     15 LYS+ HB3     3.01   # peak    177
 15 LYS+ HN     15 LYS+ HG2     4.42   # peak    178
 15 LYS+ HN     15 LYS+ HG3     4.63   # peak    179
 15 LYS+ HN     16 ALA  HN      3.05   # peak    184
 15 LYS+ HN     16 ALA  QB      5.55   # peak   1174
 15 LYS+ HN     87 TYR  HN      5.35   # peak   1264
 15 LYS+ HA     16 ALA  HN      4.49   # peak    186
 15 LYS+ HA     18 GLU- HN      4.09   # peak   1211
 15 LYS+ HB2    16 ALA  HN      3.77   # peak    187
 15 LYS+ HB3    16 ALA  HN      3.95   # peak    188
 15 LYS+ HG2    16 ALA  HN      5.86   # peak    189
 15 LYS+ HG3    16 ALA  HN      6.00   # peak    190
 15 LYS+ HD2    16 ALA  HN      6.00   # peak    191
 15 LYS+ HD3    16 ALA  HN      6.00   # peak    192
 16 ALA  HN     16 ALA  HA      3.52   # peak    196
 16 ALA  HN     16 ALA  QB      3.68   # peak    197
 16 ALA  HN     17 VAL  HN      3.19   # peak    198
 16 ALA  HN     17 VAL  QG2     7.03   # peak   1420
 16 ALA  HN     18 GLU- HN      5.42   # peak   1246
 16 ALA  HN     20 ILE  QD1     7.03   # peak   1434
 16 ALA  HN     86 ASP- HA      4.70   # peak   1423
 16 ALA  HN     87 TYR  HN      4.63   # peak   1283
 16 ALA  HN     87 TYR  HB3     3.91   # peak   1175
 16 ALA  HA     17 VAL  HN      6.00   # peak    200
 16 ALA  QB     17 VAL  HN      4.76   # peak    201
 16 ALA  QB     87 TYR  HN      4.98   # peak   1596
 17 VAL  HN     17 VAL  HA      3.77   # peak    203
 17 VAL  HN     17 VAL  HB      3.08   # peak    204
 17 VAL  HN     17 VAL  QG1     4.94   # peak    206
 17 VAL  HN     17 VAL  QG2     4.00   # peak    205
 17 VAL  HN     18 GLU- HN      3.16   # peak    207
 17 VAL  HN     19 GLU- HN      4.70   # peak   1426
 17 VAL  HA     18 GLU- HN      4.24   # peak    209
 17 VAL  HA     20 ILE  HN      4.60   # peak   1431
 17 VAL  HB     18 GLU- HN      3.19   # peak    210
 17 VAL  QG1    18 GLU- HN      4.65   # peak    212
 17 VAL  QG1    66 ASP- HN      5.23   # peak   1193
 17 VAL  QG2    18 GLU- HN      4.87   # peak    211
 17 VAL  QG2    66 ASP- HN      6.34   # peak   1293
 18 GLU- HN     18 GLU- HA      3.23   # peak    214
 18 GLU- HN     18 GLU- QB      3.82   # peak   1319
 18 GLU- HN     18 GLU- QG      5.11   # peak   1320
 18 GLU- HN     19 GLU- HN      3.26   # peak    219
 18 GLU- HA     19 GLU- HN      4.20   # peak    221
 18 GLU- HA     22 LYS+ HN      4.99   # peak   1422
 18 GLU- QB     19 GLU- HN      4.43   # peak    223
 19 GLU- HN     19 GLU- HA      3.62   # peak    227
 19 GLU- HN     19 GLU- HB2     3.26   # peak   1270
 19 GLU- HN     19 GLU- HB3     3.41   # peak   1177
 19 GLU- HN     19 GLU- HG2     4.63   # peak   1271
 19 GLU- HN     19 GLU- HG3     4.16   # peak   1178
 19 GLU- HN     20 ILE  HN      3.34   # peak    232
 19 GLU- HA     20 ILE  HN      4.52   # peak    234
 19 GLU- HA     22 LYS+ HN      3.55   # peak   1289
 19 GLU- HB2    20 ILE  HN      4.52   # peak   1430
 19 GLU- HB3    20 ILE  HN      4.20   # peak   1285
 19 GLU- HG2    20 ILE  HN      5.14   # peak    237
 19 GLU- HG2    50 MET  HN      6.00   # peak   1700
 20 ILE  HN     20 ILE  HA      3.77   # peak    240
 20 ILE  HN     20 ILE  HB      3.08   # peak    241
 20 ILE  HN     20 ILE  QG2     5.41   # peak    242
 20 ILE  HN     20 ILE  QD1     4.26   # peak    245
 20 ILE  HN     21 LYS+ HN      3.41   # peak    246
 20 ILE  HN     22 LYS+ HN      4.60   # peak   1733
 20 ILE  HN     34 LEU  QD2     7.03   # peak   1427
 20 ILE  HA     21 LYS+ HN      4.63   # peak    248
 20 ILE  HA     23 VAL  HN      4.52   # peak   1446
 20 ILE  HB     21 LYS+ HN      3.52   # peak    249
 20 ILE  HB     34 LEU  HN      6.00   # peak   1465
 20 ILE  QG2    21 LYS+ HN      4.83   # peak    250
 20 ILE  QG2    24 ALA  HN      6.49   # peak   1437
 20 ILE  HG12   21 LYS+ HN      6.00   # peak    251
 20 ILE  QD1    21 LYS+ HN      5.62   # peak    253
 21 LYS+ HN     21 LYS+ HA      3.48   # peak    255
 21 LYS+ HN     21 LYS+ QB      4.28   # peak   1326
 21 LYS+ HN     21 LYS+ HG2     3.88   # peak   1332
 21 LYS+ HN     21 LYS+ HG3     3.98   # peak   1693
 21 LYS+ HN     21 LYS+ QD      4.97   # peak   1330
 21 LYS+ HN     22 LYS+ HN      3.19   # peak    264
 21 LYS+ HA     22 LYS+ HN      4.38   # peak    266
 21 LYS+ QB     22 LYS+ HN      6.88   # peak   1327
 21 LYS+ HG2    22 LYS+ HN      5.75   # peak   1333
 21 LYS+ HG3    22 LYS+ HN      6.00   # peak   1694
 21 LYS+ QD     22 LYS+ HN      6.77   # peak   1331
 22 LYS+ HN     22 LYS+ HA      3.26   # peak    276
 22 LYS+ HN     22 LYS+ QB      6.88   # peak   1329
 22 LYS+ HN     22 LYS+ HG2     3.91   # peak    279
 22 LYS+ HN     22 LYS+ HG3     4.42   # peak    280
 22 LYS+ HN     22 LYS+ QD      6.88   # peak   1337
 22 LYS+ HN     23 VAL  HN      3.19   # peak    285
 22 LYS+ HN     24 ALA  HN      5.46   # peak   1734
 22 LYS+ HA     23 VAL  HN      3.98   # peak    287
 22 LYS+ HA     25 GLN  HN      3.77   # peak   1290
 22 LYS+ QB     23 VAL  HN      4.90   # peak   1328
 22 LYS+ HG2    23 VAL  HN      4.92   # peak    290
 22 LYS+ HG3    23 VAL  HN      5.35   # peak    291
 22 LYS+ QD     23 VAL  HN      6.88   # peak   1336
 23 VAL  HN     23 VAL  HA      3.52   # peak    297
 23 VAL  HN     23 VAL  HB      3.12   # peak    298
 23 VAL  HN     23 VAL  QG1     4.87   # peak    299
 23 VAL  HN     23 VAL  QG2     3.64   # peak    300
 23 VAL  HN     24 ALA  HN      2.98   # peak    301
 23 VAL  HA     24 ALA  HN      4.09   # peak    303
 23 VAL  HA     25 GLN  HN      4.70   # peak   1444
 23 VAL  HA     26 GLU- HN      3.80   # peak   1291
 23 VAL  HA     27 ASN  HN      6.00   # peak   1450
 23 VAL  HB     24 ALA  HN      3.48   # peak    304
 23 VAL  QG1    24 ALA  HN      5.80   # peak    305
 23 VAL  QG1    51 GLY  HN      7.03   # peak   1702
 23 VAL  QG2    24 ALA  HN      5.44   # peak    306
 24 ALA  HN     24 ALA  HA      3.98   # peak    308
 24 ALA  HN     24 ALA  QB      3.79   # peak    309
 24 ALA  HN     25 GLN  HN      3.12   # peak    310
 24 ALA  HA     25 GLN  HN      6.00   # peak    312
 24 ALA  HA     27 ASN  HN      5.35   # peak   1448
 24 ALA  HA     29 ILE  HN      4.49   # peak   1181
 24 ALA  QB     25 GLN  HN      3.93   # peak    313
 24 ALA  QB     29 ILE  HN      5.01   # peak   1182
 25 GLN  HN     25 GLN  HA      3.23   # peak    315
 25 GLN  HN     25 GLN  QB      4.43   # peak   1338
 25 GLN  HN     25 GLN  HG2     3.77   # peak    318
 25 GLN  HN     25 GLN  HG3     4.34   # peak    319
 25 GLN  HN     26 GLU- HN      3.12   # peak    320
 25 GLN  HN     27 ASN  HN      4.52   # peak   1451
 25 GLN  HA     26 GLU- HN      3.48   # peak    322
 25 GLN  HA     28 ASN  HN      3.62   # peak   1214
 25 GLN  HA     29 ILE  HN      3.91   # peak   1215
 25 GLN  QB     26 GLU- HN      4.61   # peak   1339
 25 GLN  HG2    26 GLU- HN      4.67   # peak    325
 25 GLN  HG3    26 GLU- HN      5.75   # peak    326
 26 GLU- HN     26 GLU- HA      3.62   # peak    328
 26 GLU- HN     26 GLU- HB2     3.37   # peak    329
 26 GLU- HN     26 GLU- HB3     3.23   # peak    330
 26 GLU- HN     26 GLU- HG2     4.56   # peak    331
 26 GLU- HN     26 GLU- HG3     4.42   # peak    332
 26 GLU- HN     27 ASN  HN      3.08   # peak    333
 26 GLU- HN     28 ASN  HN      4.92   # peak   1247
 26 GLU- HA     27 ASN  HN      3.55   # peak    335
 26 GLU- HB2    27 ASN  HN      4.06   # peak    336
 26 GLU- HB3    27 ASN  HN      3.84   # peak    337
 26 GLU- HG2    27 ASN  HN      5.06   # peak    338
 26 GLU- HG3    27 ASN  HN      6.00   # peak    339
 27 ASN  HN     27 ASN  HA      3.77   # peak    341
 27 ASN  HN     27 ASN  HB2     3.52   # peak    342
 27 ASN  HN     27 ASN  HB3     3.62   # peak    343
 27 ASN  HN     27 ASN  HD21    3.77   # peak   1249
 27 ASN  HN     27 ASN  HD22    6.00   # peak   1725
 27 ASN  HN     28 ASN  HN      2.98   # peak    344
 27 ASN  HN     28 ASN  HA      6.00   # peak   1213
 27 ASN  HN     29 ILE  HN      4.06   # peak   1251
 27 ASN  HA     28 ASN  HN      4.85   # peak    346
 27 ASN  HB2    28 ASN  HN      6.00   # peak    347
 27 ASN  HD21   27 ASN  HD22    2.69   # peak   1726
 27 ASN  HD21   28 ASN  HN      5.57   # peak   1728
 28 ASN  HN     28 ASN  HA      2.62   # peak    350
 28 ASN  HN     28 ASN  HB2     3.84   # peak    351
 28 ASN  HN     28 ASN  HB3     3.95   # peak    352
 28 ASN  HN     29 ILE  HN      3.08   # peak    353
 28 ASN  HN     29 ILE  QG2     7.03   # peak   1454
 28 ASN  HA     29 ILE  HN      3.05   # peak    355
 28 ASN  HB2    29 ILE  HN      4.81   # peak    356
 28 ASN  HB3    29 ILE  HN      4.74   # peak    357
 29 ILE  HN     29 ILE  HA      3.59   # peak    359
 29 ILE  HN     29 ILE  HB      2.94   # peak    360
 29 ILE  HN     29 ILE  QG2     4.69   # peak    361
 29 ILE  HN     29 ILE  HG12    3.95   # peak    362
 29 ILE  HN     29 ILE  HG13    3.34   # peak    363
 29 ILE  HN     29 ILE  QD1     5.52   # peak    364
 29 ILE  HN     30 GLU- HN      4.52   # peak    365
 29 ILE  HA     30 GLU- HN      2.69   # peak    367
 29 ILE  HA     31 ASN  HN      5.17   # peak   1461
 29 ILE  HB     30 GLU- HN      4.85   # peak    368
 29 ILE  QG2    30 GLU- HN      4.29   # peak    369
 29 ILE  QG2    31 ASN  HN      5.08   # peak   1272
 29 ILE  QG2    33 ILE  HN      5.48   # peak   1273
 29 ILE  HG12   30 GLU- HN      5.03   # peak    370
 29 ILE  HG13   30 GLU- HN      6.00   # peak    371
 29 ILE  QD1    30 GLU- HN      6.13   # peak    372
 30 GLU- HN     30 GLU- HA      3.41   # peak    374
 30 GLU- HN     30 GLU- HB2     3.08   # peak    375
 30 GLU- HN     30 GLU- HB3     3.37   # peak    376
 30 GLU- HN     30 GLU- HG2     4.96   # peak    377
 30 GLU- HN     30 GLU- HG3     4.20   # peak    378
 30 GLU- HN     31 ASN  HN      3.41   # peak    379
 30 GLU- HA     31 ASN  HN      3.08   # peak    381
 30 GLU- HB2    31 ASN  HN      4.09   # peak    382
 30 GLU- HB3    31 ASN  HN      4.02   # peak    383
 30 GLU- HG2    31 ASN  HN      6.00   # peak    384
 30 GLU- HG3    31 ASN  HN      6.00   # peak    385
 31 ASN  HN     31 ASN  HA      3.23   # peak    387
 31 ASN  HN     31 ASN  HB2     3.59   # peak    388
 31 ASN  HN     31 ASN  HB3     3.73   # peak    389
 31 ASN  HN     32 PRO  HD2     4.20   # peak   1216
 31 ASN  HN     32 PRO  HD3     3.91   # peak   1183
 31 ASN  HA     69 LYS+ HN      5.21   # peak   1546
 32 PRO  HA     33 ILE  HN      2.87   # peak    390
 32 PRO  HB2    33 ILE  HN      4.85   # peak    391
 32 PRO  HB3    33 ILE  HN      4.20   # peak    392
 32 PRO  HG3    33 ILE  HN      6.00   # peak    394
 33 ILE  HN     33 ILE  HA      5.28   # peak    398
 33 ILE  HN     33 ILE  HB      3.55   # peak    399
 33 ILE  HN     33 ILE  QG2     5.26   # peak    400
 33 ILE  HN     33 ILE  HG12    6.00   # peak    401
 33 ILE  HN     33 ILE  HG13    4.96   # peak    402
 33 ILE  HN     33 ILE  QD1     5.66   # peak    403
 33 ILE  HN     34 LEU  HN      5.10   # peak    404
 33 ILE  HA     34 LEU  HN      3.16   # peak    406
 33 ILE  HA     69 LYS+ HN      4.16   # peak   1225
 33 ILE  HB     34 LEU  HN      5.14   # peak    407
 33 ILE  HB     53 ASP- HN      4.74   # peak   1187
 33 ILE  QG2    34 LEU  HN      4.58   # peak    408
 33 ILE  QG2    53 ASP- HN      6.85   # peak   1497
 33 ILE  QG2    69 LYS+ HN      7.03   # peak   1715
 33 ILE  QG2    71 VAL  HN      7.03   # peak   1555
 33 ILE  HG12   34 LEU  HN      6.00   # peak    409
 33 ILE  HG13   34 LEU  HN      6.00   # peak    410
 33 ILE  QD1    34 LEU  HN      7.03   # peak    411
 33 ILE  QD1    55 THR  HN      7.03   # peak   1705
 33 ILE  QD1    56 VAL  HN      6.56   # peak   1501
 33 ILE  QD1    69 LYS+ HN      6.31   # peak   1541
 34 LEU  HN     34 LEU  HA      4.78   # peak    413
 34 LEU  HN     34 LEU  HB2     3.80   # peak    414
 34 LEU  HN     34 LEU  HB3     3.41   # peak    415
 34 LEU  HN     34 LEU  HG      6.00   # peak    416
 34 LEU  HN     34 LEU  QD1     6.31   # peak    417
 34 LEU  HN     34 LEU  QD2     6.45   # peak    418
 34 LEU  HN     35 ARG+ HN      4.70   # peak    419
 34 LEU  HN     69 LYS+ HN      4.63   # peak   1257
 34 LEU  HN     69 LYS+ QD      6.88   # peak   1464
 34 LEU  HN     70 VAL  HN      5.71   # peak   1551
 34 LEU  HN     70 VAL  HA      3.70   # peak   1217
 34 LEU  HN     71 VAL  HN      4.85   # peak   1558
 34 LEU  HN     71 VAL  QG1     5.98   # peak   1692
 34 LEU  HA     35 ARG+ HN      3.12   # peak    421
 34 LEU  HA     53 ASP- HN      4.74   # peak   1221
 34 LEU  HB2    35 ARG+ HN      5.24   # peak    422
 34 LEU  HB3    35 ARG+ HN      4.88   # peak    423
 34 LEU  HG     35 ARG+ HN      6.00   # peak    424
 34 LEU  QD1    35 ARG+ HN      4.90   # peak    425
 34 LEU  QD1    51 GLY  HN      6.49   # peak   1275
 34 LEU  QD2    35 ARG+ HN      6.42   # peak    426
 35 ARG+ HN     35 ARG+ HA      4.88   # peak    428
 35 ARG+ HN     35 ARG+ HB2     5.24   # peak    429
 35 ARG+ HN     35 ARG+ HB3     3.70   # peak    430
 35 ARG+ HN     35 ARG+ HG2     6.00   # peak    431
 35 ARG+ HN     35 ARG+ HG3     6.00   # peak    432
 35 ARG+ HN     36 ILE  HN      4.52   # peak    436
 35 ARG+ HN     51 GLY  HN      4.06   # peak   1252
 35 ARG+ HN     52 PHE  HA      4.67   # peak   1218
 35 ARG+ HN     53 ASP- HN      4.96   # peak   1469
 35 ARG+ HA     36 ILE  HN      3.05   # peak    437
 35 ARG+ HA     71 VAL  HN      3.98   # peak   1718
 35 ARG+ HG2    36 ILE  HN      6.00   # peak    440
 36 ILE  HN     36 ILE  HA      4.85   # peak    445
 36 ILE  HN     36 ILE  HB      3.73   # peak    446
 36 ILE  HN     36 ILE  QG2     7.03   # peak    447
 36 ILE  HN     36 ILE  HG12    6.00   # peak    448
 36 ILE  HN     36 ILE  HG13    6.00   # peak    449
 36 ILE  HN     36 ILE  QD1     7.03   # peak    450
 36 ILE  HN     37 ARG+ HN      5.10   # peak    451
 36 ILE  HN     71 VAL  QG2     5.01   # peak   1274
 36 ILE  HA     37 ARG+ HN      2.94   # peak    453
 36 ILE  HB     37 ARG+ HN      5.82   # peak    454
 36 ILE  QG2    37 ARG+ HN      4.44   # peak    455
 36 ILE  HG12   37 ARG+ HN      6.00   # peak    456
 36 ILE  QD1    37 ARG+ HN      6.81   # peak    458
 36 ILE  QD1    51 GLY  HN      7.03   # peak   1703
 37 ARG+ HN     37 ARG+ HA      4.56   # peak    460
 37 ARG+ HN     37 ARG+ QB      4.75   # peak   1342
 37 ARG+ HN     37 ARG+ QG      6.88   # peak   1341
 37 ARG+ HN     50 MET  HA      4.81   # peak   1480
 38 VAL  HA     39 VAL  HN      3.23   # peak   1654
 38 VAL  HA     49 ALA  HN      5.24   # peak   1699
 38 VAL  QG1    39 VAL  HN      5.16   # peak   1658
 38 VAL  QG2    77 MET  HN      6.70   # peak   1565
 38 VAL  QG2    79 TYR  HN      6.24   # peak   1569
 39 VAL  HN     39 VAL  HB      3.80   # peak   1655
 39 VAL  HN     39 VAL  QG1     6.38   # peak   1656
 39 VAL  HN     39 VAL  QG2     5.16   # peak   1657
 39 VAL  QG1    47 GLN  HN      7.03   # peak   1490
 39 VAL  QG1    49 ALA  HN      7.03   # peak   1492
 40 PRO  HA     41 GLY  HN      3.52   # peak    467
 40 PRO  HB2    41 GLY  HN      5.64   # peak    468
 40 PRO  HB3    41 GLY  HN      5.24   # peak    469
 40 PRO  HG3    41 GLY  HN      6.00   # peak    471
 41 GLY  HN     41 GLY  HA1     4.20   # peak    475
 41 GLY  HN     41 GLY  HA2     4.16   # peak    476
 41 GLY  HN     42 GLY  HN      5.10   # peak    478
 41 GLY  HN     46 PHE  HA      5.39   # peak   1485
 41 GLY  HN     47 GLN  HN      5.53   # peak   1491
 41 GLY  HA1    42 GLY  HN      5.60   # peak    479
 41 GLY  HA2    42 GLY  HN      6.00   # peak    480
 42 GLY  HN     42 GLY  HA1     5.06   # peak    482
 42 GLY  HN     42 GLY  HA2     6.00   # peak    483
 43 CYS  HA     44 SER  HN      5.93   # peak    484
 43 CYS  QB     44 SER  HN      6.73   # peak    485
 44 SER  HN     44 SER  HA      4.88   # peak    488
 44 SER  HN     44 SER  HB2     6.00   # peak    489
 44 SER  HN     44 SER  HB3     5.82   # peak    490
 44 SER  HN     45 GLY  HN      5.57   # peak    491
 44 SER  HA     45 GLY  HN      4.42   # peak    493
 45 GLY  HN     45 GLY  HA1     3.84   # peak    497
 45 GLY  HN     45 GLY  HA2     3.37   # peak    498
 45 GLY  HA1    46 PHE  HN      3.52   # peak    501
 45 GLY  HA2    46 PHE  HN      3.91   # peak    502
 45 GLY  HA2    47 GLN  HN      5.28   # peak   1489
 46 PHE  HN     46 PHE  HA      5.68   # peak    504
 46 PHE  HN     46 PHE  HB3     4.20   # peak    506
 46 PHE  HN     47 GLN  HN      4.38   # peak    510
 46 PHE  HA     47 GLN  HN      3.55   # peak    512
 46 PHE  HB2    47 GLN  HN      5.42   # peak    513
 46 PHE  HB3    47 GLN  HN      6.00   # peak    514
 47 GLN  HN     47 GLN  HA      5.14   # peak    519
 47 GLN  HN     47 GLN  HB2     4.34   # peak    520
 47 GLN  HN     47 GLN  HB3     4.78   # peak    521
 47 GLN  HN     47 GLN  QG      6.88   # peak   1344
 48 TYR  HA     49 ALA  HN      3.48   # peak    524
 48 TYR  HB2    49 ALA  HN      6.00   # peak   1698
 48 TYR  HB3    49 ALA  HN      4.56   # peak    526
 48 TYR  QD     79 TYR  HN      8.14   # peak   1571
 49 ALA  HN     49 ALA  QB      5.70   # peak    531
 49 ALA  HN     50 MET  HN      5.57   # peak    532
 49 ALA  HA     50 MET  HN      3.37   # peak    534
 49 ALA  QB     50 MET  HN      6.02   # peak    535
 50 MET  HN     50 MET  HA      5.93   # peak    537
 50 MET  HN     50 MET  HB2     6.00   # peak    538
 50 MET  HN     50 MET  HB3     5.46   # peak    539
 50 MET  HN     50 MET  HG2     6.00   # peak    540
 50 MET  HN     50 MET  HG3     6.00   # peak    541
 50 MET  HA     51 GLY  HN      3.26   # peak    544
 50 MET  HB2    51 GLY  HN      4.52   # peak    545
 50 MET  HB3    51 GLY  HN      4.99   # peak    546
 50 MET  HG3    51 GLY  HN      6.00   # peak    548
 51 GLY  HN     51 GLY  HA1     4.31   # peak    550
 51 GLY  HN     51 GLY  HA2     4.38   # peak    551
 51 GLY  HN     52 PHE  HN      5.57   # peak    553
 51 GLY  HA1    52 PHE  HN      3.62   # peak    554
 51 GLY  HA2    52 PHE  HN      3.73   # peak    555
 52 PHE  HN     52 PHE  HA      4.99   # peak    557
 52 PHE  HN     52 PHE  HB2     4.13   # peak    558
 52 PHE  HN     52 PHE  HB3     4.63   # peak    559
 52 PHE  HN     53 ASP- HN      5.32   # peak    563
 52 PHE  HA     53 ASP- HN      3.01   # peak    565
 52 PHE  HB2    53 ASP- HN      4.60   # peak    566
 52 PHE  HB3    53 ASP- HN      3.98   # peak    567
 53 ASP- HN     53 ASP- HA      4.56   # peak    572
 53 ASP- HN     53 ASP- HB2     4.06   # peak    573
 53 ASP- HN     53 ASP- HB3     4.02   # peak    574
 53 ASP- HA     54 ASP- HN      3.23   # peak    577
 53 ASP- HB2    54 ASP- HN      5.53   # peak    578
 53 ASP- HB3    54 ASP- HN      5.46   # peak    579
 54 ASP- HN     54 ASP- HA      4.06   # peak    581
 54 ASP- HN     54 ASP- HB2     4.38   # peak    582
 54 ASP- HN     54 ASP- HB3     4.24   # peak    583
 54 ASP- HN     55 THR  HN      3.16   # peak    584
 54 ASP- HA     55 THR  HN      5.10   # peak    586
 54 ASP- HB2    55 THR  HN      6.00   # peak    587
 54 ASP- HB3    55 THR  HN      5.53   # peak    588
 55 THR  HN     55 THR  HA      4.20   # peak    590
 55 THR  HN     55 THR  HB      3.73   # peak    591
 55 THR  HN     55 THR  QG2     7.03   # peak    592
 55 THR  HN     56 VAL  HN      4.81   # peak    594
 55 THR  HA     56 VAL  HN      2.62   # peak    595
 55 THR  HB     56 VAL  HN      4.02   # peak    596
 55 THR  QG2    56 VAL  HN      4.47   # peak    597
 55 THR  QG2    57 GLU- HN      7.03   # peak   1503
 56 VAL  HN     56 VAL  HA      3.77   # peak    599
 56 VAL  HN     56 VAL  HB      3.05   # peak    600
 56 VAL  HN     56 VAL  QG1     4.83   # peak    602
 56 VAL  HN     56 VAL  QG2     4.29   # peak    601
 56 VAL  HN     57 GLU- HN      4.81   # peak    603
 56 VAL  HA     57 GLU- HN      2.76   # peak    605
 56 VAL  HB     57 GLU- HN      4.13   # peak    606
 56 VAL  QG1    57 GLU- HN      4.36   # peak    608
 56 VAL  QG1    60 ASP- HN      5.41   # peak   1276
 56 VAL  QG2    57 GLU- HN      4.51   # peak    607
 56 VAL  QG2    60 ASP- HN      6.13   # peak   1709
 57 GLU- HN     57 GLU- HA      3.77   # peak    610
 57 GLU- HN     57 GLU- HB2     3.34   # peak    612
 57 GLU- HN     57 GLU- HB3     3.88   # peak    611
 57 GLU- HN     57 GLU- HG2     4.27   # peak    613
 57 GLU- HN     57 GLU- HG3     3.70   # peak    614
 57 GLU- HN     58 GLU- HN      4.78   # peak    615
 57 GLU- HN     60 ASP- HN      5.93   # peak   1504
 57 GLU- HN     60 ASP- HB2     4.60   # peak   1189
 57 GLU- HN     60 ASP- HB3     4.81   # peak   1188
 57 GLU- HA     58 GLU- HN      2.76   # peak    617
 57 GLU- HB2    58 GLU- HN      3.70   # peak    619
 57 GLU- HB2    60 ASP- HN      4.85   # peak   1191
 57 GLU- HB3    58 GLU- HN      3.73   # peak    618
 57 GLU- HB3    60 ASP- HN      5.17   # peak   1708
 57 GLU- HG2    58 GLU- HN      4.42   # peak    620
 57 GLU- HG3    58 GLU- HN      5.75   # peak    621
 58 GLU- HN     58 GLU- HA      3.26   # peak    623
 58 GLU- HN     58 GLU- HB2     3.05   # peak   1346
 58 GLU- HN     58 GLU- HB3     3.16   # peak   1509
 58 GLU- HN     58 GLU- QG      5.36   # peak   1348
 58 GLU- HN     59 GLY  HN      4.70   # peak    628
 58 GLU- HA     59 GLY  HN      3.12   # peak    630
 58 GLU- HB2    59 GLY  HN      4.67   # peak   1345
 58 GLU- HB3    59 GLY  HN      4.45   # peak   1513
 58 GLU- QG     59 GLY  HN      6.77   # peak   1347
 59 GLY  HN     59 GLY  HA1     3.44   # peak    636
 59 GLY  HN     59 GLY  HA2     3.52   # peak    637
 59 GLY  HN     60 ASP- HN      3.30   # peak    638
 59 GLY  HA1    60 ASP- HN      3.84   # peak    640
 59 GLY  HA2    60 ASP- HN      4.02   # peak    641
 60 ASP- HN     60 ASP- HA      3.70   # peak    643
 60 ASP- HN     60 ASP- HB2     3.01   # peak    645
 60 ASP- HN     60 ASP- HB3     3.66   # peak    644
 60 ASP- HN     61 HIS  HN      5.32   # peak    646
 60 ASP- HA     61 HIS  HN      3.34   # peak    648
 60 ASP- HB2    61 HIS  HN      5.50   # peak    650
 60 ASP- HB3    61 HIS  HN      4.24   # peak    649
 61 HIS  HN     61 HIS  HA      4.38   # peak    652
 61 HIS  HN     61 HIS  HB2     4.13   # peak    653
 61 HIS  HN     61 HIS  HB3     4.88   # peak    654
 61 HIS  HN     62 VAL  HN      6.00   # peak    657
 61 HIS  HN     71 VAL  QG2     6.85   # peak   1515
 61 HIS  HN     72 ILE  HN      3.91   # peak   1243
 61 HIS  HA     62 VAL  HN      2.98   # peak    659
 61 HIS  HB2    72 ILE  HN      6.00   # peak   1560
 61 HIS  HB3    62 VAL  HN      4.99   # peak    661
 62 VAL  HN     62 VAL  HA      4.67   # peak    665
 62 VAL  HN     62 VAL  HB      3.30   # peak    666
 62 VAL  HN     62 VAL  QG1     4.65   # peak    668
 62 VAL  HN     62 VAL  QG2     5.08   # peak    667
 62 VAL  HN     63 PHE  HN      5.64   # peak    669
 62 VAL  HN     71 VAL  QG1     6.96   # peak   1520
 62 VAL  HA     63 PHE  HN      3.16   # peak    671
 62 VAL  HB     63 PHE  HN      4.78   # peak    672
 62 VAL  QG1    63 PHE  HN      5.01   # peak    674
 62 VAL  QG1    64 GLU- HN      6.67   # peak   1712
 62 VAL  QG2    63 PHE  HN      5.23   # peak    673
 62 VAL  QG2    64 GLU- HN      6.70   # peak   1277
 63 PHE  HN     63 PHE  HA      4.13   # peak    676
 63 PHE  HN     63 PHE  HB2     4.09   # peak    677
 63 PHE  HN     63 PHE  HB3     4.49   # peak    678
 63 PHE  HN     64 GLU- HN      5.03   # peak    682
 63 PHE  HN     69 LYS+ HB3     6.00   # peak   1523
 63 PHE  HN     70 VAL  HN      3.70   # peak   1255
 63 PHE  HN     70 VAL  HB      5.82   # peak   1192
 63 PHE  HA     64 GLU- HN      2.87   # peak    684
 63 PHE  HB2    64 GLU- HN      6.00   # peak    685
 63 PHE  HB2    70 VAL  HN      6.00   # peak   1547
 63 PHE  HB3    64 GLU- HN      4.70   # peak    686
 64 GLU- HN     64 GLU- HA      3.73   # peak    691
 64 GLU- HN     64 GLU- HB2     4.09   # peak    692
 64 GLU- HN     64 GLU- HB3     4.42   # peak    693
 64 GLU- HN     64 GLU- HG2     5.17   # peak    694
 64 GLU- HN     64 GLU- HG3     4.96   # peak    695
 64 GLU- HN     65 TYR  HN      4.99   # peak    696
 64 GLU- HN     70 VAL  HN      5.46   # peak   1529
 64 GLU- HA     65 TYR  HN      2.83   # peak    698
 64 GLU- HA     70 VAL  HN      4.74   # peak   1226
 64 GLU- HB2    65 TYR  HN      4.27   # peak    699
 64 GLU- HB3    65 TYR  HN      3.80   # peak    700
 64 GLU- HG2    65 TYR  HN      6.00   # peak    701
 64 GLU- HG3    65 TYR  HN      5.28   # peak    702
 65 TYR  HN     65 TYR  HA      3.80   # peak    704
 65 TYR  HN     65 TYR  HB2     3.48   # peak    705
 65 TYR  HN     65 TYR  HB3     4.38   # peak    706
 65 TYR  HN     65 TYR  QD      8.14   # peak    707
 65 TYR  HN     67 GLY  HN      5.53   # peak   1532
 65 TYR  HN     68 VAL  HN      3.80   # peak   1253
 65 TYR  HN     69 LYS+ HA      4.16   # peak   1222
 65 TYR  HN     69 LYS+ HG2     6.00   # peak   1713
 65 TYR  HN     69 LYS+ HG3     6.00   # peak   1530
 65 TYR  HN     70 VAL  HN      5.06   # peak   1723
 65 TYR  HA     66 ASP- HN      3.01   # peak    711
 65 TYR  HB2    66 ASP- HN      3.70   # peak    712
 65 TYR  HB3    66 ASP- HN      3.30   # peak    713
 65 TYR  QD     66 ASP- HN      8.14   # peak    714
 66 ASP- HN     66 ASP- HA      2.94   # peak    717
 66 ASP- HN     66 ASP- HB2     3.16   # peak    718
 66 ASP- HN     66 ASP- HB3     3.26   # peak    719
 66 ASP- HN     67 GLY  HN      3.80   # peak    720
 66 ASP- HN     68 VAL  HN      4.31   # peak   1256
 66 ASP- HA     67 GLY  HN      3.12   # peak    722
 66 ASP- HB2    67 GLY  HN      5.17   # peak    723
 66 ASP- HB2    68 VAL  HN      5.60   # peak   1714
 66 ASP- HB3    67 GLY  HN      4.60   # peak    724
 66 ASP- HB3    68 VAL  HN      5.17   # peak   1540
 67 GLY  HN     67 GLY  HA1     2.90   # peak    726
 67 GLY  HN     67 GLY  HA2     3.23   # peak    727
 67 GLY  HN     68 VAL  HN      3.19   # peak    728
 67 GLY  HA1    68 VAL  HN      4.78   # peak    730
 67 GLY  HA2    68 VAL  HN      4.49   # peak    731
 68 VAL  HN     68 VAL  HA      3.59   # peak    733
 68 VAL  HN     68 VAL  HB      3.23   # peak    734
 68 VAL  HN     68 VAL  QG1     5.19   # peak    735
 68 VAL  HN     68 VAL  QG2     4.69   # peak    736
 68 VAL  HN     69 LYS+ HN      4.81   # peak    737
 68 VAL  HA     69 LYS+ HN      2.76   # peak    739
 68 VAL  HB     69 LYS+ HN      4.02   # peak    740
 68 VAL  QG1    69 LYS+ HN      4.47   # peak    741
 68 VAL  QG2    69 LYS+ HN      4.80   # peak    742
 69 LYS+ HN     69 LYS+ HA      3.77   # peak    744
 69 LYS+ HN     69 LYS+ HB2     3.30   # peak    746
 69 LYS+ HN     69 LYS+ HB3     4.09   # peak    745
 69 LYS+ HN     69 LYS+ HG2     6.00   # peak   1543
 69 LYS+ HN     69 LYS+ HG3     4.27   # peak    747
 69 LYS+ HN     69 LYS+ QD      6.88   # peak    750
 69 LYS+ HN     70 VAL  HN      4.63   # peak    753
 69 LYS+ HA     70 VAL  HN      2.90   # peak    755
 69 LYS+ HB2    70 VAL  HN      5.21   # peak    757
 69 LYS+ HB3    70 VAL  HN      4.42   # peak    756
 69 LYS+ HG2    70 VAL  HN      6.00   # peak   1695
 69 LYS+ HG3    70 VAL  HN      5.89   # peak    758
 69 LYS+ QD     70 VAL  HN      6.88   # peak    761
 70 VAL  HN     70 VAL  HA      4.02   # peak    765
 70 VAL  HN     70 VAL  HB      3.41   # peak    766
 70 VAL  HN     70 VAL  QG1     6.20   # peak    767
 70 VAL  HN     70 VAL  QG2     4.54   # peak    768
 70 VAL  HN     71 VAL  HN      6.00   # peak    769
 70 VAL  HA     71 VAL  HN      3.01   # peak    771
 70 VAL  QG1    71 VAL  HN      5.59   # peak    773
 70 VAL  QG2    71 VAL  HN      7.03   # peak    774
 71 VAL  HN     71 VAL  HA      4.38   # peak    776
 71 VAL  HN     71 VAL  HB      4.09   # peak    777
 71 VAL  HN     71 VAL  QG1     4.80   # peak    779
 71 VAL  HN     71 VAL  QG2     4.11   # peak    778
 71 VAL  HN     72 ILE  HN      5.68   # peak    780
 71 VAL  HA     72 ILE  HN      2.90   # peak    782
 71 VAL  HB     72 ILE  HN      3.95   # peak    783
 71 VAL  QG1    72 ILE  HN      7.03   # peak    785
 71 VAL  QG2    72 ILE  HN      5.84   # peak    784
 72 ILE  HN     72 ILE  HA      3.88   # peak    787
 72 ILE  HN     72 ILE  HB      3.80   # peak    788
 72 ILE  HN     72 ILE  QG2     7.03   # peak    789
 72 ILE  HN     72 ILE  HG12    4.74   # peak    790
 72 ILE  HN     72 ILE  HG13    4.88   # peak    791
 72 ILE  HN     72 ILE  QD1     6.74   # peak    792
 72 ILE  QG2    77 MET  HN      4.87   # peak   1278
 74 PRO  HA     75 PHE  HN      4.96   # peak    793
 74 PRO  HB2    75 PHE  HN      4.24   # peak    794
 74 PRO  HB3    75 PHE  HN      6.00   # peak    795
 74 PRO  HG2    75 PHE  HN      6.00   # peak    796
 74 PRO  HG3    75 PHE  HN      6.00   # peak    797
 74 PRO  HD2    75 PHE  HN      6.00   # peak    798
 74 PRO  HD3    75 PHE  HN      4.67   # peak    799
 75 PHE  HN     75 PHE  HA      3.52   # peak    801
 75 PHE  HN     75 PHE  HB2     3.37   # peak    802
 75 PHE  HN     75 PHE  HB3     3.52   # peak    803
 75 PHE  HN     75 PHE  QD      8.12   # peak    804
 75 PHE  HA     76 SER  HN      5.35   # peak    809
 75 PHE  HB2    76 SER  HN      4.52   # peak    810
 75 PHE  HB3    76 SER  HN      4.24   # peak    811
 76 SER  HN     76 SER  HA      3.95   # peak    816
 76 SER  HN     76 SER  HB2     4.52   # peak    817
 76 SER  HN     76 SER  HB3     3.91   # peak    818
 76 SER  HN     77 MET  HN      3.95   # peak    819
 76 SER  HA     77 MET  HN      3.80   # peak    821
 76 SER  HA     79 TYR  HN      4.16   # peak   1288
 76 SER  HA     80 VAL  HN      5.60   # peak   1292
 76 SER  HB2    77 MET  HN      5.06   # peak    822
 76 SER  HB3    77 MET  HN      4.70   # peak    823
 77 MET  HN     77 MET  HA      5.42   # peak    825
 77 MET  HN     77 MET  QB      5.22   # peak   1349
 77 MET  HN     77 MET  HG2     4.20   # peak    828
 77 MET  HN     77 MET  HG3     4.20   # peak    829
 77 MET  HN     78 PRO  HD2     4.99   # peak   1228
 77 MET  HN     78 PRO  HD3     4.96   # peak   1194
 77 MET  QE     81 ASN  HN      7.03   # peak   1195
 77 MET  QE     82 GLY  HN      7.03   # peak   1574
 78 PRO  HA     79 TYR  HN      4.06   # peak   1729
 78 PRO  HB2    79 TYR  HN      4.38   # peak    831
 78 PRO  HB3    79 TYR  HN      5.68   # peak    832
 78 PRO  QG     79 TYR  HN      6.48   # peak   1350
 78 PRO  HD2    79 TYR  HN      5.82   # peak    835
 78 PRO  HD3    79 TYR  HN      4.92   # peak    836
 79 TYR  HN     79 TYR  HA      4.52   # peak    838
 79 TYR  HN     79 TYR  HB2     3.98   # peak    839
 79 TYR  HN     79 TYR  HB3     3.62   # peak    840
 79 TYR  HN     80 VAL  HN      3.41   # peak    843
 79 TYR  HA     80 VAL  HN      5.64   # peak    845
 79 TYR  HA     81 ASN  HN      4.24   # peak   1204
 79 TYR  HB2    80 VAL  HN      6.00   # peak    846
 79 TYR  HB3    80 VAL  HN      5.68   # peak    847
 80 VAL  HN     80 VAL  HA      6.00   # peak    851
 80 VAL  HN     80 VAL  HB      6.00   # peak    852
 80 VAL  HN     80 VAL  QG1     4.65   # peak    854
 80 VAL  HN     80 VAL  QG2     4.29   # peak    853
 80 VAL  HN     81 ASN  HN      3.08   # peak    855
 80 VAL  HA     81 ASN  HN      3.80   # peak    857
 80 VAL  HB     81 ASN  HN      5.32   # peak    858
 80 VAL  QG1    81 ASN  HN      5.59   # peak    860
 80 VAL  QG2    81 ASN  HN      5.70   # peak    859
 81 ASN  HN     81 ASN  HA      4.02   # peak    862
 81 ASN  HN     81 ASN  HB2     3.37   # peak    863
 81 ASN  HN     81 ASN  HB3     3.52   # peak    864
 81 ASN  HN     81 ASN  HD21    5.64   # peak   1737
 81 ASN  HN     81 ASN  HD22    5.78   # peak   1405
 81 ASN  HN     82 GLY  HN      6.00   # peak    866
 81 ASN  HN     83 ALA  HN      5.32   # peak   1582
 81 ASN  HA     82 GLY  HN      3.44   # peak    867
 81 ASN  HA     83 ALA  HN      4.34   # peak   1229
 81 ASN  HB2    81 ASN  HD21    6.00   # peak   1745
 81 ASN  HB2    81 ASN  HD22    5.24   # peak   1742
 81 ASN  HB2    82 GLY  HN      5.28   # peak    868
 81 ASN  HB3    81 ASN  HD21    5.68   # peak   1744
 81 ASN  HB3    81 ASN  HD22    4.74   # peak   1743
 81 ASN  HB3    82 GLY  HN      6.00   # peak    869
 81 ASN  HD21   81 ASN  HD22    2.72   # peak   1739
 81 ASN  HD22   82 GLY  HN      6.00   # peak   1576
 82 GLY  HN     82 GLY  HA1     3.55   # peak    871
 82 GLY  HN     82 GLY  HA2     4.06   # peak    872
 82 GLY  HN     83 ALA  HN      3.05   # peak    873
 82 GLY  HA1    83 ALA  HN      4.20   # peak    875
 82 GLY  HA2    83 ALA  HN      4.06   # peak    876
 83 ALA  HN     83 ALA  HA      3.55   # peak    878
 83 ALA  HN     83 ALA  QB      3.46   # peak    879
 83 ALA  HN     84 GLU- HN      5.64   # peak    880
 83 ALA  HA     84 GLU- HN      3.23   # peak    882
 83 ALA  QB     84 GLU- HN      4.26   # peak    883
 83 ALA  QB     99 ARG+ HN      7.03   # peak   1688
 84 GLU- HN     84 GLU- HA      4.24   # peak    885
 84 GLU- HN     84 GLU- QB      5.18   # peak   1351
 84 GLU- HN     84 GLU- HG2     4.78   # peak    888
 84 GLU- HN     85 LEU  HN      5.57   # peak    891
 84 GLU- HN     99 ARG+ HN      4.09   # peak   1250
 84 GLU- HA     85 LEU  HN      3.08   # peak    892
 84 GLU- QB     85 LEU  HN      6.41   # peak   1352
 84 GLU- HG2    85 LEU  HN      6.00   # peak    895
 84 GLU- HG3    85 LEU  HN      4.60   # peak    896
 85 LEU  HN     85 LEU  HA      4.85   # peak    898
 85 LEU  HN     85 LEU  HB2     4.13   # peak    899
 85 LEU  HN     85 LEU  HB3     3.55   # peak    900
 85 LEU  HN     85 LEU  HG      5.78   # peak    901
 85 LEU  HN     85 LEU  QD1     6.49   # peak    903
 85 LEU  HN     85 LEU  QD2     5.62   # peak    902
 85 LEU  HN     86 ASP- HN      5.82   # peak    904
 85 LEU  HA     86 ASP- HN      2.87   # peak    906
 85 LEU  HB2    86 ASP- HN      4.92   # peak    907
 85 LEU  HB3    86 ASP- HN      5.75   # peak    908
 85 LEU  HG     86 ASP- HN      4.45   # peak    909
 85 LEU  QD1    86 ASP- HN      4.44   # peak    911
 85 LEU  QD1    97 THR  HN      6.42   # peak   1199
 85 LEU  QD2    86 ASP- HN      6.42   # peak    910
 86 ASP- HN     86 ASP- HA      3.91   # peak    913
 86 ASP- HN     86 ASP- HB2     4.16   # peak    914
 86 ASP- HN     86 ASP- HB3     4.20   # peak    915
 86 ASP- HN     87 TYR  HN      5.10   # peak    916
 86 ASP- HN     97 THR  HN      4.06   # peak   1262
 86 ASP- HN     97 THR  QG2     6.34   # peak   1593
 86 ASP- HA     87 TYR  HN      3.12   # peak    918
 86 ASP- HB3    87 TYR  HN      6.00   # peak    920
 87 TYR  HN     87 TYR  HA      4.42   # peak    922
 87 TYR  HN     87 TYR  HB2     4.70   # peak    923
 87 TYR  HN     87 TYR  HB3     4.24   # peak    924
 87 TYR  HN     88 VAL  HN      4.56   # peak    927
 87 TYR  HA     88 VAL  HN      2.87   # peak    929
 87 TYR  HB2    88 VAL  HN      5.75   # peak    930
 87 TYR  HB3    88 VAL  HN      5.78   # peak    931
 87 TYR  QD     88 VAL  HN      8.14   # peak    932
 88 VAL  HN     88 VAL  HA      3.73   # peak    935
 88 VAL  HN     88 VAL  HB      3.30   # peak    936
 88 VAL  HN     88 VAL  QG1     6.96   # peak    937
 88 VAL  HN     88 VAL  QG2     4.51   # peak    938
 88 VAL  HN     89 VAL  HN      5.24   # peak    939
 88 VAL  HN     95 GLY  HN      3.66   # peak   1263
 88 VAL  HN     96 PHE  HA      4.09   # peak   1232
 88 VAL  HN     97 THR  QG2     6.60   # peak   1601
 88 VAL  HA     89 VAL  HN      2.83   # peak    941
 88 VAL  HA     95 GLY  HN      4.85   # peak   1236
 88 VAL  HB     89 VAL  HN      3.95   # peak    942
 88 VAL  HB     95 GLY  HN      6.00   # peak   1616
 88 VAL  QG1    89 VAL  HN      4.90   # peak    943
 88 VAL  QG1    90 ASP- HN      5.80   # peak   1281
 88 VAL  QG2    89 VAL  HN      6.56   # peak    944
 88 VAL  QG2    95 GLY  HN      7.03   # peak   1615
 89 VAL  HN     89 VAL  HA      4.88   # peak    946
 89 VAL  HN     89 VAL  HB      3.19   # peak    947
 89 VAL  HN     89 VAL  QG1     5.41   # peak    949
 89 VAL  HN     89 VAL  QG2     4.51   # peak    948
 89 VAL  HN     90 ASP- HN      4.45   # peak    950
 89 VAL  HA     90 ASP- HN      2.72   # peak    952
 89 VAL  HA     94 GLY  HN      6.00   # peak   1612
 89 VAL  HB     90 ASP- HN      4.27   # peak    953
 89 VAL  QG1    90 ASP- HN      4.47   # peak    955
 89 VAL  QG2    90 ASP- HN      5.41   # peak    954
 90 ASP- HN     90 ASP- HA      3.37   # peak    957
 90 ASP- HN     90 ASP- HB2     4.31   # peak    958
 90 ASP- HN     90 ASP- HB3     4.52   # peak    959
 90 ASP- HN     91 PHE  HN      4.24   # peak    960
 90 ASP- HN     92 MET  HN      5.89   # peak   1609
 90 ASP- HN     93 GLY  HN      3.91   # peak   1603
 90 ASP- HN     94 GLY  HA1     4.34   # peak   1234
 90 ASP- HN     94 GLY  HA2     4.88   # peak   1233
 90 ASP- HA     91 PHE  HN      3.37   # peak    962
 90 ASP- HB2    91 PHE  HN      3.66   # peak    963
 90 ASP- HB2    92 MET  HN      6.00   # peak   1606
 90 ASP- HB3    91 PHE  HN      3.19   # peak    964
 90 ASP- HB3    92 MET  HN      6.00   # peak   1607
 91 PHE  HN     91 PHE  HA      3.62   # peak    966
 91 PHE  HN     91 PHE  QB      4.28   # peak   1353
 91 PHE  HN     92 MET  HN      4.49   # peak    972
 91 PHE  HA     92 MET  HN      3.26   # peak    974
 91 PHE  QB     92 MET  HN      5.65   # peak   1354
 92 MET  HN     92 MET  HA      3.19   # peak    981
 92 MET  HN     92 MET  HB2     3.62   # peak    982
 92 MET  HN     92 MET  HB3     3.44   # peak    983
 92 MET  HN     92 MET  QG      6.88   # peak   1355
 92 MET  HN     93 GLY  HN      3.05   # peak    986
 92 MET  HA     93 GLY  HN      3.41   # peak    988
 92 MET  HB2    93 GLY  HN      4.31   # peak    989
 92 MET  HB3    93 GLY  HN      4.20   # peak    990
 93 GLY  HN     93 GLY  HA1     3.30   # peak    994
 93 GLY  HN     93 GLY  HA2     2.98   # peak    995
 93 GLY  HN     94 GLY  HN      3.62   # peak    996
 93 GLY  HA1    94 GLY  HN      3.55   # peak    998
 93 GLY  HA2    94 GLY  HN      3.62   # peak    999
 94 GLY  HN     94 GLY  HA1     3.48   # peak   1001
 94 GLY  HN     94 GLY  HA2     3.23   # peak   1002
 94 GLY  HN     95 GLY  HN      4.85   # peak   1003
 94 GLY  HA1    95 GLY  HN      3.23   # peak   1005
 94 GLY  HA2    95 GLY  HN      3.62   # peak   1006
 95 GLY  HN     95 GLY  HA1     3.84   # peak   1008
 95 GLY  HN     95 GLY  HA2     3.80   # peak   1009
 95 GLY  HN     96 PHE  HN      4.42   # peak   1303
 95 GLY  HA1    96 PHE  HN      3.37   # peak   1307
 95 GLY  HA2    96 PHE  HN      3.37   # peak   1305
 96 PHE  HN     96 PHE  HA      4.67   # peak   1304
 96 PHE  HN     96 PHE  QB      4.57   # peak   1306
 96 PHE  HA     97 THR  HN      3.16   # peak   1010
 96 PHE  QB     97 THR  HN      6.01   # peak   1308
 97 THR  HN     97 THR  HA      5.24   # peak   1017
 97 THR  HN     97 THR  HB      5.64   # peak   1018
 97 THR  HN     97 THR  QG2     5.26   # peak   1019
 98 ILE  HA     99 ARG+ HN      3.08   # peak   1684
 99 ARG+ HN     99 ARG+ HB2     4.31   # peak   1686
 99 ARG+ HN     99 ARG+ HB3     3.73   # peak   1685
  2 GLN  HA      2 GLN  HB2     3.84   # peak     24
  2 GLN  HA      2 GLN  HB3     4.20   # peak     25
  2 GLN  HB2     2 GLN  HB3     6.00   # peak     32
  3 GLU- HN      3 GLU- HA      4.96   # peak     57
  3 GLU- HN      3 GLU- HB2     4.42   # peak     63
  3 GLU- HN      3 GLU- HB3     4.60   # peak     69
  3 GLU- HN      3 GLU- QG      6.88   # peak     75
  3 GLU- HA      3 GLU- HB2     3.88   # peak     59
  3 GLU- HA      3 GLU- HB3     3.91   # peak     60
  3 GLU- HA      3 GLU- QG      6.62   # peak     61
  3 GLU- HA      4 GLN  HN      3.37   # peak     62
  3 GLU- HB2     3 GLU- HB3     2.40   # peak     66
  3 GLU- HB2     3 GLU- QG      3.92   # peak     67
  3 GLU- HB2     4 GLN  HN      4.99   # peak     68
  3 GLU- HB3     3 GLU- QG      4.21   # peak     73
  3 GLU- HB3     4 GLN  HN      6.00   # peak     74
  3 GLU- QG      4 GLN  HN      6.88   # peak     80
  4 GLN  HN      4 GLN  HA      4.60   # peak     81
  4 GLN  HN      4 GLN  HB2     5.14   # peak     87
  4 GLN  HN      4 GLN  HB3     5.06   # peak     93
  4 GLN  HN      4 GLN  QG      6.88   # peak     99
  4 GLN  HA      4 GLN  HB2     3.73   # peak     83
  4 GLN  HA      4 GLN  HB3     3.48   # peak     84
  4 GLN  HA      4 GLN  QG      6.12   # peak     85
  4 GLN  HA      5 ALA  HN      3.12   # peak     86
  4 GLN  HB2     4 GLN  HB3     2.40   # peak     90
  4 GLN  HB2     4 GLN  QG      4.79   # peak     91
  4 GLN  HB2     5 ALA  HN      6.00   # peak     92
  4 GLN  HB3     4 GLN  QG      3.74   # peak     97
  4 GLN  HB3     5 ALA  HN      6.00   # peak     98
  4 GLN  QG      5 ALA  HN      6.88   # peak    104
  5 ALA  HN      5 ALA  HA      4.52   # peak    105
  5 ALA  HN      5 ALA  QB      4.69   # peak    109
  5 ALA  HA      5 ALA  QB      3.75   # peak    107
  5 ALA  HA      6 GLN  HN      3.05   # peak    108
  5 ALA  HA      6 GLN  QB      6.44   # peak   2729
  5 ALA  HA      6 GLN  QG      6.88   # peak   2730
  5 ALA  QB      6 GLN  HN      4.94   # peak    112
  6 GLN  HN      6 GLN  HA      4.09   # peak    113
  6 GLN  HN      6 GLN  QB      4.79   # peak    118
  6 GLN  HN      6 GLN  QG      6.34   # peak    123
  6 GLN  HA      6 GLN  QB      4.14   # peak    115
  6 GLN  HA      6 GLN  QG      5.04   # peak    116
  6 GLN  HA      7 GLN  HN      2.87   # peak    117
  6 GLN  QB      6 GLN  QG      5.05   # peak    121
  6 GLN  QB      7 GLN  HN      5.00   # peak    122
  6 GLN  QG      6 GLN  HE21    6.88   # peak   2733
  6 GLN  QG      6 GLN  HE22    6.88   # peak   2732
  6 GLN  QG      7 GLN  HN      6.88   # peak    127
  6 GLN  QG     63 PHE  QE      9.00   # peak   3379
  7 GLN  HN      7 GLN  HA      3.30   # peak    128
  7 GLN  HN      7 GLN  QB      4.97   # peak    134
  7 GLN  HN      7 GLN  HG2     6.00   # peak    140
  7 GLN  HN      7 GLN  HG3     6.00   # peak    146
  7 GLN  HA      7 GLN  QB      3.92   # peak    130
  7 GLN  HA      7 GLN  HG2     3.98   # peak    131
  7 GLN  HA      7 GLN  HG3     3.91   # peak    132
  7 GLN  HA      8 PHE  HN      2.80   # peak    133
  7 GLN  HA     62 VAL  QG1     5.98   # peak   2731
  7 GLN  QB      7 GLN  HG2     4.18   # peak    137
  7 GLN  QB      7 GLN  HG3     3.89   # peak    138
  7 GLN  QB      8 PHE  HN      5.44   # peak    139
  7 GLN  HG2     7 GLN  HG3     2.40   # peak    144
  7 GLN  HG2     7 GLN  HE22    6.00   # peak   2735
  7 GLN  HG2     8 PHE  HN      6.00   # peak    145
  7 GLN  HG3     7 GLN  HE22    5.86   # peak   2734
  7 GLN  HG3     8 PHE  HN      4.92   # peak    151
  8 PHE  HN      8 PHE  HA      4.56   # peak    152
  8 PHE  HN      8 PHE  QB      5.29   # peak    159
  8 PHE  HN     77 MET  QE      6.52   # peak   3247
  8 PHE  HA      8 PHE  QB      4.90   # peak    154
  8 PHE  HA      8 PHE  QD      6.43   # peak    155
  8 PHE  HA      9 ILE  HN      2.90   # peak    158
  8 PHE  HA     77 MET  QE      5.80   # peak   3252
  8 PHE  QB      8 PHE  QD      8.03   # peak    162
  8 PHE  QB      8 PHE  QE      9.00   # peak    163
  8 PHE  QB      9 ILE  HN      4.86   # peak    165
  8 PHE  QB     77 MET  QE      5.67   # peak   3241
  8 PHE  QD     72 ILE  QD1     9.15   # peak   3217
  8 PHE  QD     77 MET  QE      6.67   # peak   3238
  8 PHE  QE     72 ILE  QD1     6.88   # peak   3216
  8 PHE  QE     77 MET  QE      7.67   # peak   3237
  9 ILE  HN      9 ILE  HA      3.91   # peak    166
  9 ILE  HN      9 ILE  HB      3.34   # peak    174
  9 ILE  HN      9 ILE  QG2     5.55   # peak    182
  9 ILE  HN      9 ILE  HG12    5.60   # peak    190
  9 ILE  HN      9 ILE  HG13    5.14   # peak    198
  9 ILE  HN      9 ILE  QD1     7.03   # peak    206
  9 ILE  HN     77 MET  QE      5.12   # peak   3235
  9 ILE  HA      9 ILE  HB      4.13   # peak    168
  9 ILE  HA      9 ILE  QG2     4.62   # peak    169
  9 ILE  HA      9 ILE  HG12    4.02   # peak    170
  9 ILE  HA      9 ILE  HG13    4.27   # peak    171
  9 ILE  HA      9 ILE  QD1     5.55   # peak    172
  9 ILE  HA     10 PHE  HN      3.01   # peak    173
  9 ILE  HA     63 PHE  QD      8.12   # peak   2738
  9 ILE  HB      9 ILE  QG2     3.93   # peak    177
  9 ILE  HB      9 ILE  HG12    3.37   # peak    178
  9 ILE  HB      9 ILE  HG13    2.80   # peak    179
  9 ILE  HB      9 ILE  QD1     5.19   # peak    180
  9 ILE  HB     10 PHE  HN      5.68   # peak    181
  9 ILE  HB     82 GLY  HN      4.13   # peak   2736
  9 ILE  HB     82 GLY  HA1     4.20   # peak   2742
  9 ILE  HB     82 GLY  HA2     4.74   # peak   2747
  9 ILE  QG2     9 ILE  HG12    4.51   # peak    186
  9 ILE  QG2     9 ILE  HG13    4.72   # peak    187
  9 ILE  QG2     9 ILE  QD1     4.53   # peak    188
  9 ILE  QG2    10 PHE  HN      5.05   # peak    189
  9 ILE  QG2    11 LYS+ HG2     6.60   # peak   2760
  9 ILE  QG2    11 LYS+ HG3     7.03   # peak   2759
  9 ILE  QG2    11 LYS+ QD      7.90   # peak   2758
  9 ILE  QG2    11 LYS+ QE      5.85   # peak   2750
  9 ILE  QG2    63 PHE  QD      9.15   # peak   3385
  9 ILE  QG2    82 GLY  HN      5.44   # peak   2737
  9 ILE  QG2    82 GLY  HA1     4.83   # peak   2746
  9 ILE  QG2    82 GLY  HA2     5.01   # peak   2740
  9 ILE  QG2    83 ALA  HN      7.03   # peak   3384
  9 ILE  HG12    9 ILE  HG13    2.40   # peak    195
  9 ILE  HG12    9 ILE  QD1     3.75   # peak    196
  9 ILE  HG12   10 PHE  HN      6.00   # peak    197
  9 ILE  HG12   77 MET  QE      5.84   # peak   3284
  9 ILE  HG13    9 ILE  QD1     3.86   # peak    204
  9 ILE  HG13   10 PHE  HN      6.00   # peak    205
  9 ILE  QD1    10 PHE  HN      7.03   # peak    213
 10 PHE  HN     10 PHE  HA      4.13   # peak    214
 10 PHE  HN     10 PHE  HB2     5.53   # peak    222
 10 PHE  HN     10 PHE  HB3     4.92   # peak    230
 10 PHE  HA     10 PHE  HB2     3.62   # peak    216
 10 PHE  HA     10 PHE  HB3     3.98   # peak    217
 10 PHE  HA     10 PHE  QD      8.12   # peak    218
 10 PHE  HA     11 LYS+ HN      3.23   # peak    221
 10 PHE  HB2    10 PHE  HB3     2.80   # peak    225
 10 PHE  HB2    10 PHE  QD      8.12   # peak    226
 10 PHE  HB2    11 LYS+ HN      4.63   # peak    229
 10 PHE  HB3    10 PHE  QD      7.55   # peak    234
 10 PHE  HB3    11 LYS+ HN      6.00   # peak    237
 10 PHE  HB3    72 ILE  QD1     7.03   # peak   3487
 10 PHE  QD     12 VAL  QG2     7.31   # peak   2763
 10 PHE  QD     36 ILE  QD1     8.83   # peak   2765
 10 PHE  QD     70 VAL  QG1     8.43   # peak   3370
 10 PHE  QD     72 ILE  QD1     7.96   # peak   3218
 10 PHE  QD     77 MET  QE      8.79   # peak   3249
 10 PHE  QD     80 VAL  HB      8.12   # peak   3270
 10 PHE  QD     80 VAL  QG2     8.61   # peak   3272
 10 PHE  QD     83 ALA  QB      9.15   # peak   3499
 10 PHE  QD     85 LEU  QD1     9.15   # peak   3306
 10 PHE  QE     12 VAL  QG2     7.06   # peak   2764
 10 PHE  QE     36 ILE  QG2     9.15   # peak   3406
 10 PHE  QE     36 ILE  QD1     7.17   # peak   2766
 10 PHE  QE     70 VAL  QG1     8.50   # peak   3369
 10 PHE  QE     70 VAL  QG2     9.15   # peak   3476
 10 PHE  QE     72 ILE  QD1     9.15   # peak   3219
 10 PHE  QE     80 VAL  HB      8.12   # peak   3271
 10 PHE  QE     80 VAL  QG2     9.11   # peak   3273
 10 PHE  QE     83 ALA  QB      7.28   # peak   3350
 10 PHE  QE     85 LEU  HB2     7.83   # peak   3514
 10 PHE  QE     85 LEU  HB3     8.12   # peak   3515
 10 PHE  QE     85 LEU  QD1     9.15   # peak   3305
 10 PHE  QE     85 LEU  QD2     9.15   # peak   3308
 10 PHE  QE     98 ILE  QG2     9.15   # peak   3359
 10 PHE  QE     98 ILE  QD1     8.03   # peak   3349
 11 LYS+ HN     11 LYS+ HA      4.45   # peak    238
 11 LYS+ HN     11 LYS+ HB2     4.06   # peak    256
 11 LYS+ HN     11 LYS+ HB3     4.06   # peak    247
 11 LYS+ HN     11 LYS+ HG2     4.34   # peak    265
 11 LYS+ HN     11 LYS+ HG3     5.68   # peak    274
 11 LYS+ HN     11 LYS+ QD      6.88   # peak    283
 11 LYS+ HN     11 LYS+ QE      6.88   # peak    292
 11 LYS+ HA     11 LYS+ HB2     4.42   # peak    241
 11 LYS+ HA     11 LYS+ HB3     3.30   # peak    240
 11 LYS+ HA     11 LYS+ HG2     3.95   # peak    242
 11 LYS+ HA     11 LYS+ HG3     4.09   # peak    243
 11 LYS+ HA     11 LYS+ QD      6.88   # peak    244
 11 LYS+ HA     11 LYS+ QE      6.88   # peak    245
 11 LYS+ HA     12 VAL  HN      2.94   # peak    246
 11 LYS+ HB2    11 LYS+ HB3     2.83   # peak    250
 11 LYS+ HB2    11 LYS+ HG2     3.26   # peak    260
 11 LYS+ HB2    11 LYS+ HG3     4.09   # peak    261
 11 LYS+ HB2    11 LYS+ QD      5.29   # peak    262
 11 LYS+ HB2    11 LYS+ QE      5.69   # peak    263
 11 LYS+ HB2    12 VAL  HN      6.00   # peak    264
 11 LYS+ HB3    11 LYS+ HG2     3.55   # peak    251
 11 LYS+ HB3    11 LYS+ HG3     3.44   # peak    252
 11 LYS+ HB3    11 LYS+ QD      4.90   # peak    253
 11 LYS+ HB3    11 LYS+ QE      5.47   # peak    254
 11 LYS+ HB3    12 VAL  HN      4.24   # peak    255
 11 LYS+ HG2    11 LYS+ HG3     2.40   # peak    270
 11 LYS+ HG2    11 LYS+ QD      4.50   # peak    271
 11 LYS+ HG2    11 LYS+ QE      4.93   # peak    272
 11 LYS+ HG2    12 VAL  HN      6.00   # peak    273
 11 LYS+ HG3    11 LYS+ QD      4.14   # peak    280
 11 LYS+ HG3    11 LYS+ QE      4.79   # peak    281
 11 LYS+ HG3    12 VAL  HN      6.00   # peak    282
 11 LYS+ QD     11 LYS+ QE      5.48   # peak    290
 11 LYS+ QD     12 VAL  HN      6.88   # peak    291
 11 LYS+ QE     12 VAL  HN      6.88   # peak    300
 12 VAL  HN     12 VAL  HA      4.52   # peak    301
 12 VAL  HN     12 VAL  HB      3.70   # peak    307
 12 VAL  HN     12 VAL  QG1     6.81   # peak    319
 12 VAL  HN     12 VAL  QG2     4.58   # peak    313
 12 VAL  HA     12 VAL  HB      3.84   # peak    303
 12 VAL  HA     12 VAL  QG1     4.87   # peak    305
 12 VAL  HA     12 VAL  QG2     4.47   # peak    304
 12 VAL  HA     13 THR  HN      3.08   # peak    306
 12 VAL  HA     13 THR  QG2     5.37   # peak   2781
 12 VAL  HB     12 VAL  QG1     4.18   # peak    311
 12 VAL  HB     12 VAL  QG2     3.82   # peak    310
 12 VAL  HB     13 THR  HN      4.60   # peak    312
 12 VAL  QG1    12 VAL  QG2     5.79   # peak    317
 12 VAL  QG1    13 THR  HN      4.62   # peak    324
 12 VAL  QG1    16 ALA  QB      5.68   # peak   2681
 12 VAL  QG1    85 LEU  HN      7.03   # peak   2762
 12 VAL  QG1    85 LEU  HB3     7.03   # peak   2768
 12 VAL  QG1    85 LEU  QD1     8.06   # peak   2778
 12 VAL  QG2    13 THR  HN      5.84   # peak    318
 12 VAL  QG2    16 ALA  QB      8.06   # peak   2774
 12 VAL  QG2    65 TYR  QE      8.30   # peak   3481
 12 VAL  QG2    85 LEU  HN      6.27   # peak   2761
 12 VAL  QG2    85 LEU  HB2     5.48   # peak   2772
 12 VAL  QG2    85 LEU  HB3     5.08   # peak   2769
 12 VAL  QG2    85 LEU  QD1     6.33   # peak   2777
 13 THR  HN     13 THR  HA      3.84   # peak    325
 13 THR  HN     13 THR  QG2     4.11   # peak    335
 13 THR  HN     86 ASP- HA      4.60   # peak   2792
 13 THR  HA     13 THR  HB      3.05   # peak    327
 13 THR  HA     13 THR  QG2     4.33   # peak    328
 13 THR  HA     14 ASP- HN      3.16   # peak    329
 13 THR  HB     13 THR  QG2     4.04   # peak    333
 13 THR  QG2    13 THR  HG1     4.36   # peak   2780
 13 THR  QG2    14 ASP- HN      5.30   # peak    339
 13 THR  QG2    15 LYS+ HN      6.31   # peak   3478
 13 THR  QG2    16 ALA  HN      7.03   # peak   2782
 13 THR  QG2    16 ALA  QB      7.41   # peak   2795
 13 THR  QG2    86 ASP- HA      4.94   # peak   2779
 13 THR  QG2    86 ASP- HB2     6.38   # peak   2785
 13 THR  QG2    86 ASP- HB3     6.24   # peak   2786
 13 THR  HG1    16 ALA  QB      5.34   # peak   2808
 13 THR  HG1    86 ASP- HA      3.48   # peak   2791
 14 ASP- HN     14 ASP- HA      3.52   # peak    340
 14 ASP- HN     14 ASP- HB2     3.52   # peak    346
 14 ASP- HN     14 ASP- HB3     3.37   # peak    351
 14 ASP- HA     14 ASP- HB2     3.12   # peak    342
 14 ASP- HA     14 ASP- HB3     3.08   # peak    343
 14 ASP- HA     15 LYS+ HN      4.45   # peak    344
 14 ASP- HA     16 ALA  HN      5.10   # peak   2801
 14 ASP- HA     17 VAL  HB      3.48   # peak    345
 14 ASP- HA     17 VAL  QG1     6.24   # peak   2798
 14 ASP- HA     17 VAL  QG2     4.90   # peak   2799
 14 ASP- HA     18 GLU- HN      4.38   # peak   2800
 14 ASP- HB2    14 ASP- HB3     2.40   # peak    349
 14 ASP- HB2    15 LYS+ HN      3.77   # peak    350
 14 ASP- HB3    15 LYS+ HN      4.09   # peak    355
 15 LYS+ HN     15 LYS+ HA      3.55   # peak    356
 15 LYS+ HN     15 LYS+ HB2     3.30   # peak    368
 15 LYS+ HN     15 LYS+ HB3     3.16   # peak    379
 15 LYS+ HN     15 LYS+ HG2     4.85   # peak    390
 15 LYS+ HN     15 LYS+ HG3     4.78   # peak    401
 15 LYS+ HN     15 LYS+ HD2     6.00   # peak    412
 15 LYS+ HN     15 LYS+ HD3     5.75   # peak    423
 15 LYS+ HA     15 LYS+ HB2     3.34   # peak    358
 15 LYS+ HA     15 LYS+ HB3     3.48   # peak    359
 15 LYS+ HA     15 LYS+ HG2     4.56   # peak    360
 15 LYS+ HA     15 LYS+ HG3     4.63   # peak    361
 15 LYS+ HA     15 LYS+ HD2     4.27   # peak    362
 15 LYS+ HA     15 LYS+ HD3     4.27   # peak    363
 15 LYS+ HA     15 LYS+ HE2     6.00   # peak    364
 15 LYS+ HA     15 LYS+ HE3     6.00   # peak    446
 15 LYS+ HA     16 ALA  HN      4.45   # peak    366
 15 LYS+ HA     18 GLU- QB      5.29   # peak    367
 15 LYS+ HB2    15 LYS+ HB3     2.40   # peak    371
 15 LYS+ HB2    15 LYS+ HG2     3.80   # peak    372
 15 LYS+ HB2    15 LYS+ HG3     3.73   # peak    373
 15 LYS+ HB2    15 LYS+ HD3     4.42   # peak    375
 15 LYS+ HB2    15 LYS+ HE2     6.00   # peak    376
 15 LYS+ HB2    15 LYS+ HE3     5.96   # peak    377
 15 LYS+ HB2    16 ALA  HN      3.91   # peak    378
 15 LYS+ HB3    15 LYS+ HG2     3.98   # peak    383
 15 LYS+ HB3    15 LYS+ HG3     3.23   # peak    384
 15 LYS+ HB3    15 LYS+ HD2     5.14   # peak    385
 15 LYS+ HB3    15 LYS+ HD3     4.63   # peak    386
 15 LYS+ HB3    15 LYS+ HE2     5.57   # peak    387
 15 LYS+ HB3    15 LYS+ HE3     6.00   # peak    388
 15 LYS+ HB3    16 ALA  HN      3.84   # peak    389
 15 LYS+ HG2    15 LYS+ HG3     2.40   # peak    395
 15 LYS+ HG2    15 LYS+ HD2     2.69   # peak    396
 15 LYS+ HG2    15 LYS+ HD3     3.26   # peak    397
 15 LYS+ HG2    15 LYS+ HE2     3.52   # peak    398
 15 LYS+ HG2    15 LYS+ HE3     4.06   # peak    399
 15 LYS+ HG2    16 ALA  HN      4.85   # peak    400
 15 LYS+ HG2    87 TYR  QD      8.14   # peak   3477
 15 LYS+ HG3    15 LYS+ HD2     2.98   # peak    407
 15 LYS+ HG3    15 LYS+ HD3     2.94   # peak    408
 15 LYS+ HG3    15 LYS+ HE2     3.23   # peak    409
 15 LYS+ HG3    15 LYS+ HE3     3.80   # peak    410
 15 LYS+ HG3    16 ALA  HN      6.00   # peak    411
 15 LYS+ HD2    15 LYS+ HE2     3.95   # peak    420
 15 LYS+ HD2    15 LYS+ HE3     4.20   # peak    421
 15 LYS+ HD3    15 LYS+ HE2     3.95   # peak    431
 15 LYS+ HD3    15 LYS+ HE3     3.62   # peak    432
 15 LYS+ HE2    15 LYS+ HE3     2.40   # peak    443
 16 ALA  HN     16 ALA  HA      3.52   # peak    456
 16 ALA  HN     16 ALA  QB      4.11   # peak    461
 16 ALA  HN     17 VAL  HB      4.67   # peak   3371
 16 ALA  HN     87 TYR  HA      5.89   # peak   3504
 16 ALA  HN     87 TYR  HB3     6.00   # peak   3492
 16 ALA  HA     16 ALA  QB      4.00   # peak    458
 16 ALA  HA     17 VAL  HN      4.24   # peak    459
 16 ALA  HA     19 GLU- HB2     4.24   # peak   2858
 16 ALA  HA     19 GLU- HB3     3.73   # peak    460
 16 ALA  HA     20 ILE  QD1     6.63   # peak   2825
 16 ALA  QB     17 VAL  HN      4.04   # peak    464
 16 ALA  QB     20 ILE  QD1     7.08   # peak   2690
 16 ALA  QB     85 LEU  QD1     7.52   # peak   2819
 16 ALA  QB     85 LEU  QD2     6.65   # peak   2820
 16 ALA  QB     86 ASP- HA      4.47   # peak   2793
 16 ALA  QB     86 ASP- HB2     7.03   # peak   2787
 16 ALA  QB     86 ASP- HB3     7.03   # peak   2788
 16 ALA  QB     87 TYR  HN      5.52   # peak   2685
 16 ALA  QB     87 TYR  HA      5.41   # peak   2814
 16 ALA  QB     87 TYR  HB2     6.09   # peak   2815
 16 ALA  QB     87 TYR  HB3     5.91   # peak   2687
 16 ALA  QB     87 TYR  QD      9.17   # peak   2810
 17 VAL  HN     17 VAL  HA      3.88   # peak    465
 17 VAL  HN     17 VAL  HB      3.08   # peak    472
 17 VAL  HN     17 VAL  QG1     5.16   # peak    484
 17 VAL  HN     17 VAL  QG2     3.97   # peak    478
 17 VAL  HA     17 VAL  HB      3.66   # peak    467
 17 VAL  HA     17 VAL  QG1     4.36   # peak    469
 17 VAL  HA     17 VAL  QG2     4.15   # peak    468
 17 VAL  HA     18 GLU- HN      5.82   # peak    470
 17 VAL  HA     20 ILE  HB      3.70   # peak    471
 17 VAL  HA     20 ILE  QG2     7.03   # peak   2866
 17 VAL  HA     20 ILE  QD1     4.98   # peak   2686
 17 VAL  HA     68 VAL  QG1     7.03   # peak   3171
 17 VAL  HA     68 VAL  QG2     7.03   # peak   3028
 17 VAL  HB     17 VAL  QG1     3.54   # peak    476
 17 VAL  HB     17 VAL  QG2     3.97   # peak    475
 17 VAL  HB     18 GLU- HN      3.23   # peak    477
 17 VAL  QG1    17 VAL  QG2     4.89   # peak    482
 17 VAL  QG1    18 GLU- HN      5.30   # peak    489
 17 VAL  QG1    18 GLU- HA      6.24   # peak   2831
 17 VAL  QG1    18 GLU- QB      7.90   # peak   2841
 17 VAL  QG1    20 ILE  HB      6.24   # peak   2842
 17 VAL  QG1    21 LYS+ QB      7.44   # peak   2843
 17 VAL  QG1    21 LYS+ QD      5.53   # peak   2844
 17 VAL  QG1    21 LYS+ QE      5.46   # peak   2845
 17 VAL  QG1    65 TYR  HA      7.03   # peak   2832
 17 VAL  QG1    65 TYR  HB2     6.02   # peak   2702
 17 VAL  QG1    65 TYR  HB3     6.13   # peak   2700
 17 VAL  QG1    65 TYR  QD      8.38   # peak   2838
 17 VAL  QG1    66 ASP- HN      5.80   # peak   2682
 17 VAL  QG1    66 ASP- HB2     5.52   # peak   2699
 17 VAL  QG1    66 ASP- HB3     3.86   # peak   2694
 17 VAL  QG2    18 GLU- HN      5.88   # peak    483
 17 VAL  QG2    21 LYS+ QD      7.90   # peak   2847
 17 VAL  QG2    21 LYS+ QE      7.26   # peak   2849
 17 VAL  QG2    65 TYR  HB2     4.69   # peak   2696
 17 VAL  QG2    65 TYR  HB3     4.62   # peak   2697
 17 VAL  QG2    65 TYR  QD      8.74   # peak   2837
 17 VAL  QG2    66 ASP- HN      6.63   # peak   2683
 17 VAL  QG2    66 ASP- HB2     6.92   # peak   2707
 17 VAL  QG2    66 ASP- HB3     6.52   # peak   2695
 18 GLU- HN     18 GLU- HA      3.30   # peak    490
 18 GLU- HN     18 GLU- QB      4.10   # peak    496
 18 GLU- HN     18 GLU- QG      5.33   # peak    501
 18 GLU- HA     18 GLU- QB      4.03   # peak    492
 18 GLU- HA     18 GLU- QG      4.97   # peak    493
 18 GLU- HA     19 GLU- HN      4.67   # peak    494
 18 GLU- HA     21 LYS+ HN      4.27   # peak   2852
 18 GLU- HA     21 LYS+ QB      5.00   # peak    495
 18 GLU- HA     21 LYS+ QD      5.65   # peak   2851
 18 GLU- QB     18 GLU- QG      4.44   # peak    499
 18 GLU- QB     19 GLU- HN      4.68   # peak    500
 18 GLU- QG     19 GLU- HN      6.88   # peak    505
 19 GLU- HN     19 GLU- HA      3.41   # peak    506
 19 GLU- HN     19 GLU- HB2     3.88   # peak   2855
 19 GLU- HN     19 GLU- HB3     4.31   # peak    513
 19 GLU- HN     19 GLU- HG2     6.00   # peak    519
 19 GLU- HN     19 GLU- HG3     6.00   # peak    525
 19 GLU- HA     19 GLU- HB2     3.77   # peak   2853
 19 GLU- HA     19 GLU- HB3     4.09   # peak    508
 19 GLU- HA     19 GLU- HG2     5.86   # peak    509
 19 GLU- HA     19 GLU- HG3     5.03   # peak    510
 19 GLU- HA     20 ILE  HN      5.14   # peak    511
 19 GLU- HA     22 LYS+ QB      4.50   # peak    512
 19 GLU- HB2    19 GLU- HB3     3.70   # peak   2854
 19 GLU- HB2    19 GLU- HG2     6.00   # peak   2859
 19 GLU- HB3    19 GLU- HG2     4.63   # peak    516
 19 GLU- HB3    19 GLU- HG3     5.60   # peak    517
 19 GLU- HB3    20 ILE  HN      6.00   # peak    518
 19 GLU- HG2    19 GLU- HG3     3.23   # peak    523
 19 GLU- HG2    20 ILE  HN      6.00   # peak    524
 19 GLU- HG3    20 ILE  HN      6.00   # peak    530
 20 ILE  HN     20 ILE  HA      4.16   # peak    531
 20 ILE  HN     20 ILE  HB      3.48   # peak    540
 20 ILE  HN     20 ILE  QG2     5.26   # peak    548
 20 ILE  HN     20 ILE  HG12    6.00   # peak    556
 20 ILE  HN     20 ILE  HG13    5.93   # peak    564
 20 ILE  HN     20 ILE  QD1     5.01   # peak    572
 20 ILE  HN     34 LEU  QD2     7.03   # peak   3430
 20 ILE  HA     20 ILE  HB      3.55   # peak    533
 20 ILE  HA     20 ILE  QG2     4.47   # peak    534
 20 ILE  HA     20 ILE  HG12    5.14   # peak    535
 20 ILE  HA     20 ILE  HG13    6.00   # peak    536
 20 ILE  HA     20 ILE  QD1     4.62   # peak    537
 20 ILE  HA     21 LYS+ HN      5.46   # peak    538
 20 ILE  HA     23 VAL  HB      4.70   # peak   2909
 20 ILE  HA     23 VAL  QG1     6.78   # peak   2910
 20 ILE  HA     23 VAL  QG2     5.41   # peak   2908
 20 ILE  HB     20 ILE  QG2     4.00   # peak    543
 20 ILE  HB     20 ILE  HG12    6.00   # peak    544
 20 ILE  HB     20 ILE  HG13    6.00   # peak    545
 20 ILE  HB     20 ILE  QD1     4.15   # peak    546
 20 ILE  HB     21 LYS+ HN      3.59   # peak    547
 20 ILE  QG2    20 ILE  HG12    5.70   # peak    552
 20 ILE  QG2    20 ILE  HG13    6.09   # peak    553
 20 ILE  QG2    20 ILE  QD1     5.43   # peak    554
 20 ILE  QG2    21 LYS+ HN      5.37   # peak    555
 20 ILE  QG2    21 LYS+ HA      6.16   # peak   2865
 20 ILE  QG2    23 VAL  QG2     7.59   # peak   2906
 20 ILE  QG2    32 PRO  HG2     5.48   # peak   2871
 20 ILE  QG2    32 PRO  HG3     5.23   # peak   2869
 20 ILE  QG2    34 LEU  QD1     7.84   # peak   2873
 20 ILE  QG2    34 LEU  QD2     7.23   # peak   2877
 20 ILE  QG2    50 MET  QE      6.69   # peak   2863
 20 ILE  QG2    52 PHE  QD      7.42   # peak   2862
 20 ILE  HG12   20 ILE  HG13    4.27   # peak    561
 20 ILE  HG12   20 ILE  QD1     5.37   # peak    576
 20 ILE  HG12   21 LYS+ HN      6.00   # peak    563
 20 ILE  HG13   20 ILE  QD1     4.62   # peak    570
 20 ILE  HG13   21 LYS+ HN      6.00   # peak    571
 20 ILE  QD1    21 LYS+ HN      7.03   # peak    579
 20 ILE  QD1    23 VAL  QG1     7.05   # peak   2904
 20 ILE  QD1    23 VAL  QG2     6.80   # peak   2905
 20 ILE  QD1    24 ALA  QB      8.06   # peak   2930
 20 ILE  QD1    34 LEU  HB3     6.63   # peak   2872
 20 ILE  QD1    34 LEU  QD1     6.87   # peak   2875
 20 ILE  QD1    34 LEU  QD2     6.29   # peak   2879
 21 LYS+ HN     21 LYS+ HA      3.44   # peak    580
 21 LYS+ HN     21 LYS+ QB      4.68   # peak    588
 21 LYS+ HN     21 LYS+ HG2     5.10   # peak    595
 21 LYS+ HN     21 LYS+ HG3     5.06   # peak   3045
 21 LYS+ HN     21 LYS+ QD      6.88   # peak    602
 21 LYS+ HN     21 LYS+ QE      6.88   # peak    609
 21 LYS+ HA     21 LYS+ QB      4.43   # peak    582
 21 LYS+ HA     21 LYS+ HG2     3.44   # peak    583
 21 LYS+ HA     21 LYS+ HG3     4.38   # peak   3039
 21 LYS+ HA     21 LYS+ QD      4.97   # peak    584
 21 LYS+ HA     21 LYS+ QE      6.88   # peak    585
 21 LYS+ HA     22 LYS+ HN      5.10   # peak    586
 21 LYS+ HA     24 ALA  QB      4.15   # peak    587
 21 LYS+ QB     21 LYS+ HG2     4.90   # peak    591
 21 LYS+ QB     21 LYS+ HG3     6.77   # peak   3043
 21 LYS+ QB     21 LYS+ QD      6.46   # peak    592
 21 LYS+ QB     21 LYS+ QE      6.56   # peak    593
 21 LYS+ QB     22 LYS+ HN      4.54   # peak    594
 21 LYS+ HG2    21 LYS+ HG3     2.87   # peak   3042
 21 LYS+ HG2    21 LYS+ QD      3.78   # peak    599
 21 LYS+ HG2    21 LYS+ QE      5.00   # peak    600
 21 LYS+ HG2    22 LYS+ HN      6.00   # peak    601
 21 LYS+ HG3    21 LYS+ QE      6.88   # peak   3040
 21 LYS+ QD     21 LYS+ QE      5.52   # peak    607
 21 LYS+ QD     22 LYS+ HN      6.88   # peak    608
 22 LYS+ HN     22 LYS+ HA      3.62   # peak    616
 22 LYS+ HN     22 LYS+ QB      4.36   # peak    625
 22 LYS+ HN     22 LYS+ HG2     4.99   # peak    633
 22 LYS+ HN     22 LYS+ HG3     4.63   # peak    641
 22 LYS+ HN     22 LYS+ QD      6.66   # peak    649
 22 LYS+ HN     22 LYS+ QE      6.88   # peak    657
 22 LYS+ HA     22 LYS+ QB      4.32   # peak    618
 22 LYS+ HA     22 LYS+ HG2     3.80   # peak    619
 22 LYS+ HA     22 LYS+ HG3     3.73   # peak    620
 22 LYS+ HA     22 LYS+ QD      5.62   # peak    621
 22 LYS+ HA     22 LYS+ QE      6.88   # peak    622
 22 LYS+ HA     23 VAL  HN      5.60   # peak    623
 22 LYS+ HA     25 GLN  QB      6.12   # peak    624
 22 LYS+ QB     22 LYS+ HG2     5.11   # peak    628
 22 LYS+ QB     22 LYS+ HG3     4.75   # peak    629
 22 LYS+ QB     22 LYS+ QD      6.85   # peak    630
 22 LYS+ QB     22 LYS+ QE      7.68   # peak    631
 22 LYS+ QB     23 VAL  HN      5.18   # peak    632
 22 LYS+ HG2    22 LYS+ HG3     2.40   # peak    637
 22 LYS+ HG2    22 LYS+ QD      4.93   # peak    638
 22 LYS+ HG2    22 LYS+ QE      4.61   # peak    639
 22 LYS+ HG2    23 VAL  HN      6.00   # peak    640
 22 LYS+ HG3    22 LYS+ QD      4.14   # peak    646
 22 LYS+ HG3    22 LYS+ QE      4.68   # peak    647
 22 LYS+ HG3    23 VAL  HN      6.00   # peak    648
 22 LYS+ QD     22 LYS+ QE      5.74   # peak    655
 22 LYS+ QD     23 VAL  HN      6.88   # peak    656
 22 LYS+ QE     23 VAL  HN      6.88   # peak    664
 23 VAL  HN     23 VAL  HA      3.73   # peak    665
 23 VAL  HN     23 VAL  HB      3.19   # peak    673
 23 VAL  HN     23 VAL  QG1     5.23   # peak    679
 23 VAL  HN     23 VAL  QG2     3.86   # peak    685
 23 VAL  HA     23 VAL  HB      3.88   # peak    667
 23 VAL  HA     23 VAL  QG1     4.47   # peak    668
 23 VAL  HA     23 VAL  QG2     4.08   # peak    669
 23 VAL  HA     24 ALA  HN      4.78   # peak    670
 23 VAL  HA     26 GLU- HB2     3.95   # peak    671
 23 VAL  HA     26 GLU- HB3     3.77   # peak    672
 23 VAL  HA     27 ASN  HB2     6.00   # peak   2963
 23 VAL  HB     23 VAL  QG1     4.04   # peak    676
 23 VAL  HB     23 VAL  QG2     3.90   # peak    677
 23 VAL  HB     24 ALA  HN      3.52   # peak    678
 23 VAL  HB     52 PHE  QD      8.12   # peak   2921
 23 VAL  HB     52 PHE  QE      8.12   # peak   2922
 23 VAL  QG1    23 VAL  QG2     4.89   # peak    683
 23 VAL  QG1    24 ALA  HN      5.88   # peak    684
 23 VAL  QG1    27 ASN  HB3     6.38   # peak   2959
 23 VAL  QG1    27 ASN  HD21    4.87   # peak   2912
 23 VAL  QG1    27 ASN  HD22    4.80   # peak   2913
 23 VAL  QG1    52 PHE  QD      7.60   # peak   2916
 23 VAL  QG1    52 PHE  QE      7.31   # peak   2917
 23 VAL  QG2    24 ALA  HN      7.03   # peak    690
 23 VAL  QG2    52 PHE  QD      9.15   # peak   2914
 23 VAL  QG2    52 PHE  QE      9.15   # peak   2915
 24 ALA  HN     24 ALA  HA      3.73   # peak    691
 24 ALA  HN     24 ALA  QB      3.93   # peak    697
 24 ALA  HA     24 ALA  QB      3.79   # peak    693
 24 ALA  HA     25 GLN  HN      5.14   # peak    694
 24 ALA  HA     26 GLU- HN      4.52   # peak   2923
 24 ALA  HA     27 ASN  HB2     4.06   # peak    695
 24 ALA  HA     27 ASN  HB3     5.28   # peak    696
 24 ALA  HA     29 ILE  HB      3.95   # peak   2932
 24 ALA  HA     29 ILE  QG2     5.12   # peak   2981
 24 ALA  HA     29 ILE  QD1     5.08   # peak   2931
 24 ALA  HA     52 PHE  QD      8.12   # peak   2924
 24 ALA  HA     52 PHE  QE      8.12   # peak   2925
 24 ALA  QB     25 GLN  HN      4.22   # peak    700
 24 ALA  QB     26 GLU- HN      5.52   # peak   2918
 24 ALA  QB     29 ILE  HB      5.41   # peak   3390
 24 ALA  QB     29 ILE  QG2     6.47   # peak   2691
 24 ALA  QB     29 ILE  QD1     8.02   # peak   2929
 24 ALA  QB     32 PRO  HA      4.98   # peak   2945
 24 ALA  QB     32 PRO  HB2     5.62   # peak   2935
 24 ALA  QB     32 PRO  HB3     4.87   # peak   2941
 24 ALA  QB     32 PRO  HG2     4.47   # peak   2934
 24 ALA  QB     32 PRO  HG3     4.54   # peak   2938
 24 ALA  QB     32 PRO  HD3     6.20   # peak   2944
 24 ALA  QB     52 PHE  QD      8.21   # peak   2919
 24 ALA  QB     52 PHE  QE      8.47   # peak   2920
 25 GLN  HN     25 GLN  HA      3.55   # peak    701
 25 GLN  HN     25 GLN  QB      4.07   # peak    709
 25 GLN  HN     25 GLN  HG2     3.80   # peak    715
 25 GLN  HN     25 GLN  HG3     4.06   # peak    721
 25 GLN  HA     25 GLN  QB      3.89   # peak    703
 25 GLN  HA     25 GLN  HG2     3.52   # peak    704
 25 GLN  HA     25 GLN  HG3     4.06   # peak    705
 25 GLN  HA     26 GLU- HN      3.66   # peak    706
 25 GLN  HA     28 ASN  HN      3.84   # peak   2964
 25 GLN  QB     25 GLN  HG2     4.54   # peak    712
 25 GLN  QB     25 GLN  HG3     4.21   # peak    713
 25 GLN  QB     26 GLU- HN      4.72   # peak    714
 25 GLN  HG2    25 GLN  HG3     2.80   # peak    719
 25 GLN  HG2    26 GLU- HN      5.10   # peak    720
 25 GLN  HG3    26 GLU- HN      5.21   # peak    726
 26 GLU- HN     26 GLU- HA      3.98   # peak    727
 26 GLU- HN     26 GLU- HB2     3.62   # peak    735
 26 GLU- HN     26 GLU- HB3     3.91   # peak    742
 26 GLU- HN     26 GLU- HG2     4.81   # peak    749
 26 GLU- HN     26 GLU- HG3     4.78   # peak    756
 26 GLU- HA     26 GLU- HB2     3.41   # peak    729
 26 GLU- HA     26 GLU- HB3     3.66   # peak    730
 26 GLU- HA     26 GLU- HG2     4.34   # peak    731
 26 GLU- HA     26 GLU- HG3     4.81   # peak    732
 26 GLU- HA     27 ASN  HN      4.38   # peak    733
 26 GLU- HB2    26 GLU- HB3     2.58   # peak    738
 26 GLU- HB2    26 GLU- HG2     3.66   # peak    739
 26 GLU- HB2    26 GLU- HG3     3.70   # peak    740
 26 GLU- HB2    27 ASN  HN      4.16   # peak    741
 26 GLU- HB3    26 GLU- HG2     3.73   # peak    746
 26 GLU- HB3    26 GLU- HG3     4.31   # peak    747
 26 GLU- HB3    27 ASN  HN      4.52   # peak    748
 26 GLU- HG2    26 GLU- HG3     2.40   # peak    754
 27 ASN  HN     27 ASN  HA      3.55   # peak    763
 27 ASN  HN     27 ASN  HB2     3.44   # peak    768
 27 ASN  HN     27 ASN  HB3     3.62   # peak    773
 27 ASN  HN     29 ILE  QD1     7.03   # peak   3372
 27 ASN  HA     27 ASN  HB2     3.59   # peak    765
 27 ASN  HA     27 ASN  HB3     3.52   # peak    766
 27 ASN  HA     28 ASN  HN      4.16   # peak    767
 27 ASN  HB2    27 ASN  HB3     2.62   # peak    771
 27 ASN  HB2    27 ASN  HD21    4.96   # peak   2957
 27 ASN  HB2    28 ASN  HN      5.82   # peak    772
 27 ASN  HB2    29 ILE  HG13    6.00   # peak   2961
 27 ASN  HB2    29 ILE  QD1     6.70   # peak   2965
 27 ASN  HB3    27 ASN  HD21    5.14   # peak   2958
 27 ASN  HB3    28 ASN  HN      5.60   # peak    777
 27 ASN  HB3    29 ILE  QD1     5.91   # peak   2966
 28 ASN  HN     28 ASN  HA      2.69   # peak    778
 28 ASN  HN     28 ASN  HB2     3.77   # peak    783
 28 ASN  HN     28 ASN  HB3     3.77   # peak    788
 28 ASN  HA     28 ASN  HB2     3.05   # peak    780
 28 ASN  HA     28 ASN  HB3     2.90   # peak    781
 28 ASN  HA     29 ILE  HN      3.30   # peak    782
 28 ASN  HB2    28 ASN  HB3     2.40   # peak    786
 28 ASN  HB2    28 ASN  HD21    3.80   # peak   2967
 28 ASN  HB2    28 ASN  HD22    5.28   # peak   2969
 28 ASN  HB2    29 ILE  HN      5.14   # peak    787
 28 ASN  HB3    28 ASN  HD21    5.14   # peak   2968
 28 ASN  HB3    28 ASN  HD22    6.00   # peak   2970
 28 ASN  HB3    29 ILE  HN      5.60   # peak    792
 29 ILE  HN     29 ILE  HA      4.45   # peak    793
 29 ILE  HN     29 ILE  HB      3.12   # peak    801
 29 ILE  HN     29 ILE  QG2     5.62   # peak    809
 29 ILE  HN     29 ILE  HG12    4.34   # peak    817
 29 ILE  HN     29 ILE  HG13    4.16   # peak    825
 29 ILE  HN     29 ILE  QD1     5.88   # peak    833
 29 ILE  HA     29 ILE  HB      4.20   # peak    795
 29 ILE  HA     29 ILE  QG2     4.15   # peak    796
 29 ILE  HA     29 ILE  HG12    4.45   # peak    797
 29 ILE  HA     29 ILE  HG13    4.42   # peak    798
 29 ILE  HA     29 ILE  QD1     7.03   # peak    799
 29 ILE  HA     30 GLU- HN      2.94   # peak    800
 29 ILE  HB     29 ILE  QG2     3.93   # peak    804
 29 ILE  HB     29 ILE  HG12    4.78   # peak    805
 29 ILE  HB     29 ILE  HG13    4.96   # peak    806
 29 ILE  HB     29 ILE  QD1     4.76   # peak    807
 29 ILE  HB     30 GLU- HN      5.53   # peak    808
 29 ILE  HB     32 PRO  HG3     5.53   # peak   3020
 29 ILE  QG2    29 ILE  HG12    4.65   # peak    813
 29 ILE  QG2    29 ILE  HG13    4.29   # peak    814
 29 ILE  QG2    29 ILE  QD1     5.64   # peak    815
 29 ILE  QG2    30 GLU- HN      4.76   # peak    816
 29 ILE  QG2    31 ASN  HN      5.08   # peak   2971
 29 ILE  QG2    32 PRO  HA      4.51   # peak   2982
 29 ILE  QG2    32 PRO  HB2     5.08   # peak   2975
 29 ILE  QG2    32 PRO  HB3     5.62   # peak   2974
 29 ILE  QG2    32 PRO  HG2     6.45   # peak   2973
 29 ILE  QG2    32 PRO  HG3     6.74   # peak   2951
 29 ILE  QG2    33 ILE  HN      5.98   # peak   3392
 29 ILE  QG2    52 PHE  HB2     6.52   # peak   2976
 29 ILE  QG2    52 PHE  HB3     6.20   # peak   2977
 29 ILE  QG2    52 PHE  QD      9.15   # peak   2987
 29 ILE  QG2    52 PHE  QE      9.15   # peak   2988
 29 ILE  HG12   29 ILE  HG13    2.51   # peak    822
 29 ILE  HG12   29 ILE  QD1     4.26   # peak    823
 29 ILE  HG12   30 GLU- HN      6.00   # peak    824
 29 ILE  HG13   29 ILE  QD1     4.18   # peak    831
 29 ILE  HG13   30 GLU- HN      6.00   # peak    832
 29 ILE  QD1    30 GLU- HN      7.03   # peak    840
 29 ILE  QD1    32 PRO  HA      7.03   # peak   2986
 29 ILE  QD1    52 PHE  HB2     6.78   # peak   2894
 29 ILE  QD1    52 PHE  HB3     6.92   # peak   2895
 29 ILE  QD1    52 PHE  QD      9.15   # peak   2989
 29 ILE  QD1    52 PHE  QE      9.15   # peak   2990
 30 GLU- HN     30 GLU- HA      3.88   # peak    841
 30 GLU- HN     30 GLU- HB2     3.73   # peak    848
 30 GLU- HN     30 GLU- HB3     3.73   # peak    855
 30 GLU- HN     30 GLU- HG2     5.03   # peak    862
 30 GLU- HN     30 GLU- HG3     5.21   # peak    869
 30 GLU- HN     68 VAL  QG2     7.03   # peak   3025
 30 GLU- HA     30 GLU- HB2     3.34   # peak    843
 30 GLU- HA     30 GLU- HB3     3.66   # peak    844
 30 GLU- HA     30 GLU- HG2     5.24   # peak    845
 30 GLU- HA     30 GLU- HG3     5.35   # peak    846
 30 GLU- HA     31 ASN  HN      3.08   # peak    847
 30 GLU- HB2    30 GLU- HB3     2.87   # peak    851
 30 GLU- HB2    30 GLU- HG2     3.73   # peak    852
 30 GLU- HB2    30 GLU- HG3     3.88   # peak    853
 30 GLU- HB2    31 ASN  HN      4.31   # peak    854
 30 GLU- HB3    30 GLU- HG2     4.31   # peak    859
 30 GLU- HB3    30 GLU- HG3     4.20   # peak    860
 30 GLU- HB3    31 ASN  HN      4.31   # peak    861
 30 GLU- HG2    30 GLU- HG3     2.54   # peak    867
 31 ASN  HN     31 ASN  HB2     4.27   # peak    880
 31 ASN  HN     31 ASN  HB3     4.42   # peak    884
 31 ASN  HA     31 ASN  HB2     4.02   # peak    878
 31 ASN  HA     31 ASN  HB3     3.66   # peak    879
 31 ASN  HA     32 PRO  HD2     4.42   # peak   2947
 31 ASN  HA     32 PRO  HD3     4.02   # peak   2948
 31 ASN  HB2    31 ASN  HB3     2.40   # peak    883
 31 ASN  HB2    31 ASN  HD21    4.34   # peak   2997
 31 ASN  HB2    31 ASN  HD22    6.00   # peak   3000
 31 ASN  HB2    32 PRO  HD2     6.00   # peak   3001
 31 ASN  HB3    31 ASN  HD21    5.39   # peak   2998
 31 ASN  HB3    31 ASN  HD22    5.32   # peak   2999
 32 PRO  HA     32 PRO  HB2     3.48   # peak    905
 32 PRO  HA     32 PRO  HB3     4.06   # peak    906
 32 PRO  HA     32 PRO  HG2     5.10   # peak    907
 32 PRO  HA     32 PRO  HG3     5.24   # peak    908
 32 PRO  HA     32 PRO  HD2     6.00   # peak    888
 32 PRO  HA     32 PRO  HD3     5.82   # peak    896
 32 PRO  HA     33 ILE  HN      3.01   # peak    911
 32 PRO  HB2    32 PRO  HB3     3.26   # peak    914
 32 PRO  HB2    32 PRO  HG2     4.24   # peak    915
 32 PRO  HB2    32 PRO  HG3     3.88   # peak    916
 32 PRO  HB2    32 PRO  HD2     4.56   # peak    889
 32 PRO  HB2    32 PRO  HD3     5.21   # peak    897
 32 PRO  HB2    33 ILE  HN      3.91   # peak    919
 32 PRO  HB3    32 PRO  HG2     4.34   # peak    923
 32 PRO  HB3    32 PRO  HG3     4.49   # peak    924
 32 PRO  HB3    32 PRO  HD2     4.85   # peak    890
 32 PRO  HB3    32 PRO  HD3     4.63   # peak    898
 32 PRO  HB3    33 ILE  HN      5.10   # peak    927
 32 PRO  HG2    32 PRO  HG3     2.40   # peak    932
 32 PRO  HG2    32 PRO  HD2     5.03   # peak    891
 32 PRO  HG2    32 PRO  HD3     4.02   # peak    899
 32 PRO  HG2    68 VAL  QG1     5.19   # peak   3173
 32 PRO  HG2    68 VAL  QG2     4.83   # peak   3010
 32 PRO  HG3    32 PRO  HD2     3.84   # peak    892
 32 PRO  HG3    32 PRO  HD3     4.06   # peak    900
 32 PRO  HG3    68 VAL  HA      4.67   # peak   3022
 32 PRO  HG3    68 VAL  QG1     5.88   # peak   3016
 32 PRO  HG3    68 VAL  QG2     5.80   # peak   3011
 32 PRO  HG3    69 LYS+ HN      5.21   # peak   3024
 32 PRO  HD2    32 PRO  HD3     2.40   # peak    894
 32 PRO  HD2    33 ILE  HN      6.00   # peak    895
 32 PRO  HD2    68 VAL  QG2     5.73   # peak   3026
 32 PRO  HD3    33 ILE  HN      5.71   # peak    903
 33 ILE  HN     33 ILE  HA      4.63   # peak    944
 33 ILE  HN     33 ILE  HB      3.55   # peak    952
 33 ILE  HN     33 ILE  QG2     6.67   # peak    960
 33 ILE  HN     33 ILE  HG12    6.00   # peak    968
 33 ILE  HN     33 ILE  HG13    6.00   # peak    976
 33 ILE  HN     33 ILE  QD1     6.96   # peak    984
 33 ILE  HA     33 ILE  HB      4.31   # peak    946
 33 ILE  HA     33 ILE  QG2     4.47   # peak    947
 33 ILE  HA     33 ILE  HG12    6.00   # peak    948
 33 ILE  HA     33 ILE  HG13    6.00   # peak    949
 33 ILE  HA     33 ILE  QD1     6.67   # peak    950
 33 ILE  HA     34 LEU  HN      4.85   # peak    951
 33 ILE  HA     70 VAL  HA      6.00   # peak   3493
 33 ILE  HA     71 VAL  QG1     7.03   # peak   3199
 33 ILE  HA     71 VAL  QG2     7.03   # peak   3198
 33 ILE  HB     33 ILE  QG2     3.97   # peak    955
 33 ILE  HB     33 ILE  HG12    5.53   # peak    956
 33 ILE  HB     33 ILE  HG13    5.21   # peak    957
 33 ILE  HB     33 ILE  QD1     4.40   # peak    958
 33 ILE  HB     34 LEU  HN      6.00   # peak    959
 33 ILE  QG2    33 ILE  HG12    5.23   # peak    964
 33 ILE  QG2    33 ILE  HG13    5.01   # peak    965
 33 ILE  QG2    33 ILE  QD1     5.32   # peak    966
 33 ILE  QG2    34 LEU  HN      4.65   # peak    967
 33 ILE  QG2    35 ARG+ HN      5.91   # peak   3035
 33 ILE  QG2    52 PHE  HA      5.88   # peak   3033
 33 ILE  QG2    53 ASP- HN      6.67   # peak   3034
 33 ILE  QG2    53 ASP- HB2     7.03   # peak   3110
 33 ILE  QG2    69 LYS+ HB2     6.60   # peak   2708
 33 ILE  QG2    69 LYS+ HB3     5.95   # peak   2711
 33 ILE  QG2    69 LYS+ HG3     7.03   # peak   2714
 33 ILE  QG2    71 VAL  HB      6.31   # peak   3491
 33 ILE  QG2    71 VAL  QG1     6.18   # peak   3210
 33 ILE  QG2    71 VAL  QG2     6.22   # peak   3490
 33 ILE  HG12   33 ILE  HG13    3.19   # peak    973
 33 ILE  HG12   33 ILE  QD1     4.98   # peak    974
 33 ILE  HG12   34 LEU  HN      6.00   # peak    975
 33 ILE  HG13   33 ILE  QD1     4.58   # peak    982
 33 ILE  HG13   34 LEU  HN      6.00   # peak    983
 33 ILE  HG13   70 VAL  HA      5.75   # peak   3183
 33 ILE  QD1    34 LEU  HN      7.03   # peak    991
 33 ILE  QD1    53 ASP- HN      7.03   # peak   3055
 33 ILE  QD1    55 THR  HN      7.03   # peak   3054
 33 ILE  QD1    55 THR  HA      5.44   # peak   3051
 33 ILE  QD1    55 THR  QG2     6.90   # peak   3442
 33 ILE  QD1    56 VAL  HN      7.03   # peak   3053
 33 ILE  QD1    69 LYS+ HB2     6.13   # peak   2709
 33 ILE  QD1    69 LYS+ HB3     6.27   # peak   2710
 33 ILE  QD1    69 LYS+ HG3     6.88   # peak   2713
 34 LEU  HN     34 LEU  HA      4.31   # peak    992
 34 LEU  HN     34 LEU  HB2     4.24   # peak   1000
 34 LEU  HN     34 LEU  HB3     3.73   # peak   1008
 34 LEU  HN     34 LEU  HG      6.00   # peak   1016
 34 LEU  HN     34 LEU  QD1     7.03   # peak   1024
 34 LEU  HN     34 LEU  QD2     7.03   # peak   1032
 34 LEU  HN     70 VAL  HA      3.91   # peak   2716
 34 LEU  HN     70 VAL  QG2     6.67   # peak   2715
 34 LEU  HN     71 VAL  QG1     7.03   # peak   3192
 34 LEU  HN     71 VAL  QG2     7.03   # peak   3191
 34 LEU  HA     34 LEU  HB2     4.27   # peak    994
 34 LEU  HA     34 LEU  HB3     4.38   # peak    995
 34 LEU  HA     34 LEU  HG      4.27   # peak    996
 34 LEU  HA     34 LEU  QD1     4.47   # peak    997
 34 LEU  HA     34 LEU  QD2     6.27   # peak    998
 34 LEU  HA     35 ARG+ HN      3.41   # peak    999
 34 LEU  HA     52 PHE  HA      4.27   # peak   3106
 34 LEU  HB2    34 LEU  HB3     2.69   # peak   1003
 34 LEU  HB2    34 LEU  HG      3.41   # peak   1004
 34 LEU  HB2    34 LEU  QD1     4.15   # peak   1005
 34 LEU  HB2    34 LEU  QD2     4.26   # peak   1006
 34 LEU  HB2    35 ARG+ HN      5.24   # peak   1007
 34 LEU  HB2    70 VAL  HA      6.00   # peak   2881
 34 LEU  HB3    34 LEU  HG      3.70   # peak   1012
 34 LEU  HB3    34 LEU  QD1     4.87   # peak   1013
 34 LEU  HB3    34 LEU  QD2     5.05   # peak   1014
 34 LEU  HB3    35 ARG+ HN      5.17   # peak   1015
 34 LEU  HB3    70 VAL  HA      5.17   # peak   2882
 34 LEU  HG     34 LEU  QD1     3.93   # peak   1021
 34 LEU  HG     34 LEU  QD2     4.44   # peak   1022
 34 LEU  HG     35 ARG+ HN      5.42   # peak   1023
 34 LEU  QD1    34 LEU  QD2     5.93   # peak   1030
 34 LEU  QD1    35 ARG+ HN      5.26   # peak   1031
 34 LEU  QD1    50 MET  HA      7.03   # peak   2880
 34 LEU  QD1    50 MET  HB2     5.73   # peak   2892
 34 LEU  QD1    50 MET  HG2     6.38   # peak   2891
 34 LEU  QD1    50 MET  HG3     5.16   # peak   2887
 34 LEU  QD1    51 GLY  HN      5.62   # peak   2692
 34 LEU  QD1    51 GLY  HA1     7.03   # peak   3056
 34 LEU  QD1    52 PHE  HN      7.03   # peak   2886
 34 LEU  QD1    52 PHE  HA      5.70   # peak   2876
 34 LEU  QD1    52 PHE  QD      9.15   # peak   2883
 34 LEU  QD1    52 PHE  QE      9.15   # peak   2884
 34 LEU  QD1    53 ASP- HN      7.03   # peak   2885
 34 LEU  QD2    35 ARG+ HN      7.03   # peak   1039
 34 LEU  QD2    50 MET  HG2     7.03   # peak   2890
 34 LEU  QD2    50 MET  HG3     7.03   # peak   2888
 35 ARG+ HN     35 ARG+ HA      3.66   # peak   1040
 35 ARG+ HN     35 ARG+ HB2     4.45   # peak   1048
 35 ARG+ HN     35 ARG+ HB3     4.45   # peak   1056
 35 ARG+ HN     50 MET  HA      4.85   # peak   3437
 35 ARG+ HA     35 ARG+ HB2     4.20   # peak   1042
 35 ARG+ HA     35 ARG+ HB3     4.24   # peak   1043
 35 ARG+ HA     35 ARG+ HG2     6.00   # peak   1065
 35 ARG+ HA     35 ARG+ HG3     6.00   # peak   1073
 35 ARG+ HA     36 ILE  HN      3.59   # peak   1047
 35 ARG+ HA     71 VAL  QG1     5.98   # peak   3194
 35 ARG+ HA     71 VAL  QG2     5.05   # peak   3193
 35 ARG+ HB2    35 ARG+ HB3     4.45   # peak   1051
 35 ARG+ HB2    71 VAL  QG1     5.62   # peak   3206
 35 ARG+ HG2    35 ARG+ QD      6.88   # peak   1070
 35 ARG+ HG2    53 ASP- HB2     5.24   # peak   3107
 35 ARG+ HG3    35 ARG+ QD      5.62   # peak   1078
 36 ILE  HN     36 ILE  HB      3.88   # peak   1096
 36 ILE  HN     36 ILE  QG2     7.03   # peak   1104
 36 ILE  HN     36 ILE  HG12    6.00   # peak   1112
 36 ILE  HN     36 ILE  HG13    6.00   # peak   1120
 36 ILE  HN     36 ILE  QD1     6.85   # peak   1128
 36 ILE  HN     72 ILE  QD1     7.03   # peak   3215
 36 ILE  HA     36 ILE  HB      4.42   # peak   1090
 36 ILE  HA     36 ILE  QG2     4.22   # peak   1091
 36 ILE  HA     36 ILE  HG12    5.96   # peak   1092
 36 ILE  HA     36 ILE  HG13    5.32   # peak   1093
 36 ILE  HA     36 ILE  QD1     5.16   # peak   1094
 36 ILE  HB     36 ILE  QG2     4.29   # peak   1099
 36 ILE  HB     36 ILE  HG12    4.81   # peak   1100
 36 ILE  HB     36 ILE  HG13    4.34   # peak   1101
 36 ILE  HB     36 ILE  QD1     4.47   # peak   1102
 36 ILE  HB     37 ARG+ HN      6.00   # peak   1103
 36 ILE  HB     72 ILE  QD1     7.03   # peak   3408
 36 ILE  QG2    36 ILE  HG12    4.90   # peak   1108
 36 ILE  QG2    36 ILE  HG13    5.26   # peak   1109
 36 ILE  QG2    36 ILE  QD1     4.74   # peak   1110
 36 ILE  QG2    37 ARG+ HN      4.51   # peak   1111
 36 ILE  QG2    72 ILE  QD1     7.73   # peak   3260
 36 ILE  QG2    77 MET  QE      8.06   # peak   3283
 36 ILE  HG12   36 ILE  HG13    2.83   # peak   1117
 36 ILE  HG12   36 ILE  QD1     4.00   # peak   1118
 36 ILE  HG12   72 ILE  QD1     7.03   # peak   3407
 36 ILE  HG13   36 ILE  QD1     4.47   # peak   1126
 36 ILE  HG13   37 ARG+ HN      5.24   # peak   1127
 36 ILE  QD1    37 ARG+ HN      6.70   # peak   1135
 36 ILE  QD1    50 MET  HG2     5.55   # peak   3103
 36 ILE  QD1    72 ILE  QD1     7.66   # peak   3261
 37 ARG+ HN     37 ARG+ HA      4.49   # peak   1136
 37 ARG+ HN     37 ARG+ QB      4.86   # peak   1142
 37 ARG+ HN     37 ARG+ QG      6.88   # peak   1148
 37 ARG+ HN     72 ILE  QG2     6.56   # peak   3211
 37 ARG+ HA     37 ARG+ QB      5.90   # peak   1138
 37 ARG+ HA     37 ARG+ QG      5.51   # peak   1139
 37 ARG+ HA     37 ARG+ HD2     5.60   # peak   3411
 37 ARG+ HA     37 ARG+ HD3     3.70   # peak   3412
 37 ARG+ QB     37 ARG+ QG      7.54   # peak   1145
 37 ARG+ QB     37 ARG+ HD2     6.62   # peak   1146
 37 ARG+ QB     37 ARG+ HD3     5.98   # peak   1147
 37 ARG+ QB     49 ALA  QB      7.15   # peak   3097
 37 ARG+ QG     37 ARG+ HD2     5.98   # peak   1152
 37 ARG+ QG     37 ARG+ HD3     5.33   # peak   1153
 37 ARG+ HD2    37 ARG+ HD3     2.40   # peak   1159
 38 VAL  HA     38 VAL  QG1     4.80   # peak   1168
 38 VAL  HA     38 VAL  QG2     5.55   # peak   1169
 38 VAL  HA     39 VAL  HN      4.09   # peak   3076
 38 VAL  HB     38 VAL  QG1     4.51   # peak   1174
 38 VAL  HB     38 VAL  QG2     4.54   # peak   1175
 38 VAL  HB     39 VAL  HN      5.24   # peak   3078
 38 VAL  QG1    38 VAL  QG2     6.18   # peak   1181
 38 VAL  QG1    39 VAL  HN      5.26   # peak   3066
 38 VAL  QG1    46 PHE  HB2     7.03   # peak   3431
 38 VAL  QG1    46 PHE  HB3     7.03   # peak   3433
 38 VAL  QG1    47 GLN  HA      7.03   # peak   3434
 38 VAL  QG1    48 TYR  QD      8.30   # peak   3072
 38 VAL  QG1    48 TYR  QE      9.16   # peak   3071
 38 VAL  QG1    76 SER  HA      7.03   # peak   3415
 38 VAL  QG2    39 VAL  HN      5.88   # peak   3075
 38 VAL  QG2    48 TYR  QD      8.45   # peak   3074
 38 VAL  QG2    48 TYR  QE      9.16   # peak   3420
 38 VAL  QG2    76 SER  HA      6.06   # peak   3416
 38 VAL  QG2    76 SER  HB2     6.06   # peak   3417
 38 VAL  QG2    79 TYR  HB2     5.59   # peak   3418
 38 VAL  QG2    79 TYR  HB3     5.70   # peak   3414
 38 VAL  QG2    79 TYR  QD      9.17   # peak   3419
 38 VAL  QG2    79 TYR  QE      8.69   # peak   3073
 39 VAL  HN     39 VAL  HA      4.85   # peak   3070
 39 VAL  HN     39 VAL  HB      4.13   # peak   3069
 39 VAL  HN     39 VAL  QG1     7.03   # peak   3068
 39 VAL  HN     39 VAL  QG2     4.83   # peak   3067
 39 VAL  HA     39 VAL  HB      3.52   # peak   1203
 39 VAL  HA     39 VAL  QG1     4.83   # peak   1205
 39 VAL  HA     39 VAL  QG2     4.62   # peak   1204
 39 VAL  HA     40 PRO  QD      4.54   # peak   3085
 39 VAL  HB     39 VAL  QG1     4.15   # peak   1209
 39 VAL  HB     39 VAL  QG2     4.29   # peak   1208
 39 VAL  HB     40 PRO  QD      5.80   # peak   3080
 39 VAL  QG1    39 VAL  QG2     4.82   # peak   1213
 39 VAL  QG1    40 PRO  QD      7.15   # peak   3082
 39 VAL  QG1    49 ALA  QB      7.34   # peak   3099
 39 VAL  QG2    40 PRO  QD      7.90   # peak   3081
 39 VAL  QG2    49 ALA  HN      6.70   # peak   3079
 39 VAL  QG2    49 ALA  QB      6.69   # peak   3087
 40 PRO  HA     40 PRO  HB2     3.26   # peak   1235
 40 PRO  HA     40 PRO  HB3     3.23   # peak   1236
 40 PRO  HA     40 PRO  HG2     5.35   # peak   1237
 40 PRO  HA     40 PRO  HG3     6.00   # peak   1238
 40 PRO  HA     40 PRO  QD      6.88   # peak   1218
 40 PRO  HA     41 GLY  HN      3.44   # peak   1241
 40 PRO  HB2    40 PRO  HB3     2.80   # peak   1244
 40 PRO  HB2    40 PRO  HG2     3.23   # peak   1245
 40 PRO  HB2    40 PRO  HG3     2.94   # peak   1246
 40 PRO  HB2    40 PRO  QD      6.88   # peak   1219
 40 PRO  HB2    41 GLY  HN      5.42   # peak   1249
 40 PRO  HB3    40 PRO  HG2     3.73   # peak   1253
 40 PRO  HB3    40 PRO  QD      6.70   # peak   1220
 40 PRO  HB3    41 GLY  HN      5.39   # peak   1257
 40 PRO  HG2    40 PRO  HG3     2.98   # peak   1262
 40 PRO  HG2    40 PRO  QD      6.19   # peak   1221
 40 PRO  HG2    41 GLY  HN      6.00   # peak   1265
 40 PRO  HG3    40 PRO  QD      5.69   # peak   1222
 40 PRO  HG3    41 GLY  HN      6.00   # peak   1273
 41 GLY  HN     41 GLY  HA1     3.66   # peak   1274
 41 GLY  HN     41 GLY  HA2     3.73   # peak   1278
 41 GLY  HA1    41 GLY  HA2     2.51   # peak   1276
 41 GLY  HA1    42 GLY  HN      3.91   # peak   1277
 41 GLY  HA2    42 GLY  HN      3.73   # peak   1281
 42 GLY  HN     42 GLY  HA1     3.80   # peak   1282
 42 GLY  HN     42 GLY  HA2     3.91   # peak   1285
 42 GLY  HA1    42 GLY  HA2     2.58   # peak   1284
 43 CYS  HA     43 CYS  QB      4.25   # peak   1289
 43 CYS  HA     44 SER  HN      5.39   # peak   1290
 43 CYS  QB     44 SER  HN      6.66   # peak   1293
 43 CYS  QB     44 SER  HA      6.44   # peak   3064
 44 SER  HN     44 SER  HA      4.27   # peak   1294
 44 SER  HN     44 SER  HB3     5.10   # peak   1304
 44 SER  HA     44 SER  HB2     3.37   # peak   1296
 44 SER  HA     44 SER  HB3     3.41   # peak   1297
 44 SER  HA     45 GLY  HN      5.39   # peak   1298
 44 SER  HB2    45 GLY  HN      5.82   # peak   1303
 44 SER  HB3    45 GLY  HN      6.00   # peak   1308
 45 GLY  HN     45 GLY  HA1     3.62   # peak   1309
 45 GLY  HN     45 GLY  HA2     3.80   # peak   1313
 45 GLY  HA1    45 GLY  HA2     2.54   # peak   1311
 45 GLY  HA1    46 PHE  HN      3.66   # peak   1312
 45 GLY  HA2    46 PHE  HN      3.73   # peak   1316
 46 PHE  HN     46 PHE  HB2     5.93   # peak   1325
 46 PHE  HN     46 PHE  HB3     3.73   # peak   1333
 46 PHE  HA     46 PHE  HB2     4.13   # peak   1319
 46 PHE  HA     46 PHE  HB3     4.09   # peak   1320
 46 PHE  HB2    46 PHE  HB3     3.77   # peak   1328
 46 PHE  HB2    46 PHE  QD      8.12   # peak   1329
 46 PHE  HB2    47 GLN  HN      4.99   # peak   1332
 46 PHE  HB3    46 PHE  QD      8.12   # peak   1337
 46 PHE  HB3    47 GLN  HN      4.60   # peak   1340
 47 GLN  HN     47 GLN  HB2     4.45   # peak   1346
 47 GLN  HN     47 GLN  HB3     6.00   # peak   1351
 47 GLN  HN     47 GLN  QG      6.88   # peak   1356
 47 GLN  HA     47 GLN  HB2     3.55   # peak   1343
 47 GLN  HA     47 GLN  HB3     4.45   # peak   1344
 47 GLN  HA     47 GLN  QG      6.88   # peak   1345
 47 GLN  HB2    47 GLN  HB3     3.37   # peak   1349
 47 GLN  HB2    47 GLN  QG      4.50   # peak   1350
 47 GLN  HB2    87 TYR  HA      6.00   # peak   3435
 47 GLN  HB3    47 GLN  QG      4.46   # peak   1355
 48 TYR  HN     48 TYR  HA      4.88   # peak   3436
 48 TYR  HA     48 TYR  HB2     5.35   # peak   1362
 48 TYR  HA     48 TYR  HB3     4.78   # peak   1363
 48 TYR  HA     48 TYR  QD      8.10   # peak   1364
 48 TYR  HA     49 ALA  HN      3.34   # peak   1366
 48 TYR  HB2    48 TYR  HB3     3.80   # peak   1369
 48 TYR  HB2    48 TYR  QD      8.14   # peak   1370
 48 TYR  HB2    49 ALA  HN      6.00   # peak   1372
 48 TYR  HB3    48 TYR  QD      8.14   # peak   1376
 48 TYR  HB3    48 TYR  QE      8.13   # peak   1377
 48 TYR  HB3    49 ALA  HN      5.53   # peak   1378
 48 TYR  QD     80 VAL  QG1     8.30   # peak   3275
 48 TYR  QD     98 ILE  QG2     9.17   # peak   3360
 48 TYR  QE     80 VAL  QG1     7.72   # peak   3276
 49 ALA  HN     49 ALA  HA      4.52   # peak   1379
 49 ALA  HN     49 ALA  QB      4.44   # peak   1383
 49 ALA  HA     49 ALA  QB      3.82   # peak   1381
 49 ALA  HA     50 MET  HN      6.00   # peak   1382
 49 ALA  QB     50 MET  HN      5.05   # peak   1386
 49 ALA  QB     96 PHE  HA      7.03   # peak   3101
 50 MET  HN     50 MET  HA      5.57   # peak   1387
 50 MET  HN     50 MET  HB2     4.56   # peak   1394
 50 MET  HN     50 MET  HB3     5.35   # peak   1401
 50 MET  HN     50 MET  HG2     5.78   # peak   1408
 50 MET  HN     50 MET  HG3     6.00   # peak   1415
 50 MET  HA     50 MET  HB2     3.88   # peak   1389
 50 MET  HA     50 MET  HB3     4.45   # peak   1390
 50 MET  HA     50 MET  HG2     5.14   # peak   1391
 50 MET  HA     50 MET  HG3     5.68   # peak   1392
 50 MET  HA     51 GLY  HN      3.44   # peak   1393
 50 MET  HB2    50 MET  HB3     3.48   # peak   1397
 50 MET  HB2    50 MET  HG2     4.99   # peak   1398
 50 MET  HB2    50 MET  HG3     4.74   # peak   1399
 50 MET  HB2    51 GLY  HN      6.00   # peak   1400
 50 MET  HB3    50 MET  HG2     4.52   # peak   1411
 50 MET  HB3    50 MET  HG3     5.82   # peak   1418
 50 MET  HB3    51 GLY  HN      5.68   # peak   1407
 50 MET  HG2    50 MET  HG3     4.24   # peak   1413
 50 MET  HG2    51 GLY  HN      6.00   # peak   1414
 50 MET  HG3    51 GLY  HN      6.00   # peak   1421
 51 GLY  HN     51 GLY  HA1     3.91   # peak   1422
 51 GLY  HN     51 GLY  HA2     4.45   # peak   1426
 51 GLY  HA1    51 GLY  HA2     2.54   # peak   1424
 51 GLY  HA1    52 PHE  HN      3.70   # peak   1425
 51 GLY  HA2    52 PHE  HN      3.84   # peak   1429
 52 PHE  HN     52 PHE  HA      4.81   # peak   1430
 52 PHE  HN     52 PHE  HB2     3.70   # peak   1438
 52 PHE  HN     52 PHE  HB3     4.24   # peak   1446
 52 PHE  HA     52 PHE  HB2     3.95   # peak   1432
 52 PHE  HA     52 PHE  HB3     3.80   # peak   1433
 52 PHE  HA     52 PHE  QD      8.12   # peak   1434
 52 PHE  HA     53 ASP- HN      3.12   # peak   1437
 52 PHE  HB2    52 PHE  HB3     2.54   # peak   1441
 52 PHE  HB2    52 PHE  QD      6.86   # peak   1442
 52 PHE  HB2    52 PHE  QE      8.12   # peak   1443
 52 PHE  HB2    53 ASP- HN      4.63   # peak   1445
 52 PHE  HB3    52 PHE  QD      7.33   # peak   1450
 52 PHE  HB3    52 PHE  QE      8.12   # peak   1451
 52 PHE  HB3    53 ASP- HN      4.38   # peak   1453
 53 ASP- HN     53 ASP- HA      3.91   # peak   1454
 53 ASP- HN     53 ASP- HB2     4.85   # peak   1459
 53 ASP- HN     53 ASP- HB3     6.00   # peak   1464
 53 ASP- HA     53 ASP- HB2     3.59   # peak   1456
 53 ASP- HA     53 ASP- HB3     4.02   # peak   1457
 53 ASP- HA     54 ASP- HN      3.44   # peak   1458
 53 ASP- HB2    53 ASP- HB3     2.72   # peak   1462
 53 ASP- HB2    54 ASP- HN      4.78   # peak   1463
 53 ASP- HB3    54 ASP- HN      5.42   # peak   1468
 54 ASP- HN     54 ASP- HA      5.64   # peak   1469
 54 ASP- HN     54 ASP- HB2     4.74   # peak   1474
 54 ASP- HN     54 ASP- HB3     4.16   # peak   1479
 54 ASP- HA     54 ASP- HB2     4.42   # peak   1471
 54 ASP- HA     54 ASP- HB3     3.77   # peak   1472
 54 ASP- HA     55 THR  HN      4.67   # peak   1473
 54 ASP- HB2    54 ASP- HB3     2.40   # peak   1477
 54 ASP- HB2    55 THR  HN      6.00   # peak   1478
 54 ASP- HB3    55 THR  HN      5.24   # peak   1483
 55 THR  HN     55 THR  HA      4.70   # peak   1484
 55 THR  HN     55 THR  HB      3.98   # peak   1489
 55 THR  HN     55 THR  QG2     6.45   # peak   1494
 55 THR  HA     55 THR  HB      3.41   # peak   1486
 55 THR  HA     55 THR  QG2     4.51   # peak   1487
 55 THR  HA     56 VAL  HN      2.72   # peak   1488
 55 THR  HA     56 VAL  QG2     6.74   # peak   3117
 55 THR  HB     55 THR  QG2     4.18   # peak   1492
 55 THR  HB     56 VAL  HN      4.38   # peak   1493
 55 THR  QG2    56 VAL  HN      5.12   # peak   1498
 55 THR  QG2    57 GLU- HG2     6.56   # peak   3112
 55 THR  QG2    57 GLU- HG3     7.03   # peak   3113
 56 VAL  HN     56 VAL  HA      3.91   # peak   1499
 56 VAL  HN     56 VAL  HB      3.48   # peak   1505
 56 VAL  HN     56 VAL  QG1     6.74   # peak   1517
 56 VAL  HN     56 VAL  QG2     4.62   # peak   1511
 56 VAL  HA     56 VAL  HB      4.13   # peak   1501
 56 VAL  HA     56 VAL  QG1     4.54   # peak   1503
 56 VAL  HA     56 VAL  QG2     4.44   # peak   1502
 56 VAL  HA     57 GLU- HN      3.01   # peak   1504
 56 VAL  HB     56 VAL  QG1     3.97   # peak   1509
 56 VAL  HB     56 VAL  QG2     3.50   # peak   1508
 56 VAL  HB     57 GLU- HN      5.57   # peak   1510
 56 VAL  QG1    56 VAL  QG2     4.64   # peak   1515
 56 VAL  QG1    57 GLU- HN      4.90   # peak   1522
 56 VAL  QG1    57 GLU- HA      7.03   # peak   3446
 56 VAL  QG1    60 ASP- HN      6.67   # peak   3118
 56 VAL  QG1    60 ASP- HB3     5.95   # peak   3448
 56 VAL  QG2    57 GLU- HN      5.66   # peak   1516
 56 VAL  QG2    69 LYS+ QE      7.90   # peak   3116
 57 GLU- HN     57 GLU- HA      3.88   # peak   1523
 57 GLU- HN     57 GLU- HB2     3.66   # peak   1537
 57 GLU- HN     57 GLU- HB3     4.42   # peak   1530
 57 GLU- HN     57 GLU- HG2     5.10   # peak   1544
 57 GLU- HN     57 GLU- HG3     4.85   # peak   1551
 57 GLU- HN     60 ASP- HB2     4.56   # peak   3136
 57 GLU- HN     60 ASP- HB3     4.81   # peak   3137
 57 GLU- HA     57 GLU- HB2     3.48   # peak   1526
 57 GLU- HA     57 GLU- HB3     3.37   # peak   1525
 57 GLU- HA     57 GLU- HG2     3.66   # peak   1527
 57 GLU- HA     57 GLU- HG3     3.88   # peak   1528
 57 GLU- HA     58 GLU- HN      2.80   # peak   1529
 57 GLU- HA     58 GLU- HA      4.99   # peak   3123
 57 GLU- HA     58 GLU- HB2     5.32   # peak   3455
 57 GLU- HA     58 GLU- HB3     5.71   # peak   3456
 57 GLU- HB2    57 GLU- HB3     2.40   # peak   1533
 57 GLU- HB2    57 GLU- HG2     3.59   # peak   1541
 57 GLU- HB2    57 GLU- HG3     3.98   # peak   1542
 57 GLU- HB2    58 GLU- HN      3.73   # peak   1543
 57 GLU- HB2    59 GLY  HA1     5.24   # peak   3459
 57 GLU- HB3    57 GLU- HG2     3.26   # peak   1534
 57 GLU- HB3    57 GLU- HG3     2.58   # peak   1535
 57 GLU- HB3    58 GLU- HN      3.44   # peak   1536
 57 GLU- HG2    57 GLU- HG3     2.44   # peak   1549
 57 GLU- HG2    58 GLU- HN      5.50   # peak   1550
 57 GLU- HG3    58 GLU- HN      6.00   # peak   1557
 58 GLU- HN     58 GLU- HA      3.41   # peak   1558
 58 GLU- HN     58 GLU- HB2     2.80   # peak   1563
 58 GLU- HN     58 GLU- HB3     3.12   # peak   3457
 58 GLU- HN     58 GLU- QG      5.08   # peak   1568
 58 GLU- HA     58 GLU- HB2     2.94   # peak   1560
 58 GLU- HA     58 GLU- HB3     3.30   # peak   3449
 58 GLU- HA     58 GLU- QG      4.57   # peak   1561
 58 GLU- HA     59 GLY  HN      2.94   # peak   1562
 58 GLU- HB2    58 GLU- HB3     2.40   # peak   3450
 58 GLU- HB2    58 GLU- QG      3.28   # peak   1566
 58 GLU- HB2    59 GLY  HN      6.00   # peak   1567
 58 GLU- HB3    58 GLU- QG      4.25   # peak   3453
 58 GLU- HB3    59 GLY  HN      5.39   # peak   3458
 58 GLU- QG     59 GLY  HN      5.76   # peak   1572
 59 GLY  HN     59 GLY  HA1     3.26   # peak   1573
 59 GLY  HN     59 GLY  HA2     3.23   # peak   1577
 59 GLY  HA1    59 GLY  HA2     2.65   # peak   1575
 59 GLY  HA1    60 ASP- HN      4.20   # peak   1576
 59 GLY  HA2    60 ASP- HN      4.27   # peak   1580
 60 ASP- HN     60 ASP- HA      4.06   # peak   1581
 60 ASP- HN     60 ASP- HB2     3.41   # peak   1591
 60 ASP- HN     60 ASP- HB3     3.66   # peak   1586
 60 ASP- HA     60 ASP- HB2     3.77   # peak   1584
 60 ASP- HA     60 ASP- HB3     3.55   # peak   1583
 60 ASP- HA     61 HIS  HN      3.23   # peak   1585
 60 ASP- HA     71 VAL  QG2     6.16   # peak   3134
 60 ASP- HA     74 PRO  HD2     5.10   # peak   3460
 60 ASP- HA     74 PRO  HD3     5.35   # peak   3461
 60 ASP- HB2    60 ASP- HB3     2.80   # peak   1589
 60 ASP- HB2    61 HIS  HN      5.46   # peak   1595
 60 ASP- HB2    71 VAL  HB      6.00   # peak   3135
 60 ASP- HB2    71 VAL  QG1     5.37   # peak   3205
 60 ASP- HB2    71 VAL  QG2     5.08   # peak   3133
 60 ASP- HB3    61 HIS  HN      4.99   # peak   1590
 60 ASP- HB3    62 VAL  QG2     5.05   # peak   3144
 60 ASP- HB3    71 VAL  QG1     5.62   # peak   3203
 60 ASP- HB3    71 VAL  QG2     4.76   # peak   2693
 61 HIS  HN     61 HIS  HA      4.45   # peak   1596
 61 HIS  HN     61 HIS  HB2     4.16   # peak   1603
 61 HIS  HN     61 HIS  HB3     4.13   # peak   1610
 61 HIS  HA     61 HIS  HB2     3.98   # peak   1598
 61 HIS  HA     61 HIS  HB3     3.84   # peak   1599
 61 HIS  HA     61 HIS  HD2     5.24   # peak   1600
 61 HIS  HA     62 VAL  HN      2.98   # peak   1602
 61 HIS  HB2    61 HIS  HB3     2.80   # peak   1606
 61 HIS  HB2    61 HIS  HD2     3.98   # peak   1607
 61 HIS  HB2    62 VAL  HN      5.24   # peak   1609
 61 HIS  HB3    61 HIS  HD2     4.67   # peak   1614
 61 HIS  HB3    62 VAL  HN      4.49   # peak   1616
 62 VAL  HN     62 VAL  HB      6.00   # peak   1623
 62 VAL  HN     62 VAL  QG1     4.54   # peak   1635
 62 VAL  HN     62 VAL  QG2     4.26   # peak   1629
 62 VAL  HA     62 VAL  HB      4.24   # peak   1619
 62 VAL  HA     62 VAL  QG1     4.00   # peak   1621
 62 VAL  HA     62 VAL  QG2     3.72   # peak   1620
 62 VAL  HA     63 PHE  HN      3.62   # peak   1622
 62 VAL  HA     71 VAL  HA      3.91   # peak   3200
 62 VAL  HB     62 VAL  QG1     3.50   # peak   1627
 62 VAL  HB     62 VAL  QG2     3.43   # peak   1626
 62 VAL  HB     63 PHE  HN      6.00   # peak   1628
 62 VAL  QG1    62 VAL  QG2     4.46   # peak   1633
 62 VAL  QG1    63 PHE  HN      6.38   # peak   1640
 62 VAL  QG1    69 LYS+ QE      7.15   # peak   3141
 62 VAL  QG2    63 PHE  HN      4.98   # peak   1634
 62 VAL  QG2    63 PHE  QD      9.15   # peak   3139
 62 VAL  QG2    64 GLU- HN      7.03   # peak   3479
 62 VAL  QG2    64 GLU- HG2     6.34   # peak   3157
 62 VAL  QG2    64 GLU- HG3     5.73   # peak   3159
 62 VAL  QG2    69 LYS+ HG2     6.13   # peak   3465
 62 VAL  QG2    69 LYS+ HG3     4.11   # peak   3145
 62 VAL  QG2    70 VAL  HN      7.03   # peak   3147
 62 VAL  QG2    71 VAL  HA      6.02   # peak   3140
 63 PHE  HN     63 PHE  HA      3.66   # peak   1641
 63 PHE  HN     63 PHE  HB2     4.96   # peak   1649
 63 PHE  HN     63 PHE  HB3     4.92   # peak   1657
 63 PHE  HN     71 VAL  QG1     7.03   # peak   2717
 63 PHE  HA     63 PHE  HB2     4.24   # peak   1643
 63 PHE  HA     63 PHE  HB3     3.95   # peak   1644
 63 PHE  HA     63 PHE  QD      7.33   # peak   1645
 63 PHE  HA     63 PHE  QE      7.94   # peak   1646
 63 PHE  HA     64 GLU- HN      3.55   # peak   1648
 63 PHE  HA     64 GLU- HG2     5.75   # peak   3150
 63 PHE  HB2    63 PHE  HB3     2.87   # peak   1652
 63 PHE  HB2    63 PHE  QD      6.83   # peak   1653
 63 PHE  HB2    64 GLU- HN      6.00   # peak   1656
 63 PHE  HB2    65 TYR  QE      8.13   # peak   1654
 63 PHE  HB2    70 VAL  HB      3.95   # peak   3185
 63 PHE  HB2    70 VAL  QG1     6.24   # peak   3472
 63 PHE  HB2    70 VAL  QG2     7.03   # peak   3471
 63 PHE  HB3    63 PHE  QD      6.68   # peak   1661
 63 PHE  HB3    64 GLU- HN      4.81   # peak   1664
 63 PHE  HB3    65 TYR  QE      7.99   # peak   1662
 63 PHE  HB3    70 VAL  HB      4.70   # peak   3468
 63 PHE  HB3    70 VAL  QG2     7.03   # peak   3474
 63 PHE  QD     70 VAL  HB      8.12   # peak   3489
 63 PHE  QD     70 VAL  QG1     8.50   # peak   3188
 64 GLU- HN     64 GLU- HA      5.50   # peak   1665
 64 GLU- HN     64 GLU- HB2     3.26   # peak   1672
 64 GLU- HN     64 GLU- HB3     3.59   # peak   1679
 64 GLU- HN     64 GLU- HG2     4.42   # peak   1686
 64 GLU- HN     64 GLU- HG3     3.70   # peak   1693
 64 GLU- HA     64 GLU- HB2     3.48   # peak   1667
 64 GLU- HA     64 GLU- HB3     3.41   # peak   1668
 64 GLU- HA     64 GLU- HG2     4.16   # peak   1669
 64 GLU- HA     64 GLU- HG3     4.31   # peak   1670
 64 GLU- HA     65 TYR  HN      3.62   # peak   1671
 64 GLU- HA     69 LYS+ HA      3.88   # peak   3177
 64 GLU- HA     69 LYS+ HG3     6.00   # peak   3178
 64 GLU- HB2    64 GLU- HB3     2.40   # peak   1675
 64 GLU- HB2    64 GLU- HG2     3.05   # peak   1676
 64 GLU- HB2    64 GLU- HG3     3.05   # peak   1677
 64 GLU- HB2    65 TYR  HN      4.56   # peak   1678
 64 GLU- HB3    64 GLU- HG2     4.67   # peak   1683
 64 GLU- HB3    64 GLU- HG3     3.12   # peak   1684
 64 GLU- HB3    65 TYR  HN      3.98   # peak   1685
 64 GLU- HG2    64 GLU- HG3     2.40   # peak   1691
 64 GLU- HG2    65 TYR  HN      6.00   # peak   1692
 64 GLU- HG2    69 LYS+ HG2     6.00   # peak   3156
 64 GLU- HG2    69 LYS+ HG3     5.75   # peak   3155
 64 GLU- HG3    65 TYR  HN      6.00   # peak   1699
 64 GLU- HG3    69 LYS+ HG2     5.35   # peak   3158
 64 GLU- HG3    69 LYS+ HG3     6.00   # peak   3480
 65 TYR  HN     65 TYR  HA      3.62   # peak   1700
 65 TYR  HN     65 TYR  HB2     4.06   # peak   1707
 65 TYR  HN     65 TYR  HB3     3.73   # peak   1714
 65 TYR  HA     65 TYR  HB2     3.41   # peak   1702
 65 TYR  HA     65 TYR  HB3     3.19   # peak   1703
 65 TYR  HA     65 TYR  QD      7.38   # peak   1704
 65 TYR  HA     66 ASP- HN      3.73   # peak   1706
 65 TYR  HB2    65 TYR  HB3     2.54   # peak   1710
 65 TYR  HB2    65 TYR  QD      6.05   # peak   1711
 65 TYR  HB2    65 TYR  QE      8.13   # peak   1712
 65 TYR  HB2    66 ASP- HN      3.88   # peak   1713
 65 TYR  HB3    65 TYR  QD      6.34   # peak   1718
 65 TYR  HB3    65 TYR  QE      8.13   # peak   1719
 65 TYR  HB3    66 ASP- HN      4.09   # peak   1720
 65 TYR  QD     68 VAL  QG1     9.17   # peak   3170
 65 TYR  QD     70 VAL  QG2     8.12   # peak   3187
 65 TYR  QE     70 VAL  HB      8.13   # peak   3186
 65 TYR  QE     70 VAL  QG2     7.50   # peak   2833
 66 ASP- HN     66 ASP- HA      2.94   # peak   1721
 66 ASP- HN     66 ASP- HB2     3.16   # peak   1726
 66 ASP- HN     66 ASP- HB3     3.23   # peak   1731
 66 ASP- HA     66 ASP- HB2     3.05   # peak   1723
 66 ASP- HA     66 ASP- HB3     3.26   # peak   1724
 66 ASP- HA     67 GLY  HN      2.87   # peak   1725
 66 ASP- HB2    66 ASP- HB3     2.40   # peak   1729
 66 ASP- HB2    67 GLY  HN      5.06   # peak   1730
 66 ASP- HB3    67 GLY  HN      4.45   # peak   1735
 66 ASP- HB3    68 VAL  QG1     5.88   # peak   3172
 67 GLY  HN     67 GLY  HA1     2.94   # peak   1736
 67 GLY  HN     67 GLY  HA2     3.12   # peak   1740
 67 GLY  HA1    67 GLY  HA2     2.40   # peak   1738
 67 GLY  HA1    68 VAL  HN      4.24   # peak   1739
 67 GLY  HA2    68 VAL  HN      4.24   # peak   1743
 68 VAL  HN     68 VAL  HA      4.02   # peak   1744
 68 VAL  HN     68 VAL  HB      3.34   # peak   1750
 68 VAL  HN     68 VAL  QG1     5.52   # peak   1756
 68 VAL  HN     68 VAL  QG2     5.41   # peak   1762
 68 VAL  HA     68 VAL  HB      3.44   # peak   1746
 68 VAL  HA     68 VAL  QG1     4.58   # peak   1747
 68 VAL  HA     68 VAL  QG2     4.87   # peak   1748
 68 VAL  HA     69 LYS+ HN      2.98   # peak   1749
 68 VAL  HB     68 VAL  QG1     4.00   # peak   1753
 68 VAL  HB     68 VAL  QG2     4.18   # peak   1754
 68 VAL  HB     69 LYS+ HN      4.27   # peak   1755
 68 VAL  QG1    68 VAL  QG2     4.92   # peak   1760
 68 VAL  QG1    69 LYS+ HN      4.83   # peak   1761
 68 VAL  QG2    69 LYS+ HN      5.88   # peak   1767
 69 LYS+ HN     69 LYS+ HA      4.60   # peak   1768
 69 LYS+ HN     69 LYS+ HB2     3.73   # peak   1784
 69 LYS+ HN     69 LYS+ HB3     4.06   # peak   1776
 69 LYS+ HN     69 LYS+ HG3     5.39   # peak   1792
 69 LYS+ HN     69 LYS+ QD      6.88   # peak   1800
 69 LYS+ HA     69 LYS+ HB2     3.84   # peak   1771
 69 LYS+ HA     69 LYS+ HB3     3.91   # peak   1770
 69 LYS+ HA     69 LYS+ HG2     4.88   # peak   3397
 69 LYS+ HA     69 LYS+ HG3     4.67   # peak   1772
 69 LYS+ HA     69 LYS+ QD      6.88   # peak   1773
 69 LYS+ HA     69 LYS+ QE      6.88   # peak   1774
 69 LYS+ HA     70 VAL  HN      3.05   # peak   1775
 69 LYS+ HB2    69 LYS+ HB3     2.80   # peak   1779
 69 LYS+ HB2    69 LYS+ HG2     4.45   # peak   3375
 69 LYS+ HB2    69 LYS+ HG3     3.23   # peak   1788
 69 LYS+ HB2    69 LYS+ QD      6.88   # peak   1803
 69 LYS+ HB2    69 LYS+ QE      6.88   # peak   1790
 69 LYS+ HB2    70 VAL  HN      5.21   # peak   1791
 69 LYS+ HB3    69 LYS+ HG2     4.70   # peak   3181
 69 LYS+ HB3    69 LYS+ HG3     3.08   # peak   1780
 69 LYS+ HB3    69 LYS+ QD      5.36   # peak   1781
 69 LYS+ HB3    69 LYS+ QE      6.88   # peak   1782
 69 LYS+ HB3    70 VAL  HN      4.20   # peak   1783
 69 LYS+ HG2    69 LYS+ HG3     2.80   # peak   2712
 69 LYS+ HG2    69 LYS+ QD      6.48   # peak   3401
 69 LYS+ HG2    69 LYS+ QE      5.80   # peak   3402
 69 LYS+ HG3    69 LYS+ QD      4.75   # peak   1797
 69 LYS+ HG3    69 LYS+ QE      5.33   # peak   1798
 69 LYS+ QD     69 LYS+ QE      6.71   # peak   1806
 70 VAL  HN     70 VAL  HA      4.78   # peak   1816
 70 VAL  HN     70 VAL  HB      3.48   # peak   1822
 70 VAL  HN     70 VAL  QG1     5.23   # peak   1828
 70 VAL  HN     70 VAL  QG2     4.72   # peak   1834
 70 VAL  HA     70 VAL  HB      4.34   # peak   1818
 70 VAL  HA     70 VAL  QG1     4.65   # peak   1819
 70 VAL  HA     70 VAL  QG2     4.29   # peak   1820
 70 VAL  HA     71 VAL  HN      3.05   # peak   1821
 70 VAL  HB     70 VAL  QG1     4.18   # peak   1825
 70 VAL  HB     70 VAL  QG2     4.08   # peak   1826
 70 VAL  HB     71 VAL  HN      5.57   # peak   1827
 70 VAL  QG1    70 VAL  QG2     4.96   # peak   1832
 70 VAL  QG1    71 VAL  HN      4.69   # peak   1833
 70 VAL  QG2    71 VAL  HN      5.23   # peak   1839
 71 VAL  HN     71 VAL  HA      4.67   # peak   1840
 71 VAL  HN     71 VAL  HB      4.27   # peak   1846
 71 VAL  HN     71 VAL  QG1     5.16   # peak   1858
 71 VAL  HN     71 VAL  QG2     4.76   # peak   1852
 71 VAL  HA     71 VAL  HB      3.30   # peak   1842
 71 VAL  HA     71 VAL  QG1     4.94   # peak   1844
 71 VAL  HA     71 VAL  QG2     4.65   # peak   1843
 71 VAL  HA     72 ILE  HN      3.05   # peak   1845
 71 VAL  HB     71 VAL  QG1     3.86   # peak   1850
 71 VAL  HB     71 VAL  QG2     4.22   # peak   1849
 71 VAL  HB     72 ILE  HN      4.38   # peak   1851
 71 VAL  QG1    71 VAL  QG2     5.21   # peak   1856
 71 VAL  QG1    72 ILE  HN      5.91   # peak   1863
 71 VAL  QG2    72 ILE  HN      7.03   # peak   1857
 72 ILE  HN     72 ILE  HA      5.06   # peak   1864
 72 ILE  HN     72 ILE  HB      3.77   # peak   1871
 72 ILE  HN     72 ILE  QG2     5.80   # peak   1878
 72 ILE  HN     72 ILE  HG12    6.00   # peak   1885
 72 ILE  HN     72 ILE  HG13    6.00   # peak   1892
 72 ILE  HN     72 ILE  QD1     6.74   # peak   1899
 72 ILE  HA     72 ILE  HB      4.96   # peak   1866
 72 ILE  HA     72 ILE  QG2     4.65   # peak   1867
 72 ILE  HA     72 ILE  HG12    5.93   # peak   1886
 72 ILE  HA     72 ILE  HG13    6.00   # peak   1869
 72 ILE  HA     72 ILE  QD1     7.03   # peak   1870
 72 ILE  HB     72 ILE  QG2     4.72   # peak   1874
 72 ILE  HB     72 ILE  HG12    4.92   # peak   1875
 72 ILE  HB     72 ILE  HG13    4.31   # peak   1876
 72 ILE  HB     72 ILE  QD1     4.51   # peak   1877
 72 ILE  QG2    72 ILE  HG12    3.72   # peak   1882
 72 ILE  QG2    72 ILE  HG13    4.65   # peak   1883
 72 ILE  QG2    72 ILE  QD1     5.97   # peak   1884
 72 ILE  QG2    75 PHE  HN      7.03   # peak   3212
 72 ILE  QG2    76 SER  HB2     6.09   # peak   3223
 72 ILE  QG2    76 SER  HB3     5.55   # peak   3222
 72 ILE  QG2    77 MET  HN      5.88   # peak   3214
 72 ILE  QG2    77 MET  HA      4.94   # peak   2804
 72 ILE  QG2    77 MET  QE      7.08   # peak   3226
 72 ILE  HG12   72 ILE  HG13    3.16   # peak   1890
 72 ILE  HG12   72 ILE  QD1     3.57   # peak   1891
 72 ILE  HG13   72 ILE  QD1     3.90   # peak   1898
 72 ILE  QD1    77 MET  HA      7.03   # peak   3224
 72 ILE  QD1    77 MET  QE      6.54   # peak   3225
 72 ILE  QD1    80 VAL  QG2     6.00   # peak   3257
 73 ASP- HA     73 ASP- HB2     6.00   # peak   1907
 73 ASP- HA     73 ASP- HB3     6.00   # peak   1908
 74 PRO  HA     74 PRO  HB2     3.23   # peak   1932
 74 PRO  HA     74 PRO  HB3     3.08   # peak   1933
 74 PRO  HA     74 PRO  HG2     6.00   # peak   1934
 74 PRO  HA     74 PRO  HG3     6.00   # peak   1935
 74 PRO  HA     74 PRO  HD2     6.00   # peak   1915
 74 PRO  HA     74 PRO  HD3     5.17   # peak   1923
 74 PRO  HA     75 PHE  HN      4.67   # peak   1938
 74 PRO  HB2    74 PRO  HB3     2.40   # peak   1942
 74 PRO  HB2    74 PRO  HG2     2.94   # peak   1943
 74 PRO  HB2    74 PRO  HG3     3.37   # peak   1944
 74 PRO  HB2    74 PRO  HD2     4.27   # peak   1945
 74 PRO  HB2    74 PRO  HD3     5.39   # peak   1924
 74 PRO  HB2    75 PHE  HN      3.41   # peak   1947
 74 PRO  HB3    74 PRO  HG2     3.77   # peak   1951
 74 PRO  HB3    74 PRO  HG3     4.67   # peak   1952
 74 PRO  HB3    74 PRO  HD2     4.13   # peak   1917
 74 PRO  HB3    74 PRO  HD3     5.24   # peak   1954
 74 PRO  HG2    74 PRO  HG3     4.99   # peak   1967
 74 PRO  HG2    74 PRO  HD2     4.16   # peak   1961
 74 PRO  HG2    74 PRO  HD3     4.92   # peak   1926
 74 PRO  HG2    75 PHE  HN      6.00   # peak   1963
 74 PRO  HG3    74 PRO  HD2     4.60   # peak   1969
 74 PRO  HG3    74 PRO  HD3     4.99   # peak   1927
 74 PRO  HG3    75 PHE  HN      6.00   # peak   1971
 74 PRO  HD2    74 PRO  HD3     3.55   # peak   1921
 74 PRO  HD3    75 PHE  HN      5.78   # peak   1930
 75 PHE  HN     75 PHE  HA      4.06   # peak   1972
 75 PHE  HN     75 PHE  HB2     3.95   # peak   1982
 75 PHE  HN     75 PHE  HB3     4.27   # peak   1990
 75 PHE  HA     75 PHE  HB2     3.52   # peak   1974
 75 PHE  HA     75 PHE  HB3     3.41   # peak   1975
 75 PHE  HA     75 PHE  QD      7.15   # peak   1976
 75 PHE  HA     76 SER  HN      4.56   # peak   1979
 75 PHE  HA     78 PRO  HB2     5.71   # peak   1980
 75 PHE  HB2    75 PHE  HB3     2.47   # peak   1985
 75 PHE  HB2    75 PHE  QD      6.90   # peak   1986
 75 PHE  HB2    76 SER  HN      4.78   # peak   1989
 75 PHE  HB3    75 PHE  QD      6.93   # peak   1994
 75 PHE  HB3    75 PHE  QE      8.12   # peak   1995
 75 PHE  HB3    76 SER  HN      4.96   # peak   1997
 76 SER  HN     76 SER  HA      4.88   # peak   1998
 76 SER  HN     76 SER  HB2     5.50   # peak   2005
 76 SER  HN     76 SER  HB3     5.03   # peak   2010
 76 SER  HA     76 SER  HB2     3.55   # peak   2000
 76 SER  HA     76 SER  HB3     6.00   # peak   2001
 76 SER  HB2    76 SER  HB3     3.88   # peak   2008
 77 MET  HN     77 MET  HA      5.06   # peak   2015
 77 MET  HA     77 MET  HG2     5.14   # peak   2018
 77 MET  HA     77 MET  QE      4.58   # peak   3245
 77 MET  HA     80 VAL  QG2     4.47   # peak   2720
 77 MET  QB     77 MET  HG2     6.88   # peak   2024
 77 MET  QB     77 MET  HG3     6.88   # peak   2025
 77 MET  HG2    77 MET  HG3     5.68   # peak   2034
 77 MET  HG3    77 MET  QE      5.08   # peak   3286
 77 MET  QE     80 VAL  QG1     7.91   # peak   3254
 77 MET  QE     80 VAL  QG2     5.82   # peak   3258
 77 MET  QE     81 ASN  HA      3.93   # peak   3239
 77 MET  QE     81 ASN  HB2     4.80   # peak   3250
 77 MET  QE     82 GLY  HN      5.19   # peak   3246
 77 MET  QE     83 ALA  HN      6.99   # peak   3248
 78 PRO  HA     78 PRO  HB2     3.34   # peak   2051
 78 PRO  HA     78 PRO  HB3     2.94   # peak   2052
 78 PRO  HA     78 PRO  QG      5.08   # peak   2053
 78 PRO  HA     78 PRO  HD2     4.42   # peak   2036
 78 PRO  HA     78 PRO  HD3     6.00   # peak   2043
 78 PRO  HA     79 TYR  HN      5.78   # peak   2056
 78 PRO  HB2    78 PRO  HB3     2.40   # peak   2061
 78 PRO  HB2    78 PRO  QG      4.72   # peak   2062
 78 PRO  HB2    78 PRO  HD2     5.14   # peak   2037
 78 PRO  HB2    78 PRO  HD3     5.42   # peak   2044
 78 PRO  HB2    79 TYR  HN      5.53   # peak   2065
 78 PRO  HB3    78 PRO  QG      4.54   # peak   2069
 78 PRO  HB3    78 PRO  HD2     6.00   # peak   2038
 78 PRO  HB3    78 PRO  HD3     6.00   # peak   2045
 78 PRO  HB3    79 TYR  HN      5.17   # peak   2072
 78 PRO  QG     78 PRO  HD2     4.39   # peak   2039
 78 PRO  QG     78 PRO  HD3     4.72   # peak   2046
 78 PRO  QG     79 TYR  HN      6.88   # peak   2079
 78 PRO  HD2    78 PRO  HD3     2.76   # peak   2041
 78 PRO  HD2    79 TYR  HN      5.89   # peak   2042
 78 PRO  HD3    79 TYR  HN      6.00   # peak   2049
 79 TYR  HN     79 TYR  HA      4.34   # peak   2080
 79 TYR  HN     79 TYR  HB2     5.50   # peak   2087
 79 TYR  HN     79 TYR  HB3     3.91   # peak   2094
 79 TYR  HA     79 TYR  HB2     3.98   # peak   2082
 79 TYR  HA     79 TYR  HB3     3.70   # peak   2083
 79 TYR  HA     79 TYR  QD      7.10   # peak   2084
 79 TYR  HA     80 VAL  HN      6.00   # peak   2086
 79 TYR  HB2    79 TYR  HB3     3.01   # peak   2090
 79 TYR  HB2    79 TYR  QD      7.17   # peak   2091
 79 TYR  HB2    80 VAL  HN      6.00   # peak   2093
 79 TYR  HB3    79 TYR  QD      7.06   # peak   2098
 79 TYR  HB3    80 VAL  HN      5.39   # peak   2100
 80 VAL  HN     80 VAL  HA      4.27   # peak   2101
 80 VAL  HN     80 VAL  HB      5.93   # peak   2108
 80 VAL  HN     80 VAL  QG1     6.02   # peak   2120
 80 VAL  HN     80 VAL  QG2     4.29   # peak   2114
 80 VAL  HA     80 VAL  HB      3.30   # peak   2103
 80 VAL  HA     80 VAL  QG1     4.90   # peak   2105
 80 VAL  HA     80 VAL  QG2     5.12   # peak   2104
 80 VAL  HA     81 ASN  HN      4.60   # peak   2106
 80 VAL  HA     83 ALA  QB      6.24   # peak   2107
 80 VAL  HB     80 VAL  QG1     4.36   # peak   2112
 80 VAL  HB     80 VAL  QG2     4.15   # peak   2111
 80 VAL  HB     81 ASN  HN      6.00   # peak   2113
 80 VAL  HB     83 ALA  QB      4.87   # peak   2755
 80 VAL  QG1    80 VAL  QG2     5.03   # peak   2118
 80 VAL  QG1    81 ASN  HN      7.03   # peak   2125
 80 VAL  QG1    83 ALA  QB      8.06   # peak   3496
 80 VAL  QG2    81 ASN  HN      5.48   # peak   2119
 80 VAL  QG2    83 ALA  QB      7.66   # peak   2723
 81 ASN  HN     81 ASN  HA      3.88   # peak   2126
 81 ASN  HN     81 ASN  HB2     5.21   # peak   2132
 81 ASN  HN     81 ASN  HB3     4.92   # peak   2137
 81 ASN  HA     81 ASN  HB2     4.96   # peak   2128
 81 ASN  HA     81 ASN  HB3     4.02   # peak   2129
 81 ASN  HB2    81 ASN  HB3     3.08   # peak   2135
 81 ASN  HB2    82 GLY  HN      6.00   # peak   2136
 81 ASN  HB3    82 GLY  HN      6.00   # peak   2141
 82 GLY  HN     82 GLY  HA1     3.30   # peak   2142
 82 GLY  HN     82 GLY  HA2     3.26   # peak   2146
 82 GLY  HA1    82 GLY  HA2     2.47   # peak   2144
 82 GLY  HA1    83 ALA  HN      4.09   # peak   2145
 82 GLY  HA2    83 ALA  HN      3.73   # peak   2149
 83 ALA  HN     83 ALA  HA      4.42   # peak   2150
 83 ALA  HN     83 ALA  QB      4.04   # peak   2154
 83 ALA  HA     83 ALA  QB      3.79   # peak   2152
 83 ALA  HA     84 GLU- HN      3.16   # peak   2153
 83 ALA  HA    100 ASN  HA      4.63   # peak   3498
 83 ALA  HA    101 PRO  HD2     4.24   # peak   3289
 83 ALA  HA    101 PRO  HD3     5.46   # peak   3290
 83 ALA  QB     84 GLU- HN      4.40   # peak   2157
 83 ALA  QB     99 ARG+ HN      7.03   # peak   3391
 83 ALA  QB    100 ASN  HA      4.94   # peak   2721
 83 ALA  QB    100 ASN  HB2     6.24   # peak   2754
 83 ALA  QB    101 PRO  HD2     5.84   # peak   2756
 83 ALA  QB    101 PRO  HD3     6.74   # peak   2757
 84 GLU- HN     84 GLU- HA      3.73   # peak   2158
 84 GLU- HN     84 GLU- QB      5.58   # peak   2164
 84 GLU- HN     84 GLU- HG2     6.00   # peak   2170
 84 GLU- HN     84 GLU- HG3     5.10   # peak   2176
 84 GLU- HA     84 GLU- QB      5.04   # peak   2165
 84 GLU- HA     84 GLU- HG2     5.21   # peak   2171
 84 GLU- HA     84 GLU- HG3     5.06   # peak   2177
 84 GLU- HA     85 LEU  HN      5.42   # peak   2163
 84 GLU- QB     84 GLU- HG2     4.93   # peak   2167
 84 GLU- QB     84 GLU- HG3     5.47   # peak   2168
 84 GLU- QB     85 LEU  HN      6.77   # peak   2169
 84 GLU- HG2    84 GLU- HG3     2.94   # peak   2174
 84 GLU- HG2    85 LEU  HN      6.00   # peak   2175
 84 GLU- HG3    85 LEU  HN      5.17   # peak   2181
 85 LEU  HN     85 LEU  HA      4.67   # peak   2182
 85 LEU  HN     85 LEU  HB2     3.73   # peak   2190
 85 LEU  HN     85 LEU  HB3     4.02   # peak   2198
 85 LEU  HN     85 LEU  HG      6.00   # peak   2206
 85 LEU  HN     85 LEU  QD1     6.02   # peak   2222
 85 LEU  HN     85 LEU  QD2     7.03   # peak   2214
 85 LEU  HA     85 LEU  HB2     4.60   # peak   2184
 85 LEU  HA     85 LEU  HB3     4.78   # peak   2185
 85 LEU  HA     85 LEU  HG      4.78   # peak   2186
 85 LEU  HA     85 LEU  QD1     4.33   # peak   2188
 85 LEU  HA     85 LEU  QD2     7.03   # peak   2187
 85 LEU  HA     86 ASP- HN      3.91   # peak   2189
 85 LEU  HB2    85 LEU  HB3     3.08   # peak   2193
 85 LEU  HB2    85 LEU  HG      4.85   # peak   2194
 85 LEU  HB2    85 LEU  QD1     4.04   # peak   2196
 85 LEU  HB2    85 LEU  QD2     5.55   # peak   2195
 85 LEU  HB2    86 ASP- HN      5.21   # peak   2197
 85 LEU  HB3    85 LEU  HG      4.20   # peak   2202
 85 LEU  HB3    85 LEU  QD1     5.80   # peak   2204
 85 LEU  HB3    85 LEU  QD2     4.72   # peak   2203
 85 LEU  HB3    86 ASP- HN      4.81   # peak   2205
 85 LEU  HG     85 LEU  QD1     4.18   # peak   2212
 85 LEU  HG     85 LEU  QD2     4.98   # peak   2211
 85 LEU  HG     86 ASP- HN      6.00   # peak   2213
 85 LEU  QD1    85 LEU  QD2     5.54   # peak   2220
 85 LEU  QD1    86 ASP- HN      4.76   # peak   2229
 85 LEU  QD1    96 PHE  HA      6.60   # peak   3303
 85 LEU  QD1    96 PHE  QB      6.03   # peak   3302
 85 LEU  QD1    96 PHE  QD      9.04   # peak   3304
 85 LEU  QD1    97 THR  HN      5.77   # peak   3307
 85 LEU  QD1    98 ILE  HB      6.67   # peak   3356
 85 LEU  QD1    98 ILE  HG12    6.81   # peak   3365
 85 LEU  QD1    98 ILE  HG13    6.27   # peak   3364
 85 LEU  QD1    98 ILE  QD1     6.58   # peak   3297
 85 LEU  QD2    86 ASP- HN      7.03   # peak   2221
 85 LEU  QD2    98 ILE  QD1     6.90   # peak   2725
 86 ASP- HN     86 ASP- HA      4.56   # peak   2230
 86 ASP- HN     86 ASP- HB2     5.06   # peak   2235
 86 ASP- HN     86 ASP- HB3     4.92   # peak   2240
 86 ASP- HN     97 THR  QG2     6.38   # peak   3346
 86 ASP- HA     86 ASP- HB2     4.20   # peak   2232
 86 ASP- HA     86 ASP- HB3     3.88   # peak   2233
 86 ASP- HA     87 TYR  HN      3.26   # peak   2234
 86 ASP- HB2    86 ASP- HB3     3.66   # peak   2238
 86 ASP- HB2    87 TYR  HN      5.10   # peak   2239
 86 ASP- HB2    88 VAL  QG2     7.03   # peak   3320
 86 ASP- HB2    97 THR  QG2     6.09   # peak   3311
 86 ASP- HB3    87 TYR  HN      5.06   # peak   2244
 86 ASP- HB3    88 VAL  QG2     7.03   # peak   3319
 86 ASP- HB3    97 THR  QG2     6.52   # peak   3312
 87 TYR  HN     87 TYR  HA      3.80   # peak   2245
 87 TYR  HN     87 TYR  HB2     4.78   # peak   2252
 87 TYR  HN     87 TYR  HB3     4.92   # peak   2259
 87 TYR  HA     87 TYR  HB2     4.45   # peak   2247
 87 TYR  HA     87 TYR  HB3     4.70   # peak   2248
 87 TYR  HA     87 TYR  QD      8.14   # peak   2249
 87 TYR  HA     88 VAL  HN      3.12   # peak   2251
 87 TYR  HA     88 VAL  QG2     7.03   # peak   3321
 87 TYR  HA     96 PHE  HA      3.44   # peak   3314
 87 TYR  HB2    87 TYR  HB3     3.91   # peak   2255
 87 TYR  HB2    87 TYR  QD      7.13   # peak   2256
 87 TYR  HB2    87 TYR  QE      8.13   # peak   2257
 87 TYR  HB2    88 VAL  HN      6.00   # peak   2258
 87 TYR  HB3    87 TYR  QD      6.66   # peak   2263
 87 TYR  HB3    87 TYR  QE      8.13   # peak   2264
 87 TYR  HB3    88 VAL  HN      6.00   # peak   2265
 87 TYR  QD     89 VAL  QG2     8.81   # peak   3169
 87 TYR  QE     89 VAL  QG2     7.83   # peak   3168
 87 TYR  QE     94 GLY  HA1     8.13   # peak   3340
 87 TYR  QE     94 GLY  HA2     7.84   # peak   3338
 87 TYR  QE     95 GLY  HA1     8.13   # peak   3339
 87 TYR  QE     95 GLY  HA2     7.52   # peak   2897
 88 VAL  HN     88 VAL  HA      4.27   # peak   2266
 88 VAL  HN     88 VAL  HB      3.44   # peak   2272
 88 VAL  HN     88 VAL  QG1     6.24   # peak   2278
 88 VAL  HN     88 VAL  QG2     4.72   # peak   2284
 88 VAL  HN     96 PHE  HA      6.00   # peak   3494
 88 VAL  HA     88 VAL  HB      3.30   # peak   2268
 88 VAL  HA     88 VAL  QG1     4.18   # peak   2269
 88 VAL  HA     88 VAL  QG2     4.22   # peak   2270
 88 VAL  HA     89 VAL  HN      2.62   # peak   2271
 88 VAL  HB     88 VAL  QG1     3.82   # peak   2275
 88 VAL  HB     88 VAL  QG2     4.00   # peak   2276
 88 VAL  HB     89 VAL  HN      3.95   # peak   2277
 88 VAL  HB     95 GLY  HA2     6.00   # peak   2896
 88 VAL  QG1    88 VAL  QG2     4.49   # peak   2282
 88 VAL  QG1    89 VAL  HN      4.72   # peak   2283
 88 VAL  QG1    90 ASP- HB2     7.03   # peak   3316
 88 VAL  QG1    90 ASP- HB3     6.49   # peak   3317
 88 VAL  QG1    91 PHE  QB      7.90   # peak   3318
 88 VAL  QG2    89 VAL  HN      5.52   # peak   2289
 88 VAL  QG2    95 GLY  HN      7.03   # peak   3325
 88 VAL  QG2    96 PHE  HN      6.96   # peak   3323
 89 VAL  HN     89 VAL  HA      4.67   # peak   2290
 89 VAL  HN     89 VAL  HB      3.30   # peak   2296
 89 VAL  HN     89 VAL  QG1     5.41   # peak   2308
 89 VAL  HN     89 VAL  QG2     4.36   # peak   2302
 89 VAL  HA     89 VAL  HB      3.19   # peak   2292
 89 VAL  HA     89 VAL  QG1     4.65   # peak   2294
 89 VAL  HA     89 VAL  QG2     4.22   # peak   2293
 89 VAL  HA     90 ASP- HN      2.87   # peak   2295
 89 VAL  HB     89 VAL  QG1     3.72   # peak   2300
 89 VAL  HB     89 VAL  QG2     3.68   # peak   2299
 89 VAL  HB     90 ASP- HN      4.92   # peak   2301
 89 VAL  HB     94 GLY  HA1     4.56   # peak   3337
 89 VAL  QG1    89 VAL  QG2     4.67   # peak   2306
 89 VAL  QG1    90 ASP- HN      5.05   # peak   2313
 89 VAL  QG1    93 GLY  HN      7.03   # peak   3329
 89 VAL  QG1    93 GLY  HA1     7.03   # peak   3334
 89 VAL  QG1    93 GLY  HA2     6.13   # peak   3333
 89 VAL  QG1    94 GLY  HA2     7.03   # peak   3505
 89 VAL  QG2    90 ASP- HN      5.12   # peak   2307
 89 VAL  QG2    94 GLY  HA1     6.45   # peak   3328
 89 VAL  QG2    94 GLY  HA2     5.73   # peak   3174
 90 ASP- HN     90 ASP- HA      3.84   # peak   2314
 90 ASP- HN     90 ASP- HB2     4.34   # peak   2319
 90 ASP- HN     90 ASP- HB3     4.02   # peak   2324
 90 ASP- HA     90 ASP- HB2     3.08   # peak   2316
 90 ASP- HA     90 ASP- HB3     3.19   # peak   2317
 90 ASP- HA     91 PHE  HN      3.44   # peak   2318
 90 ASP- HB2    90 ASP- HB3     2.40   # peak   2322
 90 ASP- HB2    91 PHE  HN      3.77   # peak   2323
 90 ASP- HB3    91 PHE  HN      3.34   # peak   2328
 91 PHE  HN     91 PHE  HA      4.20   # peak   2329
 91 PHE  HN     91 PHE  QB      4.82   # peak   2336
 91 PHE  HA     91 PHE  QB      4.14   # peak   2331
 91 PHE  HA     91 PHE  QD      8.12   # peak   2332
 91 PHE  HA     92 MET  HN      3.44   # peak   2335
 91 PHE  QB     91 PHE  QD      9.00   # peak   2339
 91 PHE  QB     92 MET  HN      6.30   # peak   2342
 91 PHE  QB     93 GLY  HN      5.83   # peak   3331
 92 MET  HN     92 MET  HA      3.66   # peak   2343
 92 MET  HN     92 MET  HB2     3.91   # peak   2349
 92 MET  HN     92 MET  HB3     3.73   # peak   2355
 92 MET  HN     92 MET  QG      6.08   # peak   2361
 92 MET  HA     92 MET  HB2     3.80   # peak   2345
 92 MET  HA     92 MET  HB3     3.23   # peak   2346
 92 MET  HA     92 MET  QG      5.72   # peak   2347
 92 MET  HA     93 GLY  HN      3.62   # peak   2348
 92 MET  HB2    92 MET  HB3     2.40   # peak   2352
 92 MET  HB2    92 MET  QG      5.04   # peak   2353
 92 MET  HB2    93 GLY  HN      6.00   # peak   2354
 92 MET  HB3    92 MET  QG      4.39   # peak   2359
 92 MET  HB3    93 GLY  HN      5.28   # peak   2360
 92 MET  QG     93 GLY  HN      6.88   # peak   2366
 93 GLY  HN     93 GLY  HA1     3.23   # peak   2367
 93 GLY  HN     93 GLY  HA2     3.12   # peak   2371
 93 GLY  HA1    93 GLY  HA2     2.40   # peak   2369
 93 GLY  HA1    94 GLY  HN      3.30   # peak   2370
 93 GLY  HA2    94 GLY  HN      3.34   # peak   2374
 94 GLY  HN     94 GLY  HA1     3.80   # peak   2375
 94 GLY  HA1    94 GLY  HA2     2.65   # peak   2377
 94 GLY  HA1    95 GLY  HN      3.66   # peak   2378
 94 GLY  HA2    95 GLY  HN      4.02   # peak   2382
 95 GLY  HN     95 GLY  HA1     3.62   # peak   2383
 95 GLY  HN     95 GLY  HA2     3.95   # peak   2386
 95 GLY  HA1    95 GLY  HA2     2.69   # peak   2385
 95 GLY  HA1    96 PHE  HN      3.48   # peak   3341
 95 GLY  HA2    96 PHE  HN      3.23   # peak   2726
 96 PHE  HN     96 PHE  HA      4.63   # peak   2727
 96 PHE  HN     96 PHE  QB      4.72   # peak   2728
 96 PHE  HA     96 PHE  QB      5.22   # peak   2390
 96 PHE  HA     97 THR  HN      3.48   # peak   2394
 96 PHE  QB     96 PHE  QD      8.35   # peak   2397
 96 PHE  QB     97 THR  HN      5.26   # peak   2400
 97 THR  HN     97 THR  HA      6.00   # peak   2401
 97 THR  HN     97 THR  HB      4.96   # peak   2405
 97 THR  HN     97 THR  QG2     5.77   # peak   2409
 97 THR  HA     97 THR  HB      3.77   # peak   2403
 97 THR  HA     97 THR  QG2     6.63   # peak   2404
 97 THR  HB     97 THR  QG2     4.51   # peak   2408
 98 ILE  HN     98 ILE  HB      4.02   # peak   3353
 98 ILE  HN     98 ILE  QG2     6.85   # peak   3362
 98 ILE  HA     98 ILE  HB      4.31   # peak   2414
 98 ILE  HA     98 ILE  QG2     6.96   # peak   2415
 98 ILE  HA     98 ILE  HG12    4.02   # peak   2416
 98 ILE  HA     98 ILE  HG13    3.98   # peak   2417
 98 ILE  HA     98 ILE  QD1     6.38   # peak   2418
 98 ILE  HA     99 ARG+ HN      3.44   # peak   3352
 98 ILE  HB     98 ILE  QG2     5.41   # peak   2421
 98 ILE  HB     98 ILE  HG12    4.74   # peak   2422
 98 ILE  HB     98 ILE  HG13    4.99   # peak   2423
 98 ILE  HB     98 ILE  QD1     5.55   # peak   2424
 98 ILE  HB     99 ARG+ HN      4.78   # peak   3354
 98 ILE  QG2    98 ILE  HG12    5.12   # peak   2428
 98 ILE  QG2    98 ILE  HG13    5.70   # peak   2429
 98 ILE  QG2    98 ILE  QD1     5.72   # peak   2430
 98 ILE  QG2    99 ARG+ HN      5.70   # peak   3363
 98 ILE  QG2   100 ASN  HB2     6.06   # peak   3357
 98 ILE  HG12   98 ILE  HG13    2.58   # peak   2435
 98 ILE  HG12   98 ILE  QD1     4.36   # peak   2436
 98 ILE  HG13   98 ILE  QD1     4.69   # peak   2442
 99 ARG+ HN     99 ARG+ HB2     4.09   # peak   3366
 99 ARG+ HN     99 ARG+ HB3     5.24   # peak   3367
 99 ARG+ HA     99 ARG+ HB2     4.42   # peak   2450
 99 ARG+ HA     99 ARG+ HB3     4.16   # peak   2451
 99 ARG+ HA     99 ARG+ HG2     6.00   # peak   2452
 99 ARG+ HA     99 ARG+ HG3     6.00   # peak   2453
 99 ARG+ HB2    99 ARG+ HB3     2.83   # peak   2458
 99 ARG+ HB2    99 ARG+ HG2     4.16   # peak   2459
 99 ARG+ HB2    99 ARG+ HG3     4.31   # peak   2460
 99 ARG+ HB2    99 ARG+ HD2     5.96   # peak   2461
 99 ARG+ HB2    99 ARG+ HD3     6.00   # peak   2462
 99 ARG+ HB3    99 ARG+ HG2     4.92   # peak   2466
 99 ARG+ HB3    99 ARG+ HG3     4.78   # peak   2467
 99 ARG+ HB3    99 ARG+ HD2     5.46   # peak   2468
 99 ARG+ HB3    99 ARG+ HD3     5.28   # peak   2469
 99 ARG+ HG2    99 ARG+ HD2     4.81   # peak   2475
 99 ARG+ HG2    99 ARG+ HD3     5.03   # peak   2476
 99 ARG+ HG3    99 ARG+ HD2     4.99   # peak   2482
 99 ARG+ HG3    99 ARG+ HD3     4.81   # peak   2483
 99 ARG+ HD2    99 ARG+ HD3     3.01   # peak   2490
100 ASN  HA    100 ASN  HB2     4.42   # peak   2499
100 ASN  HA    100 ASN  HB3     4.70   # peak   2500
100 ASN  HA    101 PRO  HD2     3.80   # peak   3061
100 ASN  HA    101 PRO  HD3     3.62   # peak   3293
100 ASN  HB2   100 ASN  HB3     3.12   # peak   2503
101 PRO  HA    101 PRO  HB2     3.19   # peak   2522
101 PRO  HA    101 PRO  HB3     3.01   # peak   2523
101 PRO  HA    101 PRO  QG      6.05   # peak   2524
101 PRO  HA    101 PRO  HD2     5.75   # peak   2525
101 PRO  HA    101 PRO  HD3     6.00   # peak   2526
101 PRO  HB2   101 PRO  HB3     2.47   # peak   2530
101 PRO  HB2   101 PRO  QG      5.00   # peak   2543
101 PRO  HB2   101 PRO  HD2     4.85   # peak   2508
101 PRO  HB2   101 PRO  HD3     4.34   # peak   2515
101 PRO  HB3   101 PRO  QG      4.68   # peak   2538
101 PRO  HB3   101 PRO  HD2     5.10   # peak   2509
101 PRO  HB3   101 PRO  HD3     5.53   # peak   2540
101 PRO  QG    101 PRO  HD2     5.40   # peak   2510
101 PRO  QG    101 PRO  HD3     6.01   # peak   2517
101 PRO  HD2   101 PRO  HD3     2.98   # peak   2512
  3 GLU- HA      4 GLN  HN      2.76   # peak      1
  8 PHE  HA      8 PHE  QD      7.55   # peak      2
  8 PHE  QB      8 PHE  QD      6.91   # peak    353
  8 PHE  QD      8 PHE  QE      8.73   # peak      6
 10 PHE  HA     10 PHE  QD      7.47   # peak    157
 10 PHE  HA     10 PHE  QE      8.12   # peak    228
 10 PHE  HB2    10 PHE  QD      5.71   # peak    159
 10 PHE  HB2    10 PHE  QE      6.03   # peak    230
 10 PHE  HB3    10 PHE  QD      7.04   # peak    158
 10 PHE  QD     10 PHE  QE      7.18   # peak    156
 10 PHE  QD     12 VAL  QG2     7.31   # peak    161
 10 PHE  QD     70 VAL  QG1     7.31   # peak    160
 10 PHE  QD     72 ILE  QD1     8.57   # peak    162
 10 PHE  QE     12 VAL  QG2     7.57   # peak    233
 10 PHE  QE     70 VAL  QG1     7.67   # peak    231
 10 PHE  QE     70 VAL  QG2     8.72   # peak    232
 10 PHE  QE     98 ILE  QD1     8.47   # peak    358
 12 VAL  QG1    65 TYR  QD      7.58   # peak    357
 12 VAL  QG1    65 TYR  QE      7.76   # peak    281
 12 VAL  QG2    65 TYR  QD      9.17   # peak    202
 12 VAL  QG2    65 TYR  QE      7.11   # peak    292
 23 VAL  QG1    52 PHE  QE      8.29   # peak    269
 29 ILE  QG2    52 PHE  QD      8.61   # peak    237
 38 VAL  QG2    48 TYR  QD      9.17   # peak    341
 38 VAL  QG2    48 TYR  QE      6.86   # peak    235
 46 PHE  HB2    46 PHE  QD      7.83   # peak    204
 46 PHE  HB3    46 PHE  QD      7.04   # peak    203
 46 PHE  QD     46 PHE  QE      7.08   # peak    207
 48 TYR  HA     48 TYR  QD      7.42   # peak    216
 48 TYR  QB     48 TYR  QD      9.02   # peak    343
 48 TYR  QD     48 TYR  QE      6.67   # peak     43
 52 PHE  HN     52 PHE  QD      5.49   # peak    239
 52 PHE  HA     52 PHE  QD      6.36   # peak    166
 52 PHE  HB2    52 PHE  QD      7.29   # peak    164
 52 PHE  HB3    52 PHE  QD      6.79   # peak    165
 52 PHE  QD     52 PHE  QE      6.97   # peak    240
 52 PHE  QD     53 ASP- HN      6.86   # peak    349
 61 HIS  HA     61 HIS  HD2     5.17   # peak     57
 61 HIS  HA     61 HIS  HE1     4.88   # peak    342
 61 HIS  HB2    61 HIS  HD2     6.00   # peak     58
 61 HIS  HB3    61 HIS  HD2     6.00   # peak     59
 61 HIS  HD2    61 HIS  HE1     6.00   # peak     62
 63 PHE  HN     63 PHE  QD      7.08   # peak    245
 63 PHE  HA     63 PHE  QD      5.89   # peak    241
 63 PHE  HB2    63 PHE  QD      6.39   # peak    246
 63 PHE  HB2    65 TYR  QE      7.34   # peak    277
 63 PHE  HB3    63 PHE  QD      6.36   # peak    188
 63 PHE  HB3    65 TYR  QE      7.56   # peak    276
 63 PHE  QD     65 TYR  HN      7.47   # peak    344
 63 PHE  QD     70 VAL  QG1     8.32   # peak    248
 63 PHE  QD     72 ILE  HG13    7.91   # peak    247
 63 PHE  QD     72 ILE  QD1     9.15   # peak    348
 65 TYR  HN     65 TYR  QD      6.52   # peak    196
 65 TYR  HA     65 TYR  QD      6.56   # peak    190
 65 TYR  HB2    65 TYR  QD      6.05   # peak    198
 65 TYR  HB3    65 TYR  QD      6.12   # peak    197
 65 TYR  QD     65 TYR  QE      6.67   # peak     81
 65 TYR  QD     68 VAL  QG1     6.97   # peak    201
 65 TYR  QD     70 VAL  QG2     8.16   # peak    200
 65 TYR  QE     68 VAL  QG1     7.86   # peak    280
 65 TYR  QE     70 VAL  HB      7.52   # peak    278
 65 TYR  QE     70 VAL  QG2     7.04   # peak    279
 75 PHE  HA     75 PHE  QD      7.76   # peak    252
 75 PHE  HA     75 PHE  QE      6.83   # peak    257
 75 PHE  HB2    75 PHE  QD      6.61   # peak    250
 75 PHE  HB3    75 PHE  QD      6.32   # peak    251
 79 TYR  HA     79 TYR  QD      5.76   # peak    181
 79 TYR  HB2    79 TYR  QD      6.88   # peak    185
 79 TYR  HB2    79 TYR  QE      7.30   # peak    259
 79 TYR  HB3    79 TYR  QD      6.16   # peak    184
 79 TYR  QD     79 TYR  QE      6.82   # peak    100
 85 LEU  QD1    96 PHE  QD      7.67   # peak    323
 87 TYR  HA     87 TYR  QD      7.06   # peak    175
 87 TYR  HB2    87 TYR  QD      6.52   # peak    176
 87 TYR  HB2    87 TYR  QE      7.63   # peak    221
 87 TYR  HB3    87 TYR  QD      6.02   # peak    177
 87 TYR  QD     87 TYR  QE      6.85   # peak    171
 87 TYR  QD     97 THR  HA      8.07   # peak    174
 87 TYR  QE     95 GLY  HA1     8.13   # peak    347
 87 TYR  QE     95 GLY  HA2     7.45   # peak    220
 91 PHE  HA     91 PHE  QD      6.79   # peak    109
 91 PHE  QB     91 PHE  QD      7.52   # peak    111
 96 PHE  HN     96 PHE  QD      7.69   # peak    322
 96 PHE  HA     96 PHE  QD      7.55   # peak    272
 96 PHE  QB     96 PHE  QD      8.28   # peak    320
  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1 -12.217  -0.029  20.875
    2   1HB   MET   1          1HB       MET   1 -14.238  -0.548  23.101
    3   2HB   MET   1          2HB       MET   1 -13.875  -1.813  21.944
    4   1HG   MET   1          1HG       MET   1 -11.472  -1.721  22.534
    5   2HG   MET   1          2HG       MET   1 -11.757  -0.364  23.606
    6   1HE   MET   1          1HE       MET   1 -12.993  -1.758  26.785
    7   2HE   MET   1          2HE       MET   1 -12.169  -0.478  25.864
    8   3HE   MET   1          3HE       MET   1 -13.913  -0.752  25.641
    9    H    GLN   2           H        GLN   2 -12.928  -0.254  18.803
   10    HA   GLN   2           HA       GLN   2 -15.404  -1.059  18.103
   11   1HB   GLN   2          1HB       GLN   2 -15.489   1.721  18.811
   12   2HB   GLN   2          2HB       GLN   2 -15.682   1.627  17.072
   13   1HG   GLN   2          1HG       GLN   2 -17.579   0.123  17.270
   14   2HG   GLN   2          2HG       GLN   2 -17.279  -0.137  18.977
   15   1HE2  GLN   2          1HE2      GLN   2 -17.260   1.872  20.347
   16   2HE2  GLN   2          2HE2      GLN   2 -18.487   3.060  20.058
   17    H    GLU   3           H        GLU   3 -15.841  -0.549  15.604
   18    HA   GLU   3           HA       GLU   3 -13.426  -1.195  14.322
   19   1HB   GLU   3          1HB       GLU   3 -14.889  -1.029  12.225
   20   2HB   GLU   3          2HB       GLU   3 -15.416  -2.173  13.443
   21   1HG   GLU   3          1HG       GLU   3 -17.223  -0.827  14.133
   22   2HG   GLU   3          2HG       GLU   3 -16.470   0.656  13.582
   23    H    GLN   4           H        GLN   4 -12.199   0.019  12.775
   24    HA   GLN   4           HA       GLN   4 -12.607   2.881  13.085
   25   1HB   GLN   4          1HB       GLN   4 -10.318   1.286  13.379
   26   2HB   GLN   4          2HB       GLN   4 -10.088   2.042  11.815
   27   1HG   GLN   4          1HG       GLN   4  -9.278   3.802  13.035
   28   2HG   GLN   4          2HG       GLN   4 -10.969   4.204  13.258
   29   1HE2  GLN   4          1HE2      GLN   4 -12.084   3.150  15.104
   30   2HE2  GLN   4          2HE2      GLN   4 -11.228   2.975  16.599
   31    H    ALA   5           H        ALA   5 -14.336   2.933  11.461
   32    HA   ALA   5           HA       ALA   5 -13.825   2.013   8.822
   33   1HB   ALA   5          1HB       ALA   5 -15.881   4.111   9.424
   34   2HB   ALA   5          2HB       ALA   5 -16.010   2.639   8.432
   35   3HB   ALA   5          3HB       ALA   5 -16.058   2.522  10.207
   36    H    GLN   6           H        GLN   6 -12.849   3.041   7.127
   37    HA   GLN   6           HA       GLN   6 -12.803   5.806   6.876
   38   1HB   GLN   6          1HB       GLN   6 -11.186   5.713   8.748
   39   2HB   GLN   6          2HB       GLN   6 -10.192   4.575   7.861
   40   1HG   GLN   6          1HG       GLN   6  -9.191   6.241   6.684
   41   2HG   GLN   6          2HG       GLN   6 -10.736   6.913   6.201
   42   1HE2  GLN   6          1HE2      GLN   6 -11.357   8.781   7.005
   43   2HE2  GLN   6          2HE2      GLN   6 -10.659   9.613   8.355
   44    H    GLN   7           H        GLN   7 -12.578   6.194   4.702
   45    HA   GLN   7           HA       GLN   7 -11.172   4.127   3.196
   46   1HB   GLN   7          1HB       GLN   7 -13.854   4.569   3.028
   47   2HB   GLN   7          2HB       GLN   7 -13.305   5.724   1.830
   48   1HG   GLN   7          1HG       GLN   7 -12.731   4.086   0.347
   49   2HG   GLN   7          2HG       GLN   7 -11.911   3.140   1.574
   50   1HE2  GLN   7          1HE2      GLN   7 -13.592   2.188  -0.525
   51   2HE2  GLN   7          2HE2      GLN   7 -14.946   1.370   0.179
   52    H    PHE   8           H        PHE   8  -9.187   5.095   2.826
   53    HA   PHE   8           HA       PHE   8  -9.021   7.899   2.308
   54   1HB   PHE   8          1HB       PHE   8  -7.143   6.923   3.427
   55   2HB   PHE   8          2HB       PHE   8  -7.229   5.451   2.480
   56    HD1  PHE   8           1HD      PHE   8  -7.130   8.922   1.170
   57    HD2  PHE   8           2HD      PHE   8  -5.024   5.276   1.698
   58    HE1  PHE   8           1HE      PHE   8  -5.292   9.769  -0.314
   59    HE2  PHE   8           2HE      PHE   8  -3.186   6.123   0.214
   60    HZ   PHE   8           HZ       PHE   8  -3.342   8.359  -0.775
   61    H    ILE   9           H        ILE   9  -8.975   8.948   0.359
   62    HA   ILE   9           HA       ILE   9  -9.581   7.429  -1.975
   63    HB   ILE   9           HB       ILE   9  -8.928  10.362  -1.682
   64   1HG1  ILE   9          1HG1      ILE   9 -10.773   9.571  -0.181
   65   2HG1  ILE   9          2HG1      ILE   9 -11.242  10.789  -1.350
   66   1HG2  ILE   9          1HG2      ILE   9 -10.544  10.378  -3.734
   67   2HG2  ILE   9          2HG2      ILE   9  -8.823   9.980  -3.953
   68   3HG2  ILE   9          3HG2      ILE   9 -10.038   8.680  -3.904
   69   1HD1  ILE   9          1HD1      ILE   9 -12.881   9.396  -2.054
   70   2HD1  ILE   9          2HD1      ILE   9 -11.620   8.305  -2.677
   71   3HD1  ILE   9          3HD1      ILE   9 -12.256   8.081  -1.029
   72    H    PHE  10           H        PHE  10  -8.080   6.244  -3.026
   73    HA   PHE  10           HA       PHE  10  -5.658   7.551  -3.838
   74   1HB   PHE  10          1HB       PHE  10  -5.454   6.399  -1.435
   75   2HB   PHE  10          2HB       PHE  10  -5.508   4.892  -2.328
   76    HD1  PHE  10           1HD      PHE  10  -3.363   4.021  -2.079
   77    HD2  PHE  10           2HD      PHE  10  -3.813   8.070  -3.265
   78    HE1  PHE  10           1HE      PHE  10  -0.891   4.175  -2.490
   79    HE2  PHE  10           2HE      PHE  10  -1.342   8.225  -3.676
   80    HZ   PHE  10           HZ       PHE  10   0.090   6.275  -3.284
   81    H    LYS  11           H        LYS  11  -4.609   6.448  -5.604
   82    HA   LYS  11           HA       LYS  11  -6.006   4.061  -6.552
   83   1HB   LYS  11          1HB       LYS  11  -5.481   6.532  -8.231
   84   2HB   LYS  11          2HB       LYS  11  -6.084   5.002  -8.834
   85   1HG   LYS  11          1HG       LYS  11  -7.529   6.353  -6.541
   86   2HG   LYS  11          2HG       LYS  11  -7.774   6.949  -8.171
   87   1HD   LYS  11          1HD       LYS  11  -8.663   4.852  -8.931
   88   2HD   LYS  11          2HD       LYS  11  -8.047   3.987  -7.538
   89   1HE   LYS  11          1HE       LYS  11  -9.693   4.905  -6.075
   90   2HE   LYS  11          2HE       LYS  11 -10.053   6.234  -7.159
   91   1HZ   LYS  11          1HZ       LYS  11 -11.445   3.967  -7.021
   92   2HZ   LYS  11          2HZ       LYS  11 -11.457   4.975  -8.305
   93   3HZ   LYS  11          3HZ       LYS  11 -10.491   3.658  -8.310
   94    H    VAL  12           H        VAL  12  -4.468   2.513  -6.573
   95    HA   VAL  12           HA       VAL  12  -1.785   3.345  -7.441
   96    HB   VAL  12           HB       VAL  12  -2.350   2.417  -5.039
   97   1HG1  VAL  12          1HG1      VAL  12  -1.954  -0.042  -4.922
   98   2HG1  VAL  12          2HG1      VAL  12  -3.486   0.391  -5.718
   99   3HG1  VAL  12          3HG1      VAL  12  -2.087  -0.114  -6.695
  100   1HG2  VAL  12          1HG2      VAL  12  -0.114   3.025  -5.873
  101   2HG2  VAL  12          2HG2      VAL  12  -0.066   1.547  -4.882
  102   3HG2  VAL  12          3HG2      VAL  12   0.026   1.432  -6.656
  103    H    THR  13           H        THR  13  -0.729   2.114  -9.036
  104    HA   THR  13           HA       THR  13  -2.405   0.876 -10.919
  105    HB   THR  13           HB       THR  13  -0.275   0.481 -12.086
  106    HG1  THR  13           1HG      THR  13   0.942   1.300  -9.558
  107   1HG2  THR  13          1HG2      THR  13  -0.804   3.046 -10.731
  108   2HG2  THR  13          2HG2      THR  13   0.937   2.782 -10.992
  109   3HG2  THR  13          3HG2      THR  13  -0.184   2.754 -12.374
  110    H    ASP  14           H        ASP  14  -1.594  -1.422 -11.840
  111    HA   ASP  14           HA       ASP  14  -2.394  -3.196  -9.772
  112   1HB   ASP  14          1HB       ASP  14  -2.244  -3.174 -12.677
  113   2HB   ASP  14          2HB       ASP  14  -1.488  -4.638 -12.080
  114    H    LYS  15           H        LYS  15   0.578  -2.097 -11.336
  115    HA   LYS  15           HA       LYS  15   2.180  -4.349 -10.807
  116   1HB   LYS  15          1HB       LYS  15   2.438  -1.944 -12.177
  117   2HB   LYS  15          2HB       LYS  15   3.577  -1.778 -10.857
  118   1HG   LYS  15          1HG       LYS  15   4.769  -2.846 -12.664
  119   2HG   LYS  15          2HG       LYS  15   4.497  -4.078 -11.447
  120   1HD   LYS  15          1HD       LYS  15   2.425  -4.804 -12.733
  121   2HD   LYS  15          2HD       LYS  15   2.855  -3.660 -13.989
  122   1HE   LYS  15          1HE       LYS  15   4.863  -4.845 -14.551
  123   2HE   LYS  15          2HE       LYS  15   4.854  -5.751 -13.051
  124   1HZ   LYS  15          1HZ       LYS  15   2.851  -6.016 -15.185
  125   2HZ   LYS  15          2HZ       LYS  15   4.072  -7.062 -14.899
  126   3HZ   LYS  15          3HZ       LYS  15   2.879  -6.879 -13.799
  127    H    ALA  16           H        ALA  16   1.595  -1.252  -9.020
  128    HA   ALA  16           HA       ALA  16   3.357  -1.673  -6.954
  129   1HB   ALA  16          1HB       ALA  16   2.337   0.160  -6.038
  130   2HB   ALA  16          2HB       ALA  16   1.595   0.259  -7.653
  131   3HB   ALA  16          3HB       ALA  16   0.699  -0.483  -6.305
  132    H    VAL  17           H        VAL  17  -0.178  -2.533  -7.060
  133    HA   VAL  17           HA       VAL  17  -0.236  -3.843  -4.632
  134    HB   VAL  17           HB       VAL  17  -1.841  -3.844  -7.138
  135   1HG1  VAL  17          1HG1      VAL  17  -1.973  -5.998  -5.030
  136   2HG1  VAL  17          2HG1      VAL  17  -3.430  -5.495  -5.920
  137   3HG1  VAL  17          3HG1      VAL  17  -2.030  -6.149  -6.803
  138   1HG2  VAL  17          1HG2      VAL  17  -3.127  -3.656  -4.486
  139   2HG2  VAL  17          2HG2      VAL  17  -1.911  -2.399  -4.818
  140   3HG2  VAL  17          3HG2      VAL  17  -3.291  -2.617  -5.921
  141    H    GLU  18           H        GLU  18   0.607  -5.045  -7.928
  142    HA   GLU  18           HA       GLU  18   0.795  -7.707  -7.217
  143   1HB   GLU  18          1HB       GLU  18   1.532  -6.004  -9.488
  144   2HB   GLU  18          2HB       GLU  18   2.707  -7.282  -9.248
  145   1HG   GLU  18          1HG       GLU  18   0.573  -8.839  -9.006
  146   2HG   GLU  18          2HG       GLU  18  -0.261  -7.527  -9.815
  147    H    GLU  19           H        GLU  19   3.040  -4.967  -6.836
  148    HA   GLU  19           HA       GLU  19   5.318  -6.511  -6.367
  149   1HB   GLU  19          1HB       GLU  19   5.490  -4.154  -6.966
  150   2HB   GLU  19          2HB       GLU  19   4.575  -3.671  -5.552
  151   1HG   GLU  19          1HG       GLU  19   6.699  -3.329  -4.702
  152   2HG   GLU  19          2HG       GLU  19   6.526  -5.019  -4.269
  153    H    ILE  20           H        ILE  20   2.671  -5.285  -4.282
  154    HA   ILE  20           HA       ILE  20   3.972  -6.035  -1.860
  155    HB   ILE  20           HB       ILE  20   1.021  -5.618  -2.126
  156   1HG1  ILE  20          1HG1      ILE  20   1.636  -3.846  -3.488
  157   2HG1  ILE  20          2HG1      ILE  20   1.592  -3.110  -1.899
  158   1HG2  ILE  20          1HG2      ILE  20   2.392  -6.136   0.041
  159   2HG2  ILE  20          2HG2      ILE  20   2.824  -4.412  -0.054
  160   3HG2  ILE  20          3HG2      ILE  20   1.115  -4.896   0.060
  161   1HD1  ILE  20          1HD1      ILE  20   4.197  -3.990  -1.962
  162   2HD1  ILE  20          2HD1      ILE  20   3.916  -3.627  -3.682
  163   3HD1  ILE  20          3HD1      ILE  20   3.683  -2.359  -2.454
  164    H    LYS  21           H        LYS  21   1.534  -7.488  -4.075
  165    HA   LYS  21           HA       LYS  21   0.955  -9.680  -2.421
  166   1HB   LYS  21          1HB       LYS  21   0.604  -9.081  -5.354
  167   2HB   LYS  21          2HB       LYS  21   0.216 -10.665  -4.712
  168   1HG   LYS  21          1HG       LYS  21  -1.021  -9.048  -2.851
  169   2HG   LYS  21          2HG       LYS  21  -1.167  -8.054  -4.287
  170   1HD   LYS  21          1HD       LYS  21  -1.860 -10.992  -4.483
  171   2HD   LYS  21          2HD       LYS  21  -3.002  -9.909  -3.711
  172   1HE   LYS  21          1HE       LYS  21  -3.740  -9.703  -5.902
  173   2HE   LYS  21          2HE       LYS  21  -2.553  -8.414  -5.897
  174   1HZ   LYS  21          1HZ       LYS  21  -2.534 -10.810  -7.358
  175   2HZ   LYS  21          2HZ       LYS  21  -1.572  -9.501  -7.523
  176   3HZ   LYS  21          3HZ       LYS  21  -1.163 -10.689  -6.479
  177    H    LYS  22           H        LYS  22   3.450  -9.058  -4.931
  178    HA   LYS  22           HA       LYS  22   4.396 -11.726  -4.945
  179   1HB   LYS  22          1HB       LYS  22   4.946 -10.636  -6.881
  180   2HB   LYS  22          2HB       LYS  22   5.235  -9.102  -6.086
  181   1HG   LYS  22          1HG       LYS  22   7.435  -9.610  -5.583
  182   2HG   LYS  22          2HG       LYS  22   7.096 -11.307  -5.303
  183   1HD   LYS  22          1HD       LYS  22   7.246 -11.863  -7.589
  184   2HD   LYS  22          2HD       LYS  22   6.852 -10.241  -8.121
  185   1HE   LYS  22          1HE       LYS  22   9.095  -9.474  -7.147
  186   2HE   LYS  22          2HE       LYS  22   9.482 -11.161  -6.872
  187   1HZ   LYS  22          1HZ       LYS  22   9.607  -9.715  -9.261
  188   2HZ   LYS  22          2HZ       LYS  22  10.129 -11.233  -8.959
  189   3HZ   LYS  22          3HZ       LYS  22   8.596 -10.982  -9.462
  190    H    VAL  23           H        VAL  23   5.523  -8.666  -3.357
  191    HA   VAL  23           HA       VAL  23   7.734  -9.701  -2.102
  192    HB   VAL  23           HB       VAL  23   5.831  -7.461  -1.612
  193   1HG1  VAL  23          1HG1      VAL  23   7.602  -8.663   0.462
  194   2HG1  VAL  23          2HG1      VAL  23   7.613  -6.889   0.315
  195   3HG1  VAL  23          3HG1      VAL  23   6.086  -7.746   0.635
  196   1HG2  VAL  23          1HG2      VAL  23   7.482  -6.184  -2.471
  197   2HG2  VAL  23          2HG2      VAL  23   8.755  -7.040  -1.569
  198   3HG2  VAL  23          3HG2      VAL  23   8.119  -7.730  -3.081
  199    H    ALA  24           H        ALA  24   4.287  -9.655  -0.997
  200    HA   ALA  24           HA       ALA  24   4.852 -10.936   1.455
  201   1HB   ALA  24          1HB       ALA  24   2.158 -11.310   0.315
  202   2HB   ALA  24          2HB       ALA  24   2.659 -10.522   1.830
  203   3HB   ALA  24          3HB       ALA  24   2.713  -9.619   0.297
  204    H    GLN  25           H        GLN  25   3.852 -12.059  -1.824
  205    HA   GLN  25           HA       GLN  25   3.345 -14.667  -1.155
  206   1HB   GLN  25          1HB       GLN  25   3.935 -13.131  -3.608
  207   2HB   GLN  25          2HB       GLN  25   4.439 -14.806  -3.720
  208   1HG   GLN  25          1HG       GLN  25   2.161 -15.550  -3.021
  209   2HG   GLN  25          2HG       GLN  25   1.653 -13.879  -2.871
  210   1HE2  GLN  25          1HE2      GLN  25   0.014 -14.697  -4.399
  211   2HE2  GLN  25          2HE2      GLN  25   0.333 -14.609  -6.100
  212    H    GLU  26           H        GLU  26   6.425 -12.946  -1.663
  213    HA   GLU  26           HA       GLU  26   7.917 -15.371  -1.758
  214   1HB   GLU  26          1HB       GLU  26   8.364 -12.705  -2.509
  215   2HB   GLU  26          2HB       GLU  26   9.437 -12.925  -1.141
  216   1HG   GLU  26          1HG       GLU  26  10.106 -15.184  -2.336
  217   2HG   GLU  26          2HG       GLU  26   9.383 -14.460  -3.759
  218    H    ASN  27           H        ASN  27   6.350 -13.646   0.694
  219    HA   ASN  27           HA       ASN  27   8.353 -14.432   2.652
  220   1HB   ASN  27          1HB       ASN  27   6.152 -12.347   2.600
  221   2HB   ASN  27          2HB       ASN  27   6.658 -12.982   4.152
  222   1HD2  ASN  27          1HD2      ASN  27   7.321 -10.847   1.610
  223   2HD2  ASN  27          2HD2      ASN  27   8.868 -10.254   2.118
  224    H    ASN  28           H        ASN  28   5.399 -15.329   1.173
  225    HA   ASN  28           HA       ASN  28   4.107 -17.060   1.548
  226   1HB   ASN  28          1HB       ASN  28   6.132 -17.773   3.216
  227   2HB   ASN  28          2HB       ASN  28   4.914 -17.447   4.433
  228   1HD2  ASN  28          1HD2      ASN  28   5.234 -19.756   4.835
  229   2HD2  ASN  28          2HD2      ASN  28   4.295 -20.915   3.953
  230    H    ILE  29           H        ILE  29   3.655 -14.175   2.287
  231    HA   ILE  29           HA       ILE  29   1.809 -14.441   4.538
  232    HB   ILE  29           HB       ILE  29   2.902 -11.989   3.153
  233   1HG1  ILE  29          1HG1      ILE  29   3.604 -12.951   5.927
  234   2HG1  ILE  29          2HG1      ILE  29   4.495 -13.497   4.520
  235   1HG2  ILE  29          1HG2      ILE  29   1.087 -11.025   4.053
  236   2HG2  ILE  29          2HG2      ILE  29   0.773 -12.391   5.150
  237   3HG2  ILE  29          3HG2      ILE  29   1.986 -11.162   5.583
  238   1HD1  ILE  29          1HD1      ILE  29   5.474 -11.451   5.670
  239   2HD1  ILE  29          2HD1      ILE  29   5.143 -11.233   3.935
  240   3HD1  ILE  29          3HD1      ILE  29   4.032 -10.548   5.147
  241    H    GLU  30           H        GLU  30  -0.405 -13.856   4.349
  242    HA   GLU  30           HA       GLU  30  -1.276 -13.688   1.568
  243   1HB   GLU  30          1HB       GLU  30  -1.876 -15.683   3.521
  244   2HB   GLU  30          2HB       GLU  30  -3.343 -14.749   3.311
  245   1HG   GLU  30          1HG       GLU  30  -3.507 -15.261   1.006
  246   2HG   GLU  30          2HG       GLU  30  -1.799 -15.627   0.859
  247    H    ASN  31           H        ASN  31  -0.733 -11.775   4.078
  248    HA   ASN  31           HA       ASN  31  -3.016 -10.144   3.458
  249   1HB   ASN  31          1HB       ASN  31  -3.072  -9.650   6.097
  250   2HB   ASN  31          2HB       ASN  31  -4.012 -10.962   5.414
  251   1HD2  ASN  31          1HD2      ASN  31  -1.486 -10.046   7.504
  252   2HD2  ASN  31          2HD2      ASN  31  -0.966 -11.612   8.029
  253    HA   PRO  32           HA       PRO  32   1.053  -8.076   4.053
  254   1HB   PRO  32          1HB       PRO  32   1.372  -7.069   1.533
  255   2HB   PRO  32          2HB       PRO  32   2.077  -8.586   2.055
  256   1HG   PRO  32          1HG       PRO  32  -0.263  -8.135   0.306
  257   2HG   PRO  32          2HG       PRO  32   0.702  -9.585   0.495
  258   1HD   PRO  32          1HD       PRO  32  -1.902  -9.100   1.597
  259   2HD   PRO  32          2HD       PRO  32  -0.888 -10.501   1.880
  260    H    ILE  33           H        ILE  33   1.188  -6.148   5.025
  261    HA   ILE  33           HA       ILE  33  -1.011  -4.341   4.331
  262    HB   ILE  33           HB       ILE  33   0.656  -4.697   6.814
  263   1HG1  ILE  33          1HG1      ILE  33  -2.342  -4.817   6.381
  264   2HG1  ILE  33          2HG1      ILE  33  -1.289  -6.217   6.420
  265   1HG2  ILE  33          1HG2      ILE  33  -0.489  -2.256   5.804
  266   2HG2  ILE  33          2HG2      ILE  33  -1.326  -2.753   7.294
  267   3HG2  ILE  33          3HG2      ILE  33   0.441  -2.543   7.294
  268   1HD1  ILE  33          1HD1      ILE  33  -1.749  -4.221   8.681
  269   2HD1  ILE  33          2HD1      ILE  33  -2.245  -5.930   8.638
  270   3HD1  ILE  33          3HD1      ILE  33  -0.519  -5.506   8.730
  271    H    LEU  34           H        LEU  34  -0.523  -2.726   2.955
  272    HA   LEU  34           HA       LEU  34   2.272  -1.973   2.689
  273   1HB   LEU  34          1HB       LEU  34   0.743  -2.564   0.752
  274   2HB   LEU  34          2HB       LEU  34  -0.079  -1.045   1.047
  275    HG   LEU  34           HG       LEU  34   1.972   0.201   0.595
  276   1HD1  LEU  34          1HD1      LEU  34   3.951  -0.754   0.904
  277   2HD1  LEU  34          2HD1      LEU  34   3.216  -2.374   0.980
  278   3HD1  LEU  34          3HD1      LEU  34   3.686  -1.683  -0.591
  279   1HD2  LEU  34          1HD2      LEU  34   0.592  -1.480  -1.331
  280   2HD2  LEU  34          2HD2      LEU  34   1.118   0.216  -1.458
  281   3HD2  LEU  34          3HD2      LEU  34   2.251  -1.099  -1.853
  282    H    ARG  35           H        ARG  35   3.072  -0.358   3.910
  283    HA   ARG  35           HA       ARG  35   1.145   1.597   4.856
  284   1HB   ARG  35          1HB       ARG  35   2.597   1.980   6.732
  285   2HB   ARG  35          2HB       ARG  35   2.590   0.242   6.510
  286   1HG   ARG  35          1HG       ARG  35   4.713   0.477   5.123
  287   2HG   ARG  35          2HG       ARG  35   4.742   2.179   5.539
  288   1HD   ARG  35          1HD       ARG  35   4.437   1.022   8.040
  289   2HD   ARG  35          2HD       ARG  35   5.402  -0.190   7.221
  290    HE   ARG  35           HE       ARG  35   6.557   2.340   6.629
  291   1HH1  ARG  35          2HH2      ARG  35   6.043   0.259   9.419
  292   2HH1  ARG  35          1HH2      ARG  35   7.434   0.842  10.271
  293   1HH2  ARG  35          2HH1      ARG  35   8.393   3.109   7.751
  294   2HH2  ARG  35          1HH1      ARG  35   8.780   2.474   9.315
  295    H    ILE  36           H        ILE  36   1.615   3.881   4.643
  296    HA   ILE  36           HA       ILE  36   3.625   4.422   2.583
  297    HB   ILE  36           HB       ILE  36   1.064   5.780   3.384
  298   1HG1  ILE  36          1HG1      ILE  36   1.125   3.809   1.770
  299   2HG1  ILE  36          2HG1      ILE  36   0.312   5.262   1.225
  300   1HG2  ILE  36          1HG2      ILE  36   1.566   7.587   1.845
  301   2HG2  ILE  36          2HG2      ILE  36   2.798   7.512   3.128
  302   3HG2  ILE  36          3HG2      ILE  36   3.167   6.887   1.503
  303   1HD1  ILE  36          1HD1      ILE  36   3.236   5.106   0.609
  304   2HD1  ILE  36          2HD1      ILE  36   2.182   3.967  -0.263
  305   3HD1  ILE  36          3HD1      ILE  36   1.894   5.719  -0.388
  306    H    ARG  37           H        ARG  37   5.385   5.683   3.013
  307    HA   ARG  37           HA       ARG  37   5.291   7.334   5.362
  308   1HB   ARG  37          1HB       ARG  37   6.487   4.776   5.480
  309   2HB   ARG  37          2HB       ARG  37   7.844   5.861   5.253
  310   1HG   ARG  37          1HG       ARG  37   5.864   6.847   7.233
  311   2HG   ARG  37          2HG       ARG  37   6.605   5.325   7.687
  312   1HD   ARG  37          1HD       ARG  37   8.248   7.727   6.766
  313   2HD   ARG  37          2HD       ARG  37   7.829   7.467   8.448
  314    HE   ARG  37           HE       ARG  37   9.028   5.103   7.219
  315   1HH1  ARG  37          2HH2      ARG  37   9.727   8.174   8.787
  316   2HH1  ARG  37          1HH2      ARG  37  11.303   7.691   9.318
  317   1HH2  ARG  37          2HH1      ARG  37  11.108   4.464   7.918
  318   2HH2  ARG  37          1HH1      ARG  37  12.094   5.566   8.820
  319    H    VAL  38           H        VAL  38   6.089   9.310   4.715
  320    HA   VAL  38           HA       VAL  38   7.271   9.698   2.231
  321    HB   VAL  38           HB       VAL  38   7.247  11.398   4.731
  322   1HG1  VAL  38          1HG1      VAL  38   7.389  13.012   2.407
  323   2HG1  VAL  38          2HG1      VAL  38   8.607  12.827   3.692
  324   3HG1  VAL  38          3HG1      VAL  38   8.665  11.780   2.254
  325   1HG2  VAL  38          1HG2      VAL  38   5.399  11.148   2.352
  326   2HG2  VAL  38          2HG2      VAL  38   5.010  11.044   4.085
  327   3HG2  VAL  38          3HG2      VAL  38   5.441  12.612   3.363
  328    H    VAL  39           H        VAL  39   9.336   9.542   1.478
  329    HA   VAL  39           HA       VAL  39  11.443   9.257   3.504
  330    HB   VAL  39           HB       VAL  39  10.988   7.639   0.993
  331   1HG1  VAL  39          1HG1      VAL  39  13.447   8.449   1.781
  332   2HG1  VAL  39          2HG1      VAL  39  13.270   6.985   2.777
  333   3HG1  VAL  39          3HG1      VAL  39  13.126   6.880   1.006
  334   1HG2  VAL  39          1HG2      VAL  39  11.390   5.847   2.992
  335   2HG2  VAL  39          2HG2      VAL  39  10.610   7.167   3.896
  336   3HG2  VAL  39          3HG2      VAL  39   9.787   6.441   2.494
  337    HA   PRO  40           HA       PRO  40  13.231  12.434   1.157
  338   1HB   PRO  40          1HB       PRO  40  15.686  12.522   2.355
  339   2HB   PRO  40          2HB       PRO  40  14.268  13.310   3.017
  340   1HG   PRO  40          1HG       PRO  40  15.596  10.827   3.914
  341   2HG   PRO  40          2HG       PRO  40  14.469  11.846   4.787
  342   1HD   PRO  40          1HD       PRO  40  13.895   9.325   3.546
  343   2HD   PRO  40          2HD       PRO  40  12.746  10.399   4.318
  344    H    GLY  41           H        GLY  41  13.342  11.859  -0.956
  345   1HA   GLY  41          1HA       GLY  41  15.336   9.870  -1.680
  346   2HA   GLY  41          2HA       GLY  41  14.144  10.623  -2.720
  347    H    GLY  42           H        GLY  42  14.826  12.193  -4.126
  348   1HA   GLY  42          1HA       GLY  42  16.558  14.259  -3.613
  349   2HA   GLY  42          2HA       GLY  42  17.585  12.943  -4.148
  350    H    CYS  43           H        CYS  43  18.168  13.696  -6.195
  351    HA   CYS  43           HA       CYS  43  16.463  14.999  -7.933
  352   1HB   CYS  43          1HB       CYS  43  18.126  14.413  -9.685
  353   2HB   CYS  43          2HB       CYS  43  18.850  15.097  -8.243
  354    HG   CYS  43           HG       CYS  43  20.299  13.306  -7.703
  355    H    SER  44           H        SER  44  17.004  11.551  -7.194
  356    HA   SER  44           HA       SER  44  15.892  10.450  -9.448
  357   1HB   SER  44          1HB       SER  44  15.985   9.501  -6.558
  358   2HB   SER  44          2HB       SER  44  15.340   8.499  -7.843
  359    HG   SER  44           HG       SER  44  17.565   9.131  -8.915
  360    H    GLY  45           H        GLY  45  14.384  11.634  -6.390
  361   1HA   GLY  45          1HA       GLY  45  12.118  12.674  -7.131
  362   2HA   GLY  45          2HA       GLY  45  11.718  10.996  -7.440
  363    H    PHE  46           H        PHE  46  10.787  13.091  -5.358
  364    HA   PHE  46           HA       PHE  46  11.666  11.917  -2.880
  365   1HB   PHE  46          1HB       PHE  46   9.839  14.144  -3.873
  366   2HB   PHE  46          2HB       PHE  46   9.645  13.605  -2.217
  367    HD1  PHE  46           1HD      PHE  46  11.149  14.294  -0.530
  368    HD2  PHE  46           2HD      PHE  46  12.073  15.058  -4.600
  369    HE1  PHE  46           1HE      PHE  46  13.035  15.791   0.179
  370    HE2  PHE  46           2HE      PHE  46  13.958  16.556  -3.891
  371    HZ   PHE  46           HZ       PHE  46  14.416  16.905  -1.510
  372    H    GLN  47           H        GLN  47  10.641   9.815  -4.240
  373    HA   GLN  47           HA       GLN  47   7.851   9.623  -3.506
  374   1HB   GLN  47          1HB       GLN  47   9.664   7.791  -5.134
  375   2HB   GLN  47          2HB       GLN  47   7.984   7.434  -4.786
  376   1HG   GLN  47          1HG       GLN  47   7.498   8.593  -6.684
  377   2HG   GLN  47          2HG       GLN  47   7.822  10.039  -5.749
  378   1HE2  GLN  47          1HE2      GLN  47   8.261  10.677  -8.072
  379   2HE2  GLN  47          2HE2      GLN  47   9.896  10.570  -8.633
  380    H    TYR  48           H        TYR  48   7.077   8.295  -1.860
  381    HA   TYR  48           HA       TYR  48   9.023   7.373   0.028
  382   1HB   TYR  48          1HB       TYR  48   6.726   6.596   1.082
  383   2HB   TYR  48          2HB       TYR  48   6.961   8.320   0.872
  384    HD1  TYR  48           1HD      TYR  48   5.346   5.324  -0.630
  385    HD2  TYR  48           2HD      TYR  48   5.524   9.597  -0.530
  386    HE1  TYR  48           1HE      TYR  48   3.219   5.452  -2.017
  387    HE2  TYR  48           2HE      TYR  48   3.397   9.711  -1.917
  388    HH   TYR  48           HH       TYR  48   2.303   7.479  -3.722
  389    H    ALA  49           H        ALA  49   9.613   5.271   0.538
  390    HA   ALA  49           HA       ALA  49   9.060   3.314  -1.493
  391   1HB   ALA  49          1HB       ALA  49  10.568   1.944   0.146
  392   2HB   ALA  49          2HB       ALA  49  11.286   3.304  -0.751
  393   3HB   ALA  49          3HB       ALA  49  10.821   3.509   0.955
  394    H    MET  50           H        MET  50   8.295   1.088  -0.925
  395    HA   MET  50           HA       MET  50   6.217   1.324   1.104
  396   1HB   MET  50          1HB       MET  50   6.475  -0.079  -1.561
  397   2HB   MET  50          2HB       MET  50   5.491  -0.874  -0.349
  398   1HG   MET  50          1HG       MET  50   3.776   0.521  -0.864
  399   2HG   MET  50          2HG       MET  50   4.722   1.872  -0.272
  400   1HE   MET  50          1HE       MET  50   4.440  -0.597  -3.255
  401   2HE   MET  50          2HE       MET  50   2.968   0.403  -3.292
  402   3HE   MET  50          3HE       MET  50   4.160   0.524  -4.608
  403    H    GLY  51           H        GLY  51   5.550  -1.045   1.948
  404   1HA   GLY  51          1HA       GLY  51   7.661  -2.954   2.161
  405   2HA   GLY  51          2HA       GLY  51   7.548  -1.961   3.601
  406    H    PHE  52           H        PHE  52   7.062  -4.602   3.985
  407    HA   PHE  52           HA       PHE  52   4.139  -4.834   3.970
  408   1HB   PHE  52          1HB       PHE  52   4.873  -7.323   4.442
  409   2HB   PHE  52          2HB       PHE  52   5.148  -6.701   2.826
  410    HD1  PHE  52           1HD      PHE  52   6.693  -7.948   5.845
  411    HD2  PHE  52           2HD      PHE  52   7.444  -5.995   2.154
  412    HE1  PHE  52           1HE      PHE  52   9.130  -8.512   6.043
  413    HE2  PHE  52           2HE      PHE  52   9.882  -6.558   2.352
  414    HZ   PHE  52           HZ       PHE  52  10.696  -7.810   4.294
  415    H    ASP  53           H        ASP  53   3.111  -4.553   5.889
  416    HA   ASP  53           HA       ASP  53   4.720  -5.038   8.273
  417   1HB   ASP  53          1HB       ASP  53   3.695  -2.630   7.558
  418   2HB   ASP  53          2HB       ASP  53   2.279  -3.277   8.363
  419    H    ASP  54           H        ASP  54   2.972  -5.307  10.269
  420    HA   ASP  54           HA       ASP  54   0.833  -7.009   9.262
  421   1HB   ASP  54          1HB       ASP  54   2.933  -7.540  11.360
  422   2HB   ASP  54          2HB       ASP  54   1.332  -8.198  11.633
  423    H    THR  55           H        THR  55   2.247  -5.113  12.014
  424    HA   THR  55           HA       THR  55  -0.202  -4.982  13.466
  425    HB   THR  55           HB       THR  55   2.161  -4.843  14.410
  426    HG1  THR  55           1HG      THR  55   0.447  -4.020  15.695
  427   1HG2  THR  55          1HG2      THR  55   2.372  -1.960  14.133
  428   2HG2  THR  55          2HG2      THR  55   3.587  -3.196  13.726
  429   3HG2  THR  55          3HG2      THR  55   2.384  -2.696  12.512
  430    H    VAL  56           H        VAL  56  -0.787  -2.512  14.197
  431    HA   VAL  56           HA       VAL  56  -1.113  -0.978  11.726
  432    HB   VAL  56           HB       VAL  56  -3.174  -2.337  13.300
  433   1HG1  VAL  56          1HG1      VAL  56  -4.838  -0.532  13.158
  434   2HG1  VAL  56          2HG1      VAL  56  -3.487  -0.090  14.228
  435   3HG1  VAL  56          3HG1      VAL  56  -3.579   0.587  12.585
  436   1HG2  VAL  56          1HG2      VAL  56  -4.450  -1.620  11.110
  437   2HG2  VAL  56          2HG2      VAL  56  -2.812  -1.238  10.529
  438   3HG2  VAL  56          3HG2      VAL  56  -3.206  -2.892  11.058
  439    H    GLU  57           H        GLU  57  -1.571   1.327  12.128
  440    HA   GLU  57           HA       GLU  57  -0.123   2.169  14.439
  441   1HB   GLU  57          1HB       GLU  57  -1.505   4.018  12.474
  442   2HB   GLU  57          2HB       GLU  57  -0.050   4.312  13.405
  443   1HG   GLU  57          1HG       GLU  57   0.476   1.976  11.846
  444   2HG   GLU  57          2HG       GLU  57  -0.318   3.106  10.767
  445    H    GLU  58           H        GLU  58  -1.066   4.240  15.638
  446    HA   GLU  58           HA       GLU  58  -3.549   3.353  16.725
  447   1HB   GLU  58          1HB       GLU  58  -1.330   4.652  17.752
  448   2HB   GLU  58          2HB       GLU  58  -2.474   5.973  17.618
  449   1HG   GLU  58          1HG       GLU  58  -4.032   4.955  19.088
  450   2HG   GLU  58          2HG       GLU  58  -3.378   3.349  18.835
  451    H    GLY  59           H        GLY  59  -4.064   3.944  14.097
  452   1HA   GLY  59          1HA       GLY  59  -6.151   5.127  13.548
  453   2HA   GLY  59          2HA       GLY  59  -5.427   6.568  14.232
  454    H    ASP  60           H        ASP  60  -4.863   4.034  11.699
  455    HA   ASP  60           HA       ASP  60  -3.549   6.129  10.155
  456   1HB   ASP  60          1HB       ASP  60  -2.606   3.584  10.878
  457   2HB   ASP  60          2HB       ASP  60  -3.164   3.347   9.234
  458    H    HIS  61           H        HIS  61  -4.223   6.343   7.914
  459    HA   HIS  61           HA       HIS  61  -6.879   5.614   7.408
  460   1HB   HIS  61          1HB       HIS  61  -4.672   6.950   5.902
  461   2HB   HIS  61          2HB       HIS  61  -6.036   6.348   4.980
  462    HD1  HIS  61           1HD      HIS  61  -5.656   8.388   8.222
  463    HD2  HIS  61           2HD      HIS  61  -7.912   8.293   4.687
  464    HE1  HIS  61           1HE      HIS  61  -7.244  10.382   8.334
  465    H    VAL  62           H        VAL  62  -7.100   3.339   7.622
  466    HA   VAL  62           HA       VAL  62  -5.430   1.619   6.051
  467    HB   VAL  62           HB       VAL  62  -6.844   1.363   8.358
  468   1HG1  VAL  62          1HG1      VAL  62  -9.001   1.310   7.180
  469   2HG1  VAL  62          2HG1      VAL  62  -8.449  -0.087   6.225
  470   3HG1  VAL  62          3HG1      VAL  62  -8.662  -0.240   7.986
  471   1HG2  VAL  62          1HG2      VAL  62  -6.565  -1.257   7.620
  472   2HG2  VAL  62          2HG2      VAL  62  -5.454  -0.449   6.488
  473   3HG2  VAL  62          3HG2      VAL  62  -5.251  -0.229   8.243
  474    H    PHE  63           H        PHE  63  -5.660   1.418   3.889
  475    HA   PHE  63           HA       PHE  63  -8.391   1.664   2.836
  476   1HB   PHE  63          1HB       PHE  63  -6.393   3.344   2.287
  477   2HB   PHE  63          2HB       PHE  63  -5.751   2.026   1.327
  478    HD1  PHE  63           1HD      PHE  63  -9.308   3.033   1.729
  479    HD2  PHE  63           2HD      PHE  63  -5.952   2.819  -0.859
  480    HE1  PHE  63           1HE      PHE  63 -10.751   3.736  -0.201
  481    HE2  PHE  63           2HE      PHE  63  -7.395   3.522  -2.789
  482    HZ   PHE  63           HZ       PHE  63  -9.778   3.972  -2.436
  483    H    GLU  64           H        GLU  64  -9.239  -0.220   2.100
  484    HA   GLU  64           HA       GLU  64  -7.643  -2.508   1.904
  485   1HB   GLU  64          1HB       GLU  64 -10.482  -1.976   0.923
  486   2HB   GLU  64          2HB       GLU  64  -9.745  -3.564   1.009
  487   1HG   GLU  64          1HG       GLU  64  -9.530  -3.428   3.430
  488   2HG   GLU  64          2HG       GLU  64  -9.959  -1.729   3.436
  489    H    TYR  65           H        TYR  65  -6.738  -3.569   0.123
  490    HA   TYR  65           HA       TYR  65  -6.920  -2.081  -2.409
  491   1HB   TYR  65          1HB       TYR  65  -4.810  -3.615  -0.839
  492   2HB   TYR  65          2HB       TYR  65  -4.680  -3.652  -2.586
  493    HD1  TYR  65           1HD      TYR  65  -5.791  -0.806  -0.431
  494    HD2  TYR  65           2HD      TYR  65  -2.756  -2.369  -3.011
  495    HE1  TYR  65           1HE      TYR  65  -4.594   1.437  -0.394
  496    HE2  TYR  65           2HE      TYR  65  -1.570  -0.120  -2.965
  497    HH   TYR  65           HH       TYR  65  -1.731   1.985  -2.396
  498    H    ASP  66           H        ASP  66  -5.765  -3.995  -4.096
  499    HA   ASP  66           HA       ASP  66  -7.989  -5.570  -4.626
  500   1HB   ASP  66          1HB       ASP  66  -5.907  -4.743  -6.100
  501   2HB   ASP  66          2HB       ASP  66  -5.240  -6.300  -5.652
  502    H    GLY  67           H        GLY  67  -8.074  -6.556  -2.313
  503   1HA   GLY  67          1HA       GLY  67  -8.009  -8.488  -1.133
  504   2HA   GLY  67          2HA       GLY  67  -7.018  -9.218  -2.380
  505    H    VAL  68           H        VAL  68  -6.282  -6.146  -0.650
  506    HA   VAL  68           HA       VAL  68  -4.378  -7.468   1.060
  507    HB   VAL  68           HB       VAL  68  -3.461  -5.524  -1.068
  508   1HG1  VAL  68          1HG1      VAL  68  -1.235  -5.843  -0.200
  509   2HG1  VAL  68          2HG1      VAL  68  -2.296  -5.347   1.140
  510   3HG1  VAL  68          3HG1      VAL  68  -1.813  -7.052   0.972
  511   1HG2  VAL  68          1HG2      VAL  68  -3.880  -7.660  -2.097
  512   2HG2  VAL  68          2HG2      VAL  68  -2.121  -7.474  -1.897
  513   3HG2  VAL  68          3HG2      VAL  68  -3.038  -8.516  -0.783
  514    H    LYS  69           H        LYS  69  -3.527  -5.986   2.709
  515    HA   LYS  69           HA       LYS  69  -5.403  -3.789   3.117
  516   1HB   LYS  69          1HB       LYS  69  -3.983  -5.699   4.844
  517   2HB   LYS  69          2HB       LYS  69  -3.924  -4.050   5.432
  518   1HG   LYS  69          1HG       LYS  69  -6.465  -3.936   5.041
  519   2HG   LYS  69          2HG       LYS  69  -6.420  -5.661   4.739
  520   1HD   LYS  69          1HD       LYS  69  -5.309  -5.947   7.025
  521   2HD   LYS  69          2HD       LYS  69  -5.598  -4.243   7.315
  522   1HE   LYS  69          1HE       LYS  69  -8.069  -5.411   6.376
  523   2HE   LYS  69          2HE       LYS  69  -7.434  -6.445   7.641
  524   1HZ   LYS  69          1HZ       LYS  69  -8.804  -4.627   8.471
  525   2HZ   LYS  69          2HZ       LYS  69  -7.290  -4.568   9.079
  526   3HZ   LYS  69          3HZ       LYS  69  -7.736  -3.533   7.897
  527    H    VAL  70           H        VAL  70  -4.689  -1.652   3.608
  528    HA   VAL  70           HA       VAL  70  -1.848  -1.137   3.317
  529    HB   VAL  70           HB       VAL  70  -3.961   0.008   1.482
  530   1HG1  VAL  70          1HG1      VAL  70  -2.273   1.410   0.525
  531   2HG1  VAL  70          2HG1      VAL  70  -2.246   1.674   2.285
  532   3HG1  VAL  70          3HG1      VAL  70  -1.000   0.661   1.518
  533   1HG2  VAL  70          1HG2      VAL  70  -2.149  -0.946  -0.206
  534   2HG2  VAL  70          2HG2      VAL  70  -1.791  -2.030   1.160
  535   3HG2  VAL  70          3HG2      VAL  70  -3.430  -1.983   0.467
  536    H    VAL  71           H        VAL  71  -1.243   0.984   4.134
  537    HA   VAL  71           HA       VAL  71  -3.376   2.479   5.422
  538    HB   VAL  71           HB       VAL  71  -2.637   2.245   7.574
  539   1HG1  VAL  71          1HG1      VAL  71  -2.015  -0.418   6.256
  540   2HG1  VAL  71          2HG1      VAL  71  -2.201  -0.180   8.011
  541   3HG1  VAL  71          3HG1      VAL  71  -3.576   0.122   6.921
  542   1HG2  VAL  71          1HG2      VAL  71  -0.389   1.377   8.218
  543   2HG2  VAL  71          2HG2      VAL  71   0.039   1.305   6.492
  544   3HG2  VAL  71          3HG2      VAL  71  -0.323   2.872   7.254
  545    H    ILE  72           H        ILE  72  -2.595   4.641   6.164
  546    HA   ILE  72           HA       ILE  72  -0.023   5.411   5.053
  547    HB   ILE  72           HB       ILE  72  -2.648   6.628   4.193
  548   1HG1  ILE  72          1HG1      ILE  72  -1.379   6.056   1.905
  549   2HG1  ILE  72          2HG1      ILE  72  -0.664   4.807   2.905
  550   1HG2  ILE  72          1HG2      ILE  72   0.194   7.592   3.890
  551   2HG2  ILE  72          2HG2      ILE  72  -1.090   8.064   2.752
  552   3HG2  ILE  72          3HG2      ILE  72  -1.236   8.475   4.477
  553   1HD1  ILE  72          1HD1      ILE  72  -3.580   5.063   3.319
  554   2HD1  ILE  72          2HD1      ILE  72  -3.138   4.639   1.648
  555   3HD1  ILE  72          3HD1      ILE  72  -2.601   3.611   2.998
  556    H    ASP  73           H        ASP  73   1.011   6.845   6.371
  557    HA   ASP  73           HA       ASP  73   0.002   7.334   8.869
  558   1HB   ASP  73          1HB       ASP  73   2.287   8.297   7.213
  559   2HB   ASP  73          2HB       ASP  73   1.826   9.386   8.507
  560    HA   PRO  74           HA       PRO  74  -2.263  11.058   8.362
  561   1HB   PRO  74          1HB       PRO  74  -1.660  12.550  10.571
  562   2HB   PRO  74          2HB       PRO  74  -2.786  11.207  10.599
  563   1HG   PRO  74          1HG       PRO  74  -0.017  11.325  11.627
  564   2HG   PRO  74          2HG       PRO  74  -1.282  10.176  12.011
  565   1HD   PRO  74          1HD       PRO  74   0.963   9.742  10.279
  566   2HD   PRO  74          2HD       PRO  74  -0.364   8.635  10.573
  567    H    PHE  75           H        PHE  75   1.137  11.364   8.644
  568    HA   PHE  75           HA       PHE  75   1.061  14.103   7.729
  569   1HB   PHE  75          1HB       PHE  75   2.939  12.099   8.883
  570   2HB   PHE  75          2HB       PHE  75   3.687  13.023   7.595
  571    HD1  PHE  75           1HD      PHE  75   4.656  15.066   8.093
  572    HD2  PHE  75           2HD      PHE  75   1.693  13.520  10.708
  573    HE1  PHE  75           1HE      PHE  75   5.085  16.952   9.694
  574    HE2  PHE  75           2HE      PHE  75   2.122  15.406  12.309
  575    HZ   PHE  75           HZ       PHE  75   3.813  17.099  11.782
  576    H    SER  76           H        SER  76   1.547  10.811   6.466
  577    HA   SER  76           HA       SER  76   2.544  11.860   3.983
  578   1HB   SER  76          1HB       SER  76   2.749   9.481   3.330
  579   2HB   SER  76          2HB       SER  76   3.515   9.780   4.878
  580    HG   SER  76           HG       SER  76   0.859   9.112   5.235
  581    H    MET  77           H        MET  77  -0.473  11.078   5.506
  582    HA   MET  77           HA       MET  77  -1.943  10.104   3.414
  583   1HB   MET  77          1HB       MET  77  -2.363  11.189   6.055
  584   2HB   MET  77          2HB       MET  77  -3.500  12.001   4.997
  585   1HG   MET  77          1HG       MET  77  -3.337   9.084   4.491
  586   2HG   MET  77          2HG       MET  77  -3.855   9.467   6.121
  587   1HE   MET  77          1HE       MET  77  -6.054  10.297   2.204
  588   2HE   MET  77          2HE       MET  77  -4.394  10.899   2.430
  589   3HE   MET  77          3HE       MET  77  -4.726   9.152   2.511
  590    HA   PRO  78           HA       PRO  78  -2.775  14.625   2.222
  591   1HB   PRO  78          1HB       PRO  78  -1.236  16.614   3.293
  592   2HB   PRO  78          2HB       PRO  78  -2.808  16.171   3.929
  593   1HG   PRO  78          1HG       PRO  78  -0.129  15.575   5.028
  594   2HG   PRO  78          2HG       PRO  78  -1.683  15.524   5.836
  595   1HD   PRO  78          1HD       PRO  78  -0.160  13.281   4.899
  596   2HD   PRO  78          2HD       PRO  78  -1.765  13.238   5.602
  597    H    TYR  79           H        TYR  79  -0.043  12.906   2.176
  598    HA   TYR  79           HA       TYR  79   1.190  14.633   0.151
  599   1HB   TYR  79          1HB       TYR  79   2.075  13.056   2.376
  600   2HB   TYR  79          2HB       TYR  79   2.522  12.107   0.971
  601    HD1  TYR  79           1HD      TYR  79   3.414  14.861   3.075
  602    HD2  TYR  79           2HD      TYR  79   3.918  13.278  -0.867
  603    HE1  TYR  79           1HE      TYR  79   5.485  16.301   2.754
  604    HE2  TYR  79           2HE      TYR  79   5.987  14.723  -1.175
  605    HH   TYR  79           HH       TYR  79   7.736  15.761   0.593
  606    H    VAL  80           H        VAL  80  -1.148  12.328   0.247
  607    HA   VAL  80           HA       VAL  80  -0.522  11.475  -2.438
  608    HB   VAL  80           HB       VAL  80  -0.840   9.094  -1.908
  609   1HG1  VAL  80          1HG1      VAL  80   1.477  10.396  -0.438
  610   2HG1  VAL  80          2HG1      VAL  80   1.395   8.695  -0.957
  611   3HG1  VAL  80          3HG1      VAL  80   1.422   9.996  -2.171
  612   1HG2  VAL  80          1HG2      VAL  80  -0.172   9.215   0.914
  613   2HG2  VAL  80          2HG2      VAL  80  -1.714  10.041   0.584
  614   3HG2  VAL  80          3HG2      VAL  80  -1.490   8.345   0.093
  615    H    ASN  81           H        ASN  81  -2.442  13.283  -1.176
  616    HA   ASN  81           HA       ASN  81  -4.852  12.069  -0.678
  617   1HB   ASN  81          1HB       ASN  81  -4.498  14.437  -0.173
  618   2HB   ASN  81          2HB       ASN  81  -4.158  14.806  -1.852
  619   1HD2  ASN  81          1HD2      ASN  81  -6.346  15.262   0.412
  620   2HD2  ASN  81          2HD2      ASN  81  -7.831  15.259  -0.479
  621    H    GLY  82           H        GLY  82  -5.734  10.580  -2.153
  622   1HA   GLY  82          1HA       GLY  82  -6.563   9.733  -4.061
  623   2HA   GLY  82          2HA       GLY  82  -6.895  11.386  -4.538
  624    H    ALA  83           H        ALA  83  -3.544  10.724  -3.815
  625    HA   ALA  83           HA       ALA  83  -2.831  11.228  -6.533
  626   1HB   ALA  83          1HB       ALA  83  -0.841  11.784  -5.610
  627   2HB   ALA  83          2HB       ALA  83  -1.679  11.620  -4.048
  628   3HB   ALA  83          3HB       ALA  83  -0.736  10.258  -4.699
  629    H    GLU  84           H        GLU  84  -0.960   9.709  -7.461
  630    HA   GLU  84           HA       GLU  84  -1.871   6.965  -7.074
  631   1HB   GLU  84          1HB       GLU  84  -2.738   7.851  -9.213
  632   2HB   GLU  84          2HB       GLU  84  -1.123   8.322  -9.702
  633   1HG   GLU  84          1HG       GLU  84  -0.669   6.232 -10.457
  634   2HG   GLU  84          2HG       GLU  84  -1.093   5.525  -8.911
  635    H    LEU  85           H        LEU  85  -0.258   5.427  -6.794
  636    HA   LEU  85           HA       LEU  85   2.489   6.422  -7.111
  637   1HB   LEU  85          1HB       LEU  85   2.805   6.025  -4.974
  638   2HB   LEU  85          2HB       LEU  85   1.142   5.502  -4.799
  639    HG   LEU  85           HG       LEU  85   1.825   3.192  -5.428
  640   1HD1  LEU  85          1HD1      LEU  85   4.642   3.421  -4.912
  641   2HD1  LEU  85          2HD1      LEU  85   3.801   2.735  -6.323
  642   3HD1  LEU  85          3HD1      LEU  85   4.196   4.470  -6.279
  643   1HD2  LEU  85          1HD2      LEU  85   3.600   3.858  -3.140
  644   2HD2  LEU  85          2HD2      LEU  85   1.897   4.359  -3.015
  645   3HD2  LEU  85          3HD2      LEU  85   2.303   2.647  -3.283
  646    H    ASP  86           H        ASP  86   3.331   5.546  -8.929
  647    HA   ASP  86           HA       ASP  86   2.419   2.904  -9.660
  648   1HB   ASP  86          1HB       ASP  86   2.747   5.071 -11.206
  649   2HB   ASP  86          2HB       ASP  86   4.408   4.517 -11.267
  650    H    TYR  87           H        TYR  87   3.635   1.351  -8.516
  651    HA   TYR  87           HA       TYR  87   6.429   1.846  -7.977
  652   1HB   TYR  87          1HB       TYR  87   4.304   0.536  -6.750
  653   2HB   TYR  87          2HB       TYR  87   5.046  -0.816  -7.582
  654    HD1  TYR  87           1HD      TYR  87   6.698  -2.021  -6.478
  655    HD2  TYR  87           2HD      TYR  87   6.019   2.054  -5.365
  656    HE1  TYR  87           1HE      TYR  87   8.388  -2.246  -4.592
  657    HE2  TYR  87           2HE      TYR  87   7.711   1.815  -3.483
  658    HH   TYR  87           HH       TYR  87   9.049  -1.297  -2.648
  659    H    VAL  88           H        VAL  88   8.091   1.218  -9.258
  660    HA   VAL  88           HA       VAL  88   7.481  -0.396 -11.570
  661    HB   VAL  88           HB       VAL  88   9.858   1.163 -10.584
  662   1HG1  VAL  88          1HG1      VAL  88  11.090   0.504 -12.599
  663   2HG1  VAL  88          2HG1      VAL  88  10.734  -0.910 -11.577
  664   3HG1  VAL  88          3HG1      VAL  88   9.777  -0.611 -13.048
  665   1HG2  VAL  88          1HG2      VAL  88   7.814   2.206 -11.762
  666   2HG2  VAL  88          2HG2      VAL  88   9.432   2.610 -12.384
  667   3HG2  VAL  88          3HG2      VAL  88   8.426   1.412 -13.233
  668    H    VAL  89           H        VAL  89   8.802  -2.320 -12.140
  669    HA   VAL  89           HA       VAL  89   9.766  -3.706  -9.738
  670    HB   VAL  89           HB       VAL  89   8.164  -4.931 -11.990
  671   1HG1  VAL  89          1HG1      VAL  89   9.470  -5.994  -9.507
  672   2HG1  VAL  89          2HG1      VAL  89   7.955  -6.737 -10.074
  673   3HG1  VAL  89          3HG1      VAL  89   9.380  -6.696 -11.141
  674   1HG2  VAL  89          1HG2      VAL  89   7.123  -4.581  -9.187
  675   2HG2  VAL  89          2HG2      VAL  89   6.977  -3.259 -10.371
  676   3HG2  VAL  89          3HG2      VAL  89   6.230  -4.839 -10.705
  677    H    ASP  90           H        ASP  90  11.873  -4.244  -9.933
  678    HA   ASP  90           HA       ASP  90  12.819  -5.334 -12.359
  679   1HB   ASP  90          1HB       ASP  90  13.873  -2.614 -11.449
  680   2HB   ASP  90          2HB       ASP  90  14.659  -3.615 -12.654
  681    H    PHE  91           H        PHE  91  15.485  -5.448 -12.034
  682    HA   PHE  91           HA       PHE  91  16.923  -6.677 -10.826
  683   1HB   PHE  91          1HB       PHE  91  16.969  -4.015 -10.295
  684   2HB   PHE  91          2HB       PHE  91  16.509  -4.545  -8.689
  685    HD1  PHE  91           1HD      PHE  91  18.324  -4.398  -7.282
  686    HD2  PHE  91           2HD      PHE  91  18.917  -5.912 -11.201
  687    HE1  PHE  91           1HE      PHE  91  20.733  -4.853  -6.742
  688    HE2  PHE  91           2HE      PHE  91  21.326  -6.367 -10.661
  689    HZ   PHE  91           HZ       PHE  91  22.205  -5.833  -8.438
  690    H    MET  92           H        MET  92  17.047  -6.132  -7.731
  691    HA   MET  92           HA       MET  92  15.385  -8.404  -7.124
  692   1HB   MET  92          1HB       MET  92  17.846  -7.157  -6.109
  693   2HB   MET  92          2HB       MET  92  16.732  -7.440  -4.786
  694   1HG   MET  92          1HG       MET  92  16.459  -9.843  -5.695
  695   2HG   MET  92          2HG       MET  92  17.807  -9.503  -6.761
  696   1HE   MET  92          1HE       MET  92  17.186 -10.403  -2.662
  697   2HE   MET  92          2HE       MET  92  16.733 -11.164  -4.206
  698   3HE   MET  92          3HE       MET  92  18.217 -11.673  -3.364
  699    H    GLY  93           H        GLY  93  14.161  -5.729  -7.710
  700   1HA   GLY  93          1HA       GLY  93  12.245  -5.688  -5.643
  701   2HA   GLY  93          2HA       GLY  93  13.386  -4.383  -5.390
  702    H    GLY  94           H        GLY  94  13.329  -2.539  -6.697
  703   1HA   GLY  94          1HA       GLY  94  12.397  -2.301  -9.262
  704   2HA   GLY  94          2HA       GLY  94  10.963  -2.163  -8.265
  705    H    GLY  95           H        GLY  95  10.556   0.051  -8.584
  706   1HA   GLY  95          1HA       GLY  95  12.501   1.846  -7.288
  707   2HA   GLY  95          2HA       GLY  95  11.900   2.214  -8.893
  708    H    PHE  96           H        PHE  96  11.293   4.196  -7.329
  709    HA   PHE  96           HA       PHE  96   8.532   3.685  -6.472
  710   1HB   PHE  96          1HB       PHE  96  10.269   5.889  -5.311
  711   2HB   PHE  96          2HB       PHE  96   8.973   5.006  -4.529
  712    HD1  PHE  96           1HD      PHE  96   9.394   2.894  -3.429
  713    HD2  PHE  96           2HD      PHE  96  12.525   4.943  -5.431
  714    HE1  PHE  96           1HE      PHE  96  11.081   1.421  -2.297
  715    HE2  PHE  96           2HE      PHE  96  14.212   3.470  -4.299
  716    HZ   PHE  96           HZ       PHE  96  13.470   1.726  -2.746
  717    H    THR  97           H        THR  97   7.166   4.698  -7.862
  718    HA   THR  97           HA       THR  97   7.909   7.411  -8.713
  719    HB   THR  97           HB       THR  97   7.108   4.996 -10.376
  720    HG1  THR  97           1HG      THR  97   8.920   7.299 -10.578
  721   1HG2  THR  97          1HG2      THR  97   5.506   6.842 -10.989
  722   2HG2  THR  97          2HG2      THR  97   6.890   7.941 -11.196
  723   3HG2  THR  97          3HG2      THR  97   6.697   6.540 -12.277
  724    H    ILE  98           H        ILE  98   6.312   8.922  -8.620
  725    HA   ILE  98           HA       ILE  98   3.608   7.926  -8.124
  726    HB   ILE  98           HB       ILE  98   4.948   8.485  -5.998
  727   1HG1  ILE  98          1HG1      ILE  98   2.212   9.639  -6.597
  728   2HG1  ILE  98          2HG1      ILE  98   2.580   8.050  -5.956
  729   1HG2  ILE  98          1HG2      ILE  98   5.752  10.692  -7.096
  730   2HG2  ILE  98          2HG2      ILE  98   4.162  11.324  -6.605
  731   3HG2  ILE  98          3HG2      ILE  98   5.287  10.694  -5.378
  732   1HD1  ILE  98          1HD1      ILE  98   3.653   9.176  -3.947
  733   2HD1  ILE  98          2HD1      ILE  98   3.056  10.729  -4.578
  734   3HD1  ILE  98          3HD1      ILE  98   1.903   9.461  -4.100
  735    H    ARG  99           H        ARG  99   2.003   9.123  -9.117
  736    HA   ARG  99           HA       ARG  99   2.967  11.511 -10.476
  737   1HB   ARG  99          1HB       ARG  99   1.261   9.215 -11.481
  738   2HB   ARG  99          2HB       ARG  99   1.028  10.807 -12.175
  739   1HG   ARG  99          1HG       ARG  99   3.701  10.755 -12.375
  740   2HG   ARG  99          2HG       ARG  99   3.461   9.021 -12.296
  741   1HD   ARG  99          1HD       ARG  99   2.527   8.923 -14.395
  742   2HD   ARG  99          2HD       ARG  99   1.591  10.385 -14.158
  743    HE   ARG  99           HE       ARG  99   4.067  10.228 -15.548
  744   1HH1  ARG  99          2HH2      ARG  99   2.523  12.244 -13.112
  745   2HH1  ARG  99          1HH2      ARG  99   3.409  13.668 -13.545
  746   1HH2  ARG  99          2HH1      ARG  99   5.236  12.106 -16.120
  747   2HH2  ARG  99          1HH1      ARG  99   4.963  13.589 -15.268
  748    H    ASN 100           H        ASN 100   1.570  13.336 -10.428
  749    HA   ASN 100           HA       ASN 100  -0.901  12.897  -8.942
  750   1HB   ASN 100          1HB       ASN 100   0.617  14.126  -7.490
  751   2HB   ASN 100          2HB       ASN 100   1.119  15.185  -8.793
  752   1HD2  ASN 100          1HD2      ASN 100   0.411  17.143  -8.471
  753   2HD2  ASN 100          2HD2      ASN 100  -1.165  17.620  -7.933
  754    HA   PRO 101           HA       PRO 101  -2.441  14.804 -12.625
  755   1HB   PRO 101          1HB       PRO 101  -5.108  14.619 -12.057
  756   2HB   PRO 101          2HB       PRO 101  -4.189  13.313 -12.779
  757   1HG   PRO 101          1HG       PRO 101  -5.160  13.581 -10.000
  758   2HG   PRO 101          2HG       PRO 101  -4.628  12.139 -10.843
  759   1HD   PRO 101          1HD       PRO 101  -3.147  13.630  -8.891
  760   2HD   PRO 101          2HD       PRO 101  -2.574  12.259  -9.819
  Start of MODEL    2
    1    H    MET   1           H        MET   1 -17.585   2.723  23.822
    2    HA   MET   1           HA       MET   1 -16.540   1.656  21.453
    3   1HB   MET   1          1HB       MET   1 -19.239   2.186  22.681
    4   2HB   MET   1          2HB       MET   1 -19.227   1.987  20.939
    5   1HG   MET   1          1HG       MET   1 -18.037  -0.203  21.195
    6   2HG   MET   1          2HG       MET   1 -18.045  -0.005  22.937
    7   1HE   MET   1          1HE       MET   1 -20.441  -2.505  23.310
    8   2HE   MET   1          2HE       MET   1 -20.021  -2.786  21.604
    9   3HE   MET   1          3HE       MET   1 -18.774  -2.233  22.748
   10    H    GLN   2           H        GLN   2 -15.969   2.667  19.575
   11    HA   GLN   2           HA       GLN   2 -17.488   4.799  18.569
   12   1HB   GLN   2          1HB       GLN   2 -15.055   5.446  20.158
   13   2HB   GLN   2          2HB       GLN   2 -15.132   6.227  18.591
   14   1HG   GLN   2          1HG       GLN   2 -16.580   7.742  19.450
   15   2HG   GLN   2          2HG       GLN   2 -17.754   6.460  19.671
   16   1HE2  GLN   2          1HE2      GLN   2 -18.281   8.037  21.445
   17   2HE2  GLN   2          2HE2      GLN   2 -17.554   7.781  22.996
   18    H    GLU   3           H        GLU   3 -16.003   5.870  16.618
   19    HA   GLU   3           HA       GLU   3 -14.313   3.806  15.523
   20   1HB   GLU   3          1HB       GLU   3 -17.040   4.438  14.544
   21   2HB   GLU   3          2HB       GLU   3 -15.817   4.467  13.289
   22   1HG   GLU   3          1HG       GLU   3 -15.075   2.186  13.907
   23   2HG   GLU   3          2HG       GLU   3 -16.202   2.156  15.250
   24    H    GLN   4           H        GLN   4 -12.837   4.605  13.897
   25    HA   GLN   4           HA       GLN   4 -12.931   7.507  13.625
   26   1HB   GLN   4          1HB       GLN   4 -11.085   6.259  15.169
   27   2HB   GLN   4          2HB       GLN   4 -10.265   6.132  13.626
   28   1HG   GLN   4          1HG       GLN   4 -11.439   8.815  14.163
   29   2HG   GLN   4          2HG       GLN   4 -10.177   8.348  15.286
   30   1HE2  GLN   4          1HE2      GLN   4 -10.561  10.174  12.790
   31   2HE2  GLN   4          2HE2      GLN   4  -9.113   9.936  11.870
   32    H    ALA   5           H        ALA   5 -12.765   8.272  11.537
   33    HA   ALA   5           HA       ALA   5 -13.039   6.554   9.394
   34   1HB   ALA   5          1HB       ALA   5 -11.793   9.054   8.619
   35   2HB   ALA   5          2HB       ALA   5 -13.477   8.520   8.399
   36   3HB   ALA   5          3HB       ALA   5 -12.993   9.340   9.902
   37    H    GLN   6           H        GLN   6 -11.644   5.230   8.344
   38    HA   GLN   6           HA       GLN   6  -8.835   5.976   8.438
   39   1HB   GLN   6          1HB       GLN   6  -8.140   3.741   8.980
   40   2HB   GLN   6          2HB       GLN   6  -9.375   4.175  10.146
   41   1HG   GLN   6          1HG       GLN   6 -10.658   3.005   7.819
   42   2HG   GLN   6          2HG       GLN   6  -9.362   1.946   8.339
   43   1HE2  GLN   6          1HE2      GLN   6 -12.314   1.732   8.472
   44   2HE2  GLN   6          2HE2      GLN   6 -12.713   1.400  10.124
   45    H    GLN   7           H        GLN   7 -10.599   6.583   6.328
   46    HA   GLN   7           HA       GLN   7  -9.701   4.644   4.342
   47   1HB   GLN   7          1HB       GLN   7 -11.770   5.086   3.060
   48   2HB   GLN   7          2HB       GLN   7 -12.138   4.449   4.650
   49   1HG   GLN   7          1HG       GLN   7 -12.296   6.979   5.375
   50   2HG   GLN   7          2HG       GLN   7 -12.416   7.305   3.657
   51   1HE2  GLN   7          1HE2      GLN   7 -14.063   6.130   2.430
   52   2HE2  GLN   7          2HE2      GLN   7 -15.589   5.777   3.170
   53    H    PHE   8           H        PHE   8  -8.012   5.632   3.301
   54    HA   PHE   8           HA       PHE   8  -8.173   8.508   2.884
   55   1HB   PHE   8          1HB       PHE   8  -5.755   8.180   2.314
   56   2HB   PHE   8          2HB       PHE   8  -6.114   7.409   3.846
   57    HD1  PHE   8           1HD      PHE   8  -5.387   5.243   4.179
   58    HD2  PHE   8           2HD      PHE   8  -6.010   6.591   0.203
   59    HE1  PHE   8           1HE      PHE   8  -4.478   3.075   3.301
   60    HE2  PHE   8           2HE      PHE   8  -5.101   4.422  -0.674
   61    HZ   PHE   8           HZ       PHE   8  -4.346   2.690   0.885
   62    H    ILE   9           H        ILE   9  -8.151   9.486   0.833
   63    HA   ILE   9           HA       ILE   9  -9.042   7.744  -1.298
   64    HB   ILE   9           HB       ILE   9  -8.981  10.703  -0.826
   65   1HG1  ILE   9          1HG1      ILE   9 -10.825   9.005  -0.065
   66   2HG1  ILE   9          2HG1      ILE   9 -11.268  10.564  -0.730
   67   1HG2  ILE   9          1HG2      ILE   9  -8.234  10.600  -3.074
   68   2HG2  ILE   9          2HG2      ILE   9  -9.382   9.300  -3.474
   69   3HG2  ILE   9          3HG2      ILE   9  -9.980  10.942  -3.132
   70   1HD1  ILE   9          1HD1      ILE   9 -11.123   7.951  -2.304
   71   2HD1  ILE   9          2HD1      ILE   9 -12.612   8.757  -1.757
   72   3HD1  ILE   9          3HD1      ILE   9 -11.576   9.535  -2.977
   73    H    PHE  10           H        PHE  10  -7.525   6.688  -2.463
   74    HA   PHE  10           HA       PHE  10  -5.487   8.230  -3.739
   75   1HB   PHE  10          1HB       PHE  10  -4.307   7.811  -1.647
   76   2HB   PHE  10          2HB       PHE  10  -4.976   6.198  -1.508
   77    HD1  PHE  10           1HD      PHE  10  -3.552   4.446  -1.940
   78    HD2  PHE  10           2HD      PHE  10  -2.868   8.142  -3.909
   79    HE1  PHE  10           1HE      PHE  10  -1.486   3.497  -3.005
   80    HE2  PHE  10           2HE      PHE  10  -0.802   7.193  -4.973
   81    HZ   PHE  10           HZ       PHE  10  -0.136   4.882  -4.508
   82    H    LYS  11           H        LYS  11  -4.465   7.057  -5.492
   83    HA   LYS  11           HA       LYS  11  -5.686   4.438  -5.999
   84   1HB   LYS  11          1HB       LYS  11  -5.343   6.674  -8.020
   85   2HB   LYS  11          2HB       LYS  11  -5.925   5.058  -8.368
   86   1HG   LYS  11          1HG       LYS  11  -7.289   6.726  -6.231
   87   2HG   LYS  11          2HG       LYS  11  -7.661   7.002  -7.922
   88   1HD   LYS  11          1HD       LYS  11  -8.841   5.046  -8.118
   89   2HD   LYS  11          2HD       LYS  11  -7.674   4.131  -7.185
   90   1HE   LYS  11          1HE       LYS  11  -8.832   4.409  -5.226
   91   2HE   LYS  11          2HE       LYS  11  -9.156   6.102  -5.545
   92   1HZ   LYS  11          1HZ       LYS  11 -11.185   5.494  -6.085
   93   2HZ   LYS  11          2HZ       LYS  11 -10.616   4.675  -7.377
   94   3HZ   LYS  11          3HZ       LYS  11 -10.834   3.905  -5.953
   95    H    VAL  12           H        VAL  12  -4.239   2.858  -6.475
   96    HA   VAL  12           HA       VAL  12  -1.555   3.751  -7.269
   97    HB   VAL  12           HB       VAL  12  -2.039   2.862  -4.832
   98   1HG1  VAL  12          1HG1      VAL  12  -1.976   0.549  -4.508
   99   2HG1  VAL  12          2HG1      VAL  12  -3.074   0.734  -5.896
  100   3HG1  VAL  12          3HG1      VAL  12  -1.386   0.233  -6.158
  101   1HG2  VAL  12          1HG2      VAL  12   0.257   2.220  -4.655
  102   2HG2  VAL  12          2HG2      VAL  12   0.336   1.787  -6.380
  103   3HG2  VAL  12          3HG2      VAL  12   0.163   3.491  -5.897
  104    H    THR  13           H        THR  13  -0.545   2.552  -8.900
  105    HA   THR  13           HA       THR  13  -2.262   1.175 -10.658
  106    HB   THR  13           HB       THR  13  -0.226   0.952 -11.983
  107    HG1  THR  13           1HG      THR  13   1.083   1.660  -9.454
  108   1HG2  THR  13          1HG2      THR  13   0.773   3.327 -10.528
  109   2HG2  THR  13          2HG2      THR  13   0.213   3.194 -12.212
  110   3HG2  THR  13          3HG2      THR  13  -0.964   3.436 -10.899
  111    H    ASP  14           H        ASP  14  -2.147  -1.048 -11.395
  112    HA   ASP  14           HA       ASP  14  -2.367  -2.796  -9.280
  113   1HB   ASP  14          1HB       ASP  14  -2.173  -3.029 -12.274
  114   2HB   ASP  14          2HB       ASP  14  -1.947  -4.502 -11.352
  115    H    LYS  15           H        LYS  15   0.386  -1.639 -11.138
  116    HA   LYS  15           HA       LYS  15   2.095  -3.846 -10.825
  117   1HB   LYS  15          1HB       LYS  15   2.170  -1.562 -12.266
  118   2HB   LYS  15          2HB       LYS  15   3.243  -1.105 -10.958
  119   1HG   LYS  15          1HG       LYS  15   3.518  -3.662 -12.608
  120   2HG   LYS  15          2HG       LYS  15   4.441  -2.198 -12.885
  121   1HD   LYS  15          1HD       LYS  15   5.941  -2.834 -11.312
  122   2HD   LYS  15          2HD       LYS  15   4.685  -2.809 -10.091
  123   1HE   LYS  15          1HE       LYS  15   4.272  -5.110 -10.257
  124   2HE   LYS  15          2HE       LYS  15   4.781  -5.194 -11.932
  125   1HZ   LYS  15          1HZ       LYS  15   6.760  -4.502  -9.922
  126   2HZ   LYS  15          2HZ       LYS  15   6.296  -6.062 -10.050
  127   3HZ   LYS  15          3HZ       LYS  15   6.955  -5.298 -11.334
  128    H    ALA  16           H        ALA  16   1.320  -0.992  -8.789
  129    HA   ALA  16           HA       ALA  16   3.377  -1.530  -6.906
  130   1HB   ALA  16          1HB       ALA  16   1.403   0.483  -7.450
  131   2HB   ALA  16          2HB       ALA  16   1.231  -0.029  -5.753
  132   3HB   ALA  16          3HB       ALA  16   2.799   0.566  -6.350
  133    H    VAL  17           H        VAL  17  -0.209  -2.088  -6.998
  134    HA   VAL  17           HA       VAL  17  -0.325  -3.356  -4.512
  135    HB   VAL  17           HB       VAL  17  -2.035  -2.872  -6.829
  136   1HG1  VAL  17          1HG1      VAL  17  -2.284  -5.217  -7.046
  137   2HG1  VAL  17          2HG1      VAL  17  -2.329  -5.458  -5.283
  138   3HG1  VAL  17          3HG1      VAL  17  -3.696  -4.673  -6.108
  139   1HG2  VAL  17          1HG2      VAL  17  -2.610  -3.164  -3.860
  140   2HG2  VAL  17          2HG2      VAL  17  -2.197  -1.650  -4.701
  141   3HG2  VAL  17          3HG2      VAL  17  -3.716  -2.495  -5.083
  142    H    GLU  18           H        GLU  18  -0.289  -4.775  -7.863
  143    HA   GLU  18           HA       GLU  18  -0.157  -7.380  -7.052
  144   1HB   GLU  18          1HB       GLU  18   0.396  -7.892  -9.301
  145   2HB   GLU  18          2HB       GLU  18  -0.501  -6.391  -9.411
  146   1HG   GLU  18          1HG       GLU  18   1.289  -5.696 -10.666
  147   2HG   GLU  18          2HG       GLU  18   2.024  -5.384  -9.106
  148    H    GLU  19           H        GLU  19   2.285  -4.865  -6.947
  149    HA   GLU  19           HA       GLU  19   4.489  -6.638  -6.931
  150   1HB   GLU  19          1HB       GLU  19   5.057  -4.475  -7.633
  151   2HB   GLU  19          2HB       GLU  19   4.061  -3.698  -6.418
  152   1HG   GLU  19          1HG       GLU  19   6.456  -3.440  -5.862
  153   2HG   GLU  19          2HG       GLU  19   5.643  -4.392  -4.635
  154    H    ILE  20           H        ILE  20   2.072  -5.709  -4.634
  155    HA   ILE  20           HA       ILE  20   3.728  -6.067  -2.318
  156    HB   ILE  20           HB       ILE  20   0.721  -5.915  -2.538
  157   1HG1  ILE  20          1HG1      ILE  20   1.299  -3.910  -3.502
  158   2HG1  ILE  20          2HG1      ILE  20   1.251  -3.463  -1.808
  159   1HG2  ILE  20          1HG2      ILE  20   0.854  -5.143  -0.203
  160   2HG2  ILE  20          2HG2      ILE  20   1.477  -6.797  -0.407
  161   3HG2  ILE  20          3HG2      ILE  20   2.610  -5.437  -0.216
  162   1HD1  ILE  20          1HD1      ILE  20   3.658  -3.909  -3.584
  163   2HD1  ILE  20          2HD1      ILE  20   3.305  -2.551  -2.489
  164   3HD1  ILE  20          3HD1      ILE  20   3.813  -4.122  -1.824
  165    H    LYS  21           H        LYS  21   0.996  -7.888  -3.877
  166    HA   LYS  21           HA       LYS  21   1.139 -10.080  -2.184
  167   1HB   LYS  21          1HB       LYS  21  -0.118 -11.246  -3.958
  168   2HB   LYS  21          2HB       LYS  21  -0.777  -9.664  -3.592
  169   1HG   LYS  21          1HG       LYS  21   0.812  -8.849  -5.561
  170   2HG   LYS  21          2HG       LYS  21   0.799 -10.538  -6.027
  171   1HD   LYS  21          1HD       LYS  21  -0.994  -9.234  -7.181
  172   2HD   LYS  21          2HD       LYS  21  -1.651 -10.534  -6.207
  173   1HE   LYS  21          1HE       LYS  21  -1.341  -7.994  -4.706
  174   2HE   LYS  21          2HE       LYS  21  -2.432  -7.860  -6.071
  175   1HZ   LYS  21          1HZ       LYS  21  -3.034 -10.234  -4.844
  176   2HZ   LYS  21          2HZ       LYS  21  -2.846  -9.162  -3.627
  177   3HZ   LYS  21          3HZ       LYS  21  -3.920  -8.862  -4.820
  178    H    LYS  22           H        LYS  22   3.286  -8.984  -4.714
  179    HA   LYS  22           HA       LYS  22   4.381 -11.530  -5.325
  180   1HB   LYS  22          1HB       LYS  22   4.581  -8.871  -6.290
  181   2HB   LYS  22          2HB       LYS  22   6.201  -9.353  -5.831
  182   1HG   LYS  22          1HG       LYS  22   5.277 -11.646  -7.098
  183   2HG   LYS  22          2HG       LYS  22   4.468 -10.389  -8.013
  184   1HD   LYS  22          1HD       LYS  22   6.411  -9.676  -8.984
  185   2HD   LYS  22          2HD       LYS  22   7.298  -9.735  -7.474
  186   1HE   LYS  22          1HE       LYS  22   7.963 -11.956  -7.778
  187   2HE   LYS  22          2HE       LYS  22   6.544 -12.370  -8.720
  188   1HZ   LYS  22          1HZ       LYS  22   7.490 -10.892 -10.471
  189   2HZ   LYS  22          2HZ       LYS  22   8.877 -10.836  -9.611
  190   3HZ   LYS  22          3HZ       LYS  22   8.334 -12.262 -10.193
  191    H    VAL  23           H        VAL  23   5.397  -8.770  -3.205
  192    HA   VAL  23           HA       VAL  23   7.666 -10.159  -2.235
  193    HB   VAL  23           HB       VAL  23   6.236  -7.618  -1.736
  194   1HG1  VAL  23          1HG1      VAL  23   7.769  -7.266   0.322
  195   2HG1  VAL  23          2HG1      VAL  23   6.260  -8.186   0.534
  196   3HG1  VAL  23          3HG1      VAL  23   7.815  -9.043   0.406
  197   1HG2  VAL  23          1HG2      VAL  23   8.498  -8.329  -3.073
  198   2HG2  VAL  23          2HG2      VAL  23   8.172  -6.693  -2.451
  199   3HG2  VAL  23          3HG2      VAL  23   9.182  -7.818  -1.511
  200    H    ALA  24           H        ALA  24   4.230 -10.180  -1.504
  201    HA   ALA  24           HA       ALA  24   4.530 -11.175   1.154
  202   1HB   ALA  24          1HB       ALA  24   2.078 -11.474  -0.593
  203   2HB   ALA  24          2HB       ALA  24   2.178 -11.217   1.166
  204   3HB   ALA  24          3HB       ALA  24   2.555  -9.883   0.049
  205    H    GLN  25           H        GLN  25   3.670 -12.604  -2.071
  206    HA   GLN  25           HA       GLN  25   3.423 -15.187  -1.122
  207   1HB   GLN  25          1HB       GLN  25   3.273 -15.824  -3.388
  208   2HB   GLN  25          2HB       GLN  25   2.738 -14.155  -3.408
  209   1HG   GLN  25          1HG       GLN  25   4.325 -13.788  -4.993
  210   2HG   GLN  25          2HG       GLN  25   5.510 -13.913  -3.708
  211   1HE2  GLN  25          1HE2      GLN  25   6.848 -15.610  -3.590
  212   2HE2  GLN  25          2HE2      GLN  25   6.885 -16.942  -4.697
  213    H    GLU  26           H        GLU  26   6.207 -13.183  -1.452
  214    HA   GLU  26           HA       GLU  26   7.979 -15.421  -1.832
  215   1HB   GLU  26          1HB       GLU  26   8.119 -12.518  -2.158
  216   2HB   GLU  26          2HB       GLU  26   9.493 -13.103  -1.240
  217   1HG   GLU  26          1HG       GLU  26   9.309 -15.007  -3.259
  218   2HG   GLU  26          2HG       GLU  26   8.797 -13.553  -4.093
  219    H    ASN  27           H        ASN  27   6.214 -14.283   0.710
  220    HA   ASN  27           HA       ASN  27   8.264 -15.161   2.568
  221   1HB   ASN  27          1HB       ASN  27   6.713 -12.572   2.593
  222   2HB   ASN  27          2HB       ASN  27   6.969 -13.353   4.140
  223   1HD2  ASN  27          1HD2      ASN  27   8.226 -11.293   1.846
  224   2HD2  ASN  27          2HD2      ASN  27   9.882 -11.228   2.348
  225    H    ASN  28           H        ASN  28   5.590 -16.069   1.144
  226    HA   ASN  28           HA       ASN  28   3.787 -17.185   1.603
  227   1HB   ASN  28          1HB       ASN  28   5.575 -18.499   2.970
  228   2HB   ASN  28          2HB       ASN  28   4.913 -17.720   4.394
  229   1HD2  ASN  28          1HD2      ASN  28   4.103 -19.507   5.349
  230   2HD2  ASN  28          2HD2      ASN  28   2.775 -20.440   4.744
  231    H    ILE  29           H        ILE  29   3.551 -14.401   2.075
  232    HA   ILE  29           HA       ILE  29   2.141 -14.180   4.626
  233    HB   ILE  29           HB       ILE  29   3.137 -12.095   2.681
  234   1HG1  ILE  29          1HG1      ILE  29   4.113 -12.873   5.446
  235   2HG1  ILE  29          2HG1      ILE  29   4.910 -13.263   3.935
  236   1HG2  ILE  29          1HG2      ILE  29   2.559 -10.527   4.610
  237   2HG2  ILE  29          2HG2      ILE  29   1.209 -11.148   3.630
  238   3HG2  ILE  29          3HG2      ILE  29   1.542 -11.849   5.232
  239   1HD1  ILE  29          1HD1      ILE  29   6.047 -11.315   4.569
  240   2HD1  ILE  29          2HD1      ILE  29   4.785 -10.647   3.506
  241   3HD1  ILE  29          3HD1      ILE  29   4.591 -10.573   5.274
  242    H    GLU  30           H        GLU  30  -0.054 -13.673   4.753
  243    HA   GLU  30           HA       GLU  30  -1.410 -13.705   2.169
  244   1HB   GLU  30          1HB       GLU  30  -1.646 -15.544   4.336
  245   2HB   GLU  30          2HB       GLU  30  -3.124 -14.603   4.338
  246   1HG   GLU  30          1HG       GLU  30  -3.594 -15.165   2.021
  247   2HG   GLU  30          2HG       GLU  30  -1.996 -15.849   1.795
  248    H    ASN  31           H        ASN  31  -0.452 -11.670   4.505
  249    HA   ASN  31           HA       ASN  31  -2.751  -9.999   4.094
  250   1HB   ASN  31          1HB       ASN  31  -3.199 -11.208   6.269
  251   2HB   ASN  31          2HB       ASN  31  -1.678 -10.609   6.900
  252   1HD2  ASN  31          1HD2      ASN  31  -4.614 -10.208   7.546
  253   2HD2  ASN  31          2HD2      ASN  31  -4.824  -8.495   7.685
  254    HA   PRO  32           HA       PRO  32   1.419  -8.044   4.135
  255   1HB   PRO  32          1HB       PRO  32   1.491  -7.173   1.546
  256   2HB   PRO  32          2HB       PRO  32   2.208  -8.684   2.069
  257   1HG   PRO  32          1HG       PRO  32  -0.294  -8.244   0.557
  258   2HG   PRO  32          2HG       PRO  32   0.647  -9.713   0.719
  259   1HD   PRO  32          1HD       PRO  32  -1.810  -9.092   2.063
  260   2HD   PRO  32          2HD       PRO  32  -0.809 -10.509   2.311
  261    H    ILE  33           H        ILE  33   1.258  -6.306   5.404
  262    HA   ILE  33           HA       ILE  33  -0.745  -4.356   4.597
  263    HB   ILE  33           HB       ILE  33   0.829  -4.868   7.104
  264   1HG1  ILE  33          1HG1      ILE  33  -2.145  -4.492   6.879
  265   2HG1  ILE  33          2HG1      ILE  33  -1.423  -6.014   6.396
  266   1HG2  ILE  33          1HG2      ILE  33   0.935  -2.471   6.790
  267   2HG2  ILE  33          2HG2      ILE  33  -0.813  -2.402   6.466
  268   3HG2  ILE  33          3HG2      ILE  33  -0.225  -2.858   8.083
  269   1HD1  ILE  33          1HD1      ILE  33  -2.149  -5.969   8.810
  270   2HD1  ILE  33          2HD1      ILE  33  -0.415  -6.319   8.605
  271   3HD1  ILE  33          3HD1      ILE  33  -0.942  -4.694   9.106
  272    H    LEU  34           H        LEU  34   0.073  -3.228   2.848
  273    HA   LEU  34           HA       LEU  34   2.795  -2.228   3.056
  274   1HB   LEU  34          1HB       LEU  34   1.504  -3.307   0.988
  275   2HB   LEU  34          2HB       LEU  34   1.026  -1.640   0.736
  276    HG   LEU  34           HG       LEU  34   2.942  -2.021  -0.603
  277   1HD1  LEU  34          1HD1      LEU  34   4.694  -0.531   0.515
  278   2HD1  LEU  34          2HD1      LEU  34   3.063   0.145   0.288
  279   3HD1  LEU  34          3HD1      LEU  34   3.567  -0.443   1.891
  280   1HD2  LEU  34          1HD2      LEU  34   4.920  -3.093   0.019
  281   2HD2  LEU  34          2HD2      LEU  34   4.590  -2.908   1.758
  282   3HD2  LEU  34          3HD2      LEU  34   3.645  -4.065   0.791
  283    H    ARG  35           H        ARG  35   3.213  -0.288   3.951
  284    HA   ARG  35           HA       ARG  35   0.974   1.561   4.060
  285   1HB   ARG  35          1HB       ARG  35   2.122   2.586   6.001
  286   2HB   ARG  35          2HB       ARG  35   1.913   0.866   6.266
  287   1HG   ARG  35          1HG       ARG  35   4.409   1.165   4.899
  288   2HG   ARG  35          2HG       ARG  35   4.380   2.403   6.140
  289   1HD   ARG  35          1HD       ARG  35   3.856   0.699   7.870
  290   2HD   ARG  35          2HD       ARG  35   3.780  -0.553   6.646
  291    HE   ARG  35           HE       ARG  35   6.140  -0.541   6.481
  292   1HH1  ARG  35          2HH2      ARG  35   5.032   2.138   8.476
  293   2HH1  ARG  35          1HH2      ARG  35   6.615   2.516   9.071
  294   1HH2  ARG  35          2HH1      ARG  35   8.228  -0.042   7.265
  295   2HH2  ARG  35          1HH1      ARG  35   8.444   1.268   8.377
  296    H    ILE  36           H        ILE  36   1.246   3.723   3.305
  297    HA   ILE  36           HA       ILE  36   3.629   4.095   1.663
  298    HB   ILE  36           HB       ILE  36   0.837   5.155   1.638
  299   1HG1  ILE  36          1HG1      ILE  36   1.345   4.706  -0.890
  300   2HG1  ILE  36          2HG1      ILE  36   2.696   3.771  -0.279
  301   1HG2  ILE  36          1HG2      ILE  36   2.288   7.155   1.635
  302   2HG2  ILE  36          2HG2      ILE  36   3.151   6.503   0.221
  303   3HG2  ILE  36          3HG2      ILE  36   1.426   6.923   0.095
  304   1HD1  ILE  36          1HD1      ILE  36   1.095   2.487   1.193
  305   2HD1  ILE  36          2HD1      ILE  36  -0.246   3.374   0.430
  306   3HD1  ILE  36          3HD1      ILE  36   0.773   2.289  -0.547
  307    H    ARG  37           H        ARG  37   5.310   5.036   2.695
  308    HA   ARG  37           HA       ARG  37   4.608   7.244   4.461
  309   1HB   ARG  37          1HB       ARG  37   5.959   4.876   5.152
  310   2HB   ARG  37          2HB       ARG  37   7.264   6.026   4.935
  311   1HG   ARG  37          1HG       ARG  37   5.091   7.296   6.401
  312   2HG   ARG  37          2HG       ARG  37   5.511   5.783   7.179
  313   1HD   ARG  37          1HD       ARG  37   7.926   7.245   6.369
  314   2HD   ARG  37          2HD       ARG  37   6.905   8.241   7.388
  315    HE   ARG  37           HE       ARG  37   7.072   5.618   8.538
  316   1HH1  ARG  37          2HH2      ARG  37   9.054   8.476   8.003
  317   2HH1  ARG  37          1HH2      ARG  37  10.073   8.183   9.373
  318   1HH2  ARG  37          2HH1      ARG  37   8.415   5.231  10.345
  319   2HH2  ARG  37          1HH1      ARG  37   9.707   6.324  10.714
  320    H    VAL  38           H        VAL  38   6.187   9.058   4.496
  321    HA   VAL  38           HA       VAL  38   7.186   9.604   1.900
  322    HB   VAL  38           HB       VAL  38   7.792  11.103   4.445
  323   1HG1  VAL  38          1HG1      VAL  38   7.365  12.074   1.600
  324   2HG1  VAL  38          2HG1      VAL  38   7.872  13.048   3.001
  325   3HG1  VAL  38          3HG1      VAL  38   8.952  11.790   2.353
  326   1HG2  VAL  38          1HG2      VAL  38   5.649  12.418   3.717
  327   2HG2  VAL  38          2HG2      VAL  38   5.208  10.890   2.919
  328   3HG2  VAL  38          3HG2      VAL  38   5.491  10.927   4.676
  329    H    VAL  39           H        VAL  39   9.467  10.170   1.396
  330    HA   VAL  39           HA       VAL  39  11.453   9.043   3.165
  331    HB   VAL  39           HB       VAL  39  10.719   7.855   0.500
  332   1HG1  VAL  39          1HG1      VAL  39  12.912   7.819  -0.014
  333   2HG1  VAL  39          2HG1      VAL  39  13.410   8.209   1.649
  334   3HG1  VAL  39          3HG1      VAL  39  13.015   6.530   1.210
  335   1HG2  VAL  39          1HG2      VAL  39  11.213   6.725   3.271
  336   2HG2  VAL  39          2HG2      VAL  39   9.679   6.772   2.368
  337   3HG2  VAL  39          3HG2      VAL  39  11.007   5.725   1.813
  338    HA   PRO  40           HA       PRO  40  13.109  12.630   1.234
  339   1HB   PRO  40          1HB       PRO  40  15.006  13.157   3.130
  340   2HB   PRO  40          2HB       PRO  40  13.361  13.752   3.229
  341   1HG   PRO  40          1HG       PRO  40  14.631  11.553   4.742
  342   2HG   PRO  40          2HG       PRO  40  13.160  12.432   5.109
  343   1HD   PRO  40          1HD       PRO  40  13.350   9.790   4.008
  344   2HD   PRO  40          2HD       PRO  40  11.884  10.715   4.267
  345    H    GLY  41           H        GLY  41  13.659  10.898  -0.418
  346   1HA   GLY  41          1HA       GLY  41  16.363   9.908  -0.200
  347   2HA   GLY  41          2HA       GLY  41  15.237   9.680  -1.523
  348    H    GLY  42           H        GLY  42  14.586  12.071  -2.534
  349   1HA   GLY  42          1HA       GLY  42  17.106  13.563  -2.900
  350   2HA   GLY  42          2HA       GLY  42  16.204  12.971  -4.281
  351    H    CYS  43           H        CYS  43  16.761  15.759  -3.756
  352    HA   CYS  43           HA       CYS  43  14.565  16.994  -2.516
  353   1HB   CYS  43          1HB       CYS  43  16.731  17.975  -4.380
  354   2HB   CYS  43          2HB       CYS  43  15.431  19.030  -3.861
  355    HG   CYS  43           HG       CYS  43  18.079  18.164  -2.449
  356    H    SER  44           H        SER  44  15.480  16.297  -5.960
  357    HA   SER  44           HA       SER  44  12.946  17.278  -6.851
  358   1HB   SER  44          1HB       SER  44  15.423  17.148  -8.012
  359   2HB   SER  44          2HB       SER  44  14.689  15.718  -8.710
  360    HG   SER  44           HG       SER  44  14.313  17.613 -10.020
  361    H    GLY  45           H        GLY  45  14.710  14.122  -6.620
  362   1HA   GLY  45          1HA       GLY  45  12.698  12.524  -7.764
  363   2HA   GLY  45          2HA       GLY  45  13.992  11.993  -6.709
  364    H    PHE  46           H        PHE  46  13.604  11.604  -4.505
  365    HA   PHE  46           HA       PHE  46  12.416  11.116  -2.714
  366   1HB   PHE  46          1HB       PHE  46  12.084  13.404  -2.201
  367   2HB   PHE  46          2HB       PHE  46  11.332  13.738  -3.748
  368    HD1  PHE  46           1HD      PHE  46   9.309  14.757  -3.263
  369    HD2  PHE  46           2HD      PHE  46  10.397  11.256  -1.127
  370    HE1  PHE  46           1HE      PHE  46   7.048  14.719  -2.174
  371    HE2  PHE  46           2HE      PHE  46   8.136  11.218  -0.038
  372    HZ   PHE  46           HZ       PHE  46   6.488  12.950  -0.574
  373    H    GLN  47           H        GLN  47  11.379   9.170  -2.908
  374    HA   GLN  47           HA       GLN  47   8.690   9.309  -4.001
  375   1HB   GLN  47          1HB       GLN  47  10.699   7.094  -4.606
  376   2HB   GLN  47          2HB       GLN  47   9.022   7.108  -5.117
  377   1HG   GLN  47          1HG       GLN  47   9.400   8.638  -6.794
  378   2HG   GLN  47          2HG       GLN  47  10.527   9.573  -5.833
  379   1HE2  GLN  47          1HE2      GLN  47  11.224   9.302  -8.320
  380   2HE2  GLN  47          2HE2      GLN  47  12.493   8.150  -8.571
  381    H    TYR  48           H        TYR  48   7.219   7.644  -3.129
  382    HA   TYR  48           HA       TYR  48   7.896   7.040  -0.394
  383   1HB   TYR  48          1HB       TYR  48   5.528   6.820  -2.321
  384   2HB   TYR  48          2HB       TYR  48   5.438   5.997  -0.777
  385    HD1  TYR  48           1HD      TYR  48   4.857   7.170   1.199
  386    HD2  TYR  48           2HD      TYR  48   5.877   9.353  -2.336
  387    HE1  TYR  48           1HE      TYR  48   4.066   9.325   2.293
  388    HE2  TYR  48           2HE      TYR  48   5.083  11.501  -1.230
  389    HH   TYR  48           HH       TYR  48   4.867  12.308   1.182
  390    H    ALA  49           H        ALA  49   9.042   5.244   0.121
  391    HA   ALA  49           HA       ALA  49   9.099   3.021  -1.701
  392   1HB   ALA  49          1HB       ALA  49  10.277   2.863   1.043
  393   2HB   ALA  49          2HB       ALA  49  10.970   2.394  -0.528
  394   3HB   ALA  49          3HB       ALA  49  10.931   4.108  -0.048
  395    H    MET  50           H        MET  50   8.628   0.766  -0.956
  396    HA   MET  50           HA       MET  50   6.144   0.822   0.509
  397   1HB   MET  50          1HB       MET  50   7.579  -1.084  -1.362
  398   2HB   MET  50          2HB       MET  50   6.393  -1.767  -0.267
  399   1HG   MET  50          1HG       MET  50   4.696  -1.036  -1.587
  400   2HG   MET  50          2HG       MET  50   5.251   0.619  -1.439
  401   1HE   MET  50          1HE       MET  50   3.803  -0.940  -3.560
  402   2HE   MET  50          2HE       MET  50   4.528  -0.636  -5.157
  403   3HE   MET  50          3HE       MET  50   4.815  -2.186  -4.329
  404    H    GLY  51           H        GLY  51   5.797  -1.392   1.867
  405   1HA   GLY  51          1HA       GLY  51   7.974  -2.574   3.166
  406   2HA   GLY  51          2HA       GLY  51   7.477  -1.188   4.116
  407    H    PHE  52           H        PHE  52   7.236  -4.267   4.454
  408    HA   PHE  52           HA       PHE  52   4.326  -4.335   4.831
  409   1HB   PHE  52          1HB       PHE  52   6.430  -6.576   4.670
  410   2HB   PHE  52          2HB       PHE  52   4.697  -6.825   4.736
  411    HD1  PHE  52           1HD      PHE  52   7.207  -5.005   2.650
  412    HD2  PHE  52           2HD      PHE  52   3.598  -7.234   2.753
  413    HE1  PHE  52           1HE      PHE  52   7.103  -4.952   0.143
  414    HE2  PHE  52           2HE      PHE  52   3.494  -7.181   0.246
  415    HZ   PHE  52           HZ       PHE  52   5.248  -6.041  -1.029
  416    H    ASP  53           H        ASP  53   3.729  -3.956   6.910
  417    HA   ASP  53           HA       ASP  53   5.604  -4.829   8.960
  418   1HB   ASP  53          1HB       ASP  53   4.303  -2.360   8.555
  419   2HB   ASP  53          2HB       ASP  53   3.379  -3.108   9.842
  420    H    ASP  54           H        ASP  54   4.189  -5.233  11.175
  421    HA   ASP  54           HA       ASP  54   1.836  -6.757  10.385
  422   1HB   ASP  54          1HB       ASP  54   4.027  -8.076  11.007
  423   2HB   ASP  54          2HB       ASP  54   3.678  -7.590  12.654
  424    H    THR  55           H        THR  55   1.140  -4.355  11.127
  425    HA   THR  55           HA       THR  55  -0.173  -4.558  13.566
  426    HB   THR  55           HB       THR  55   1.956  -4.376  14.706
  427    HG1  THR  55           1HG      THR  55   0.428  -2.912  15.596
  428   1HG2  THR  55          1HG2      THR  55   3.464  -3.543  12.983
  429   2HG2  THR  55          2HG2      THR  55   2.473  -2.083  12.747
  430   3HG2  THR  55          3HG2      THR  55   3.400  -2.295  14.251
  431    H    VAL  56           H        VAL  56  -1.036  -2.284  14.270
  432    HA   VAL  56           HA       VAL  56  -1.266  -0.589  11.896
  433    HB   VAL  56           HB       VAL  56  -3.327  -2.248  13.127
  434   1HG1  VAL  56          1HG1      VAL  56  -5.131  -0.563  13.004
  435   2HG1  VAL  56          2HG1      VAL  56  -3.938  -0.179  14.268
  436   3HG1  VAL  56          3HG1      VAL  56  -3.914   0.705  12.724
  437   1HG2  VAL  56          1HG2      VAL  56  -3.521  -2.592  10.924
  438   2HG2  VAL  56          2HG2      VAL  56  -4.341  -1.014  10.841
  439   3HG2  VAL  56          3HG2      VAL  56  -2.591  -1.125  10.537
  440    H    GLU  57           H        GLU  57  -1.947   1.633  12.414
  441    HA   GLU  57           HA       GLU  57  -0.891   2.349  14.993
  442   1HB   GLU  57          1HB       GLU  57  -1.887   4.318  12.919
  443   2HB   GLU  57          2HB       GLU  57  -0.626   4.537  14.115
  444   1HG   GLU  57          1HG       GLU  57   0.770   2.809  12.910
  445   2HG   GLU  57          2HG       GLU  57  -0.477   2.691  11.685
  446    H    GLU  58           H        GLU  58  -2.092   4.355  16.080
  447    HA   GLU  58           HA       GLU  58  -4.756   3.404  16.539
  448   1HB   GLU  58          1HB       GLU  58  -2.745   4.754  18.064
  449   2HB   GLU  58          2HB       GLU  58  -4.132   5.823  18.006
  450   1HG   GLU  58          1HG       GLU  58  -5.606   3.942  18.767
  451   2HG   GLU  58          2HG       GLU  58  -4.211   2.884  18.840
  452    H    GLY  59           H        GLY  59  -4.129   4.622  13.909
  453   1HA   GLY  59          1HA       GLY  59  -6.379   6.062  13.394
  454   2HA   GLY  59          2HA       GLY  59  -5.227   7.280  13.902
  455    H    ASP  60           H        ASP  60  -5.186   4.272  11.845
  456    HA   ASP  60           HA       ASP  60  -3.740   5.876   9.884
  457   1HB   ASP  60          1HB       ASP  60  -2.976   3.457  11.158
  458   2HB   ASP  60          2HB       ASP  60  -3.471   2.974   9.548
  459    H    HIS  61           H        HIS  61  -4.799   6.033   7.887
  460    HA   HIS  61           HA       HIS  61  -7.343   4.884   7.589
  461   1HB   HIS  61          1HB       HIS  61  -5.496   6.427   5.773
  462   2HB   HIS  61          2HB       HIS  61  -7.010   5.776   5.178
  463    HD1  HIS  61           1HD      HIS  61  -6.814   7.132   8.695
  464    HD2  HIS  61           2HD      HIS  61  -8.138   8.348   4.905
  465    HE1  HIS  61           1HE      HIS  61  -8.180   9.255   9.063
  466    H    VAL  62           H        VAL  62  -7.512   2.673   7.510
  467    HA   VAL  62           HA       VAL  62  -5.580   1.204   5.919
  468    HB   VAL  62           HB       VAL  62  -6.791   0.714   8.299
  469   1HG1  VAL  62          1HG1      VAL  62  -8.430  -1.045   8.059
  470   2HG1  VAL  62          2HG1      VAL  62  -8.987   0.385   7.157
  471   3HG1  VAL  62          3HG1      VAL  62  -8.284  -0.998   6.286
  472   1HG2  VAL  62          1HG2      VAL  62  -5.501  -1.070   6.249
  473   2HG2  VAL  62          2HG2      VAL  62  -4.871  -0.495   7.811
  474   3HG2  VAL  62          3HG2      VAL  62  -6.121  -1.761   7.767
  475    H    PHE  63           H        PHE  63  -5.926   0.648   3.831
  476    HA   PHE  63           HA       PHE  63  -8.704   0.810   2.891
  477   1HB   PHE  63          1HB       PHE  63  -6.436   2.255   2.131
  478   2HB   PHE  63          2HB       PHE  63  -6.365   0.918   1.000
  479    HD1  PHE  63           1HD      PHE  63  -9.102   3.071   2.373
  480    HD2  PHE  63           2HD      PHE  63  -7.208   1.457  -1.064
  481    HE1  PHE  63           1HE      PHE  63 -10.783   4.222   0.906
  482    HE2  PHE  63           2HE      PHE  63  -8.888   2.608  -2.531
  483    HZ   PHE  63           HZ       PHE  63 -10.656   3.977  -1.528
  484    H    GLU  64           H        GLU  64  -9.598  -1.072   2.193
  485    HA   GLU  64           HA       GLU  64  -7.963  -3.386   2.123
  486   1HB   GLU  64          1HB       GLU  64 -10.902  -2.973   1.417
  487   2HB   GLU  64          2HB       GLU  64 -10.124  -4.538   1.535
  488   1HG   GLU  64          1HG       GLU  64  -9.534  -4.064   3.922
  489   2HG   GLU  64          2HG       GLU  64 -10.315  -2.500   3.804
  490    H    TYR  65           H        TYR  65  -7.003  -4.358   0.370
  491    HA   TYR  65           HA       TYR  65  -7.698  -3.240  -2.262
  492   1HB   TYR  65          1HB       TYR  65  -5.210  -3.998  -0.744
  493   2HB   TYR  65          2HB       TYR  65  -5.210  -4.529  -2.414
  494    HD1  TYR  65           1HD      TYR  65  -5.801  -2.687  -4.206
  495    HD2  TYR  65           2HD      TYR  65  -4.481  -1.841  -0.225
  496    HE1  TYR  65           1HE      TYR  65  -5.059  -0.367  -4.936
  497    HE2  TYR  65           2HE      TYR  65  -3.745   0.476  -0.969
  498    HH   TYR  65           HH       TYR  65  -3.025   1.530  -3.118
  499    H    ASP  66           H        ASP  66  -6.323  -5.139  -3.834
  500    HA   ASP  66           HA       ASP  66  -8.267  -7.114  -3.974
  501   1HB   ASP  66          1HB       ASP  66  -6.582  -6.187  -5.768
  502   2HB   ASP  66          2HB       ASP  66  -5.470  -7.384  -5.135
  503    H    GLY  67           H        GLY  67  -8.045  -7.804  -1.574
  504   1HA   GLY  67          1HA       GLY  67  -7.547  -9.483  -0.148
  505   2HA   GLY  67          2HA       GLY  67  -6.595 -10.251  -1.403
  506    H    VAL  68           H        VAL  68  -6.127  -6.891  -0.203
  507    HA   VAL  68           HA       VAL  68  -3.865  -7.714   1.396
  508    HB   VAL  68           HB       VAL  68  -3.583  -6.028  -1.097
  509   1HG1  VAL  68          1HG1      VAL  68  -1.321  -5.564  -0.473
  510   2HG1  VAL  68          2HG1      VAL  68  -2.349  -5.120   0.910
  511   3HG1  VAL  68          3HG1      VAL  68  -1.423  -6.640   0.942
  512   1HG2  VAL  68          1HG2      VAL  68  -2.483  -8.725  -0.268
  513   2HG2  VAL  68          2HG2      VAL  68  -3.484  -8.327  -1.685
  514   3HG2  VAL  68          3HG2      VAL  68  -1.796  -7.767  -1.602
  515    H    LYS  69           H        LYS  69  -3.138  -5.997   2.826
  516    HA   LYS  69           HA       LYS  69  -5.179  -3.902   3.069
  517   1HB   LYS  69          1HB       LYS  69  -3.480  -5.310   5.141
  518   2HB   LYS  69          2HB       LYS  69  -4.378  -3.845   5.482
  519   1HG   LYS  69          1HG       LYS  69  -6.382  -4.942   5.540
  520   2HG   LYS  69          2HG       LYS  69  -6.025  -5.862   4.092
  521   1HD   LYS  69          1HD       LYS  69  -4.777  -7.521   5.326
  522   2HD   LYS  69          2HD       LYS  69  -4.704  -6.513   6.758
  523   1HE   LYS  69          1HE       LYS  69  -6.553  -7.619   7.490
  524   2HE   LYS  69          2HE       LYS  69  -7.458  -6.720   6.289
  525   1HZ   LYS  69          1HZ       LYS  69  -6.865  -9.448   6.330
  526   2HZ   LYS  69          2HZ       LYS  69  -7.837  -8.633   5.301
  527   3HZ   LYS  69          3HZ       LYS  69  -6.247  -8.800   4.964
  528    H    VAL  70           H        VAL  70  -4.533  -1.730   3.418
  529    HA   VAL  70           HA       VAL  70  -1.678  -1.194   3.292
  530    HB   VAL  70           HB       VAL  70  -3.698  -0.497   1.188
  531   1HG1  VAL  70          1HG1      VAL  70  -1.148   1.066   1.723
  532   2HG1  VAL  70          2HG1      VAL  70  -2.252   1.284   0.344
  533   3HG1  VAL  70          3HG1      VAL  70  -2.805   1.658   1.994
  534   1HG2  VAL  70          1HG2      VAL  70  -1.599  -0.954  -0.242
  535   2HG2  VAL  70          2HG2      VAL  70  -0.898  -1.628   1.249
  536   3HG2  VAL  70          3HG2      VAL  70  -2.380  -2.336   0.563
  537    H    VAL  71           H        VAL  71  -1.151   0.999   3.989
  538    HA   VAL  71           HA       VAL  71  -3.372   2.519   5.084
  539    HB   VAL  71           HB       VAL  71  -2.652   2.498   7.284
  540   1HG1  VAL  71          1HG1      VAL  71  -1.978  -0.334   6.442
  541   2HG1  VAL  71          2HG1      VAL  71  -2.695   0.219   7.974
  542   3HG1  VAL  71          3HG1      VAL  71  -3.638   0.309   6.467
  543   1HG2  VAL  71          1HG2      VAL  71  -0.253   2.903   6.797
  544   2HG2  VAL  71          2HG2      VAL  71  -0.501   1.698   8.084
  545   3HG2  VAL  71          3HG2      VAL  71  -0.053   1.170   6.444
  546    H    ILE  72           H        ILE  72  -2.606   4.725   5.822
  547    HA   ILE  72           HA       ILE  72  -0.033   5.484   4.713
  548    HB   ILE  72           HB       ILE  72  -2.578   6.841   3.828
  549   1HG1  ILE  72          1HG1      ILE  72  -0.912   4.713   2.483
  550   2HG1  ILE  72          2HG1      ILE  72  -2.640   4.724   2.776
  551   1HG2  ILE  72          1HG2      ILE  72  -0.210   8.012   4.018
  552   2HG2  ILE  72          2HG2      ILE  72   0.061   7.174   2.471
  553   3HG2  ILE  72          3HG2      ILE  72  -1.298   8.311   2.642
  554   1HD1  ILE  72          1HD1      ILE  72  -2.875   6.683   1.220
  555   2HD1  ILE  72          2HD1      ILE  72  -1.130   6.582   0.882
  556   3HD1  ILE  72          3HD1      ILE  72  -2.205   5.242   0.417
  557    H    ASP  73           H        ASP  73   0.977   6.840   6.102
  558    HA   ASP  73           HA       ASP  73   0.031   7.418   8.533
  559   1HB   ASP  73          1HB       ASP  73   2.136   8.514   6.754
  560   2HB   ASP  73          2HB       ASP  73   1.606   9.657   7.972
  561    HA   PRO  74           HA       PRO  74  -2.717  10.799   8.040
  562   1HB   PRO  74          1HB       PRO  74  -2.405  12.205  10.362
  563   2HB   PRO  74          2HB       PRO  74  -3.360  10.741  10.250
  564   1HG   PRO  74          1HG       PRO  74  -0.677  11.117  11.434
  565   2HG   PRO  74          2HG       PRO  74  -1.811   9.804  11.680
  566   1HD   PRO  74          1HD       PRO  74   0.550   9.751  10.051
  567   2HD   PRO  74          2HD       PRO  74  -0.646   8.479  10.206
  568    H    PHE  75           H        PHE  75   0.602  11.499   8.557
  569    HA   PHE  75           HA       PHE  75   0.221  14.252   7.750
  570   1HB   PHE  75          1HB       PHE  75   2.387  12.414   8.801
  571   2HB   PHE  75          2HB       PHE  75   2.937  13.777   7.847
  572    HD1  PHE  75           1HD      PHE  75   2.711  12.811  11.041
  573    HD2  PHE  75           2HD      PHE  75   1.323  15.994   8.602
  574    HE1  PHE  75           1HE      PHE  75   2.550  14.291  13.063
  575    HE2  PHE  75           2HE      PHE  75   1.162  17.473  10.623
  576    HZ   PHE  75           HZ       PHE  75   1.777  16.604  12.830
  577    H    SER  76           H        SER  76   1.114  11.112   6.392
  578    HA   SER  76           HA       SER  76   2.269  12.355   4.073
  579   1HB   SER  76          1HB       SER  76   3.317  10.366   3.824
  580   2HB   SER  76          2HB       SER  76   2.623   9.896   5.363
  581    HG   SER  76           HG       SER  76   1.981   9.044   2.784
  582    H    MET  77           H        MET  77  -0.819  11.260   5.248
  583    HA   MET  77           HA       MET  77  -1.995  10.368   2.933
  584   1HB   MET  77          1HB       MET  77  -2.742  10.934   5.594
  585   2HB   MET  77          2HB       MET  77  -3.741  12.036   4.667
  586   1HG   MET  77          1HG       MET  77  -3.572   9.199   3.675
  587   2HG   MET  77          2HG       MET  77  -4.470   9.467   5.156
  588   1HE   MET  77          1HE       MET  77  -3.716  10.333   1.733
  589   2HE   MET  77          2HE       MET  77  -5.264   9.755   1.071
  590   3HE   MET  77          3HE       MET  77  -4.940  11.502   1.182
  591    HA   PRO  78           HA       PRO  78  -3.148  14.898   2.104
  592   1HB   PRO  78          1HB       PRO  78  -1.954  16.892   3.541
  593   2HB   PRO  78          2HB       PRO  78  -3.529  16.235   3.939
  594   1HG   PRO  78          1HG       PRO  78  -0.935  15.778   5.283
  595   2HG   PRO  78          2HG       PRO  78  -2.553  15.490   5.892
  596   1HD   PRO  78          1HD       PRO  78  -0.708  13.519   4.925
  597   2HD   PRO  78          2HD       PRO  78  -2.365  13.247   5.425
  598    H    TYR  79           H        TYR  79  -0.243  13.475   2.234
  599    HA   TYR  79           HA       TYR  79   1.110  15.540   0.692
  600   1HB   TYR  79          1HB       TYR  79   1.805  13.596   2.603
  601   2HB   TYR  79          2HB       TYR  79   2.244  12.786   1.112
  602    HD1  TYR  79           1HD      TYR  79   3.227  15.221   3.560
  603    HD2  TYR  79           2HD      TYR  79   3.852  13.997  -0.492
  604    HE1  TYR  79           1HE      TYR  79   5.424  16.499   3.505
  605    HE2  TYR  79           2HE      TYR  79   6.047  15.279  -0.533
  606    HH   TYR  79           HH       TYR  79   7.244  16.897   2.385
  607    H    VAL  80           H        VAL  80  -0.600  12.461   0.312
  608    HA   VAL  80           HA       VAL  80  -0.179  12.702  -2.566
  609    HB   VAL  80           HB       VAL  80   0.268  10.347  -2.791
  610   1HG1  VAL  80          1HG1      VAL  80   2.493  10.508  -2.370
  611   2HG1  VAL  80          2HG1      VAL  80   2.069  12.191  -1.974
  612   3HG1  VAL  80          3HG1      VAL  80   2.251  10.989  -0.674
  613   1HG2  VAL  80          1HG2      VAL  80  -0.659  10.245  -0.040
  614   2HG2  VAL  80          2HG2      VAL  80  -0.469   8.932  -1.227
  615   3HG2  VAL  80          3HG2      VAL  80   0.913   9.429  -0.221
  616    H    ASN  81           H        ASN  81  -2.358  13.492  -0.748
  617    HA   ASN  81           HA       ASN  81  -4.320  11.512  -0.750
  618   1HB   ASN  81          1HB       ASN  81  -4.276  13.626   0.684
  619   2HB   ASN  81          2HB       ASN  81  -4.698  14.553  -0.742
  620   1HD2  ASN  81          1HD2      ASN  81  -6.651  13.827  -1.944
  621   2HD2  ASN  81          2HD2      ASN  81  -8.035  13.314  -1.038
  622    H    GLY  82           H        GLY  82  -5.309  10.698  -2.603
  623   1HA   GLY  82          1HA       GLY  82  -6.643  10.860  -4.472
  624   2HA   GLY  82          2HA       GLY  82  -6.242  12.558  -4.639
  625    H    ALA  83           H        ALA  83  -3.306  12.193  -4.388
  626    HA   ALA  83           HA       ALA  83  -2.657  11.912  -7.052
  627   1HB   ALA  83          1HB       ALA  83  -1.158  11.864  -4.442
  628   2HB   ALA  83          2HB       ALA  83  -0.293  11.455  -5.943
  629   3HB   ALA  83          3HB       ALA  83  -1.081  13.042  -5.774
  630    H    GLU  84           H        GLU  84  -0.702  10.170  -7.584
  631    HA   GLU  84           HA       GLU  84  -1.678   7.570  -6.740
  632   1HB   GLU  84          1HB       GLU  84  -1.233   8.426  -9.633
  633   2HB   GLU  84          2HB       GLU  84  -1.486   6.767  -9.129
  634   1HG   GLU  84          1HG       GLU  84  -3.728   7.086  -9.140
  635   2HG   GLU  84          2HG       GLU  84  -3.569   8.335  -7.921
  636    H    LEU  85           H        LEU  85  -0.047   6.020  -6.468
  637    HA   LEU  85           HA       LEU  85   2.660   7.007  -7.035
  638   1HB   LEU  85          1HB       LEU  85   3.090   6.634  -4.913
  639   2HB   LEU  85          2HB       LEU  85   1.447   6.083  -4.650
  640    HG   LEU  85           HG       LEU  85   2.121   3.782  -5.260
  641   1HD1  LEU  85          1HD1      LEU  85   4.563   5.146  -6.093
  642   2HD1  LEU  85          2HD1      LEU  85   4.880   3.748  -5.037
  643   3HD1  LEU  85          3HD1      LEU  85   3.935   3.539  -6.531
  644   1HD2  LEU  85          1HD2      LEU  85   2.971   5.276  -2.920
  645   2HD2  LEU  85          2HD2      LEU  85   2.272   3.643  -3.047
  646   3HD2  LEU  85          3HD2      LEU  85   4.027   3.877  -3.227
  647    H    ASP  86           H        ASP  86   3.442   6.122  -8.872
  648    HA   ASP  86           HA       ASP  86   2.508   3.480  -9.566
  649   1HB   ASP  86          1HB       ASP  86   3.193   3.965 -11.767
  650   2HB   ASP  86          2HB       ASP  86   2.681   5.534 -11.176
  651    H    TYR  87           H        TYR  87   3.868   1.667  -9.374
  652    HA   TYR  87           HA       TYR  87   6.462   2.095  -8.180
  653   1HB   TYR  87          1HB       TYR  87   4.631   0.329  -7.593
  654   2HB   TYR  87          2HB       TYR  87   4.986  -0.437  -9.128
  655    HD1  TYR  87           1HD      TYR  87   6.452   0.449  -5.825
  656    HD2  TYR  87           2HD      TYR  87   6.829  -1.924  -9.365
  657    HE1  TYR  87           1HE      TYR  87   8.302  -0.907  -4.728
  658    HE2  TYR  87           2HE      TYR  87   8.677  -3.272  -8.256
  659    HH   TYR  87           HH       TYR  87  10.278  -3.039  -6.519
  660    H    VAL  88           H        VAL  88   8.371   2.130  -9.258
  661    HA   VAL  88           HA       VAL  88   8.378   1.812 -12.080
  662    HB   VAL  88           HB       VAL  88  10.551   2.210 -10.018
  663   1HG1  VAL  88          1HG1      VAL  88  11.805   1.301 -11.726
  664   2HG1  VAL  88          2HG1      VAL  88  10.694   1.867 -12.995
  665   3HG1  VAL  88          3HG1      VAL  88  11.797   3.016 -12.201
  666   1HG2  VAL  88          1HG2      VAL  88   8.744   3.992 -11.531
  667   2HG2  VAL  88          2HG2      VAL  88   9.609   4.260  -9.998
  668   3HG2  VAL  88          3HG2      VAL  88  10.458   4.473 -11.548
  669    H    VAL  89           H        VAL  89   9.626   0.240 -13.316
  670    HA   VAL  89           HA       VAL  89  10.096  -2.245 -11.824
  671    HB   VAL  89           HB       VAL  89   8.911  -2.069 -14.595
  672   1HG1  VAL  89          1HG1      VAL  89  10.145  -4.151 -13.962
  673   2HG1  VAL  89          2HG1      VAL  89   8.989  -4.380 -12.628
  674   3HG1  VAL  89          3HG1      VAL  89   8.421  -4.414 -14.315
  675   1HG2  VAL  89          1HG2      VAL  89   7.089  -1.261 -13.495
  676   2HG2  VAL  89          2HG2      VAL  89   6.849  -2.987 -13.128
  677   3HG2  VAL  89          3HG2      VAL  89   7.606  -1.917 -11.923
  678    H    ASP  90           H        ASP  90  12.191  -2.842 -11.966
  679    HA   ASP  90           HA       ASP  90  13.497  -2.750 -14.467
  680   1HB   ASP  90          1HB       ASP  90  14.472  -0.927 -12.218
  681   2HB   ASP  90          2HB       ASP  90  15.421  -1.320 -13.638
  682    H    PHE  91           H        PHE  91  16.148  -3.112 -13.700
  683    HA   PHE  91           HA       PHE  91  17.379  -4.881 -13.074
  684   1HB   PHE  91          1HB       PHE  91  17.104  -2.957 -11.177
  685   2HB   PHE  91          2HB       PHE  91  16.346  -4.255 -10.277
  686    HD1  PHE  91           1HD      PHE  91  19.348  -4.127 -12.502
  687    HD2  PHE  91           2HD      PHE  91  17.786  -5.038  -8.663
  688    HE1  PHE  91           1HE      PHE  91  21.608  -4.943 -11.777
  689    HE2  PHE  91           2HE      PHE  91  20.046  -5.854  -7.938
  690    HZ   PHE  91           HZ       PHE  91  21.930  -5.797  -9.503
  691    H    MET  92           H        MET  92  16.788  -6.141 -10.257
  692    HA   MET  92           HA       MET  92  15.151  -8.238 -11.382
  693   1HB   MET  92          1HB       MET  92  17.338  -7.994  -9.430
  694   2HB   MET  92          2HB       MET  92  16.007  -8.895  -8.731
  695   1HG   MET  92          1HG       MET  92  16.077 -10.115 -11.156
  696   2HG   MET  92          2HG       MET  92  17.750  -9.597 -11.082
  697   1HE   MET  92          1HE       MET  92  19.508 -11.909  -9.423
  698   2HE   MET  92          2HE       MET  92  18.478 -12.829 -10.547
  699   3HE   MET  92          3HE       MET  92  19.003 -11.181 -10.967
  700    H    GLY  93           H        GLY  93  14.014  -5.588 -10.478
  701   1HA   GLY  93          1HA       GLY  93  11.747  -6.601  -9.105
  702   2HA   GLY  93          2HA       GLY  93  12.780  -5.715  -8.001
  703    H    GLY  94           H        GLY  94  12.793  -3.468  -8.023
  704   1HA   GLY  94          1HA       GLY  94  12.303  -1.808 -10.167
  705   2HA   GLY  94          2HA       GLY  94  10.726  -2.158  -9.487
  706    H    GLY  95           H        GLY  95  10.336  -0.064  -8.648
  707   1HA   GLY  95          1HA       GLY  95  11.589   0.464  -6.103
  708   2HA   GLY  95          2HA       GLY  95  11.998   1.629  -7.347
  709    H    PHE  96           H        PHE  96  10.835   3.201  -5.923
  710    HA   PHE  96           HA       PHE  96   7.933   2.985  -6.323
  711   1HB   PHE  96          1HB       PHE  96   8.297   4.777  -4.254
  712   2HB   PHE  96          2HB       PHE  96   8.077   3.059  -3.988
  713    HD1  PHE  96           1HD      PHE  96  10.093   5.786  -3.227
  714    HD2  PHE  96           2HD      PHE  96  10.356   1.658  -4.172
  715    HE1  PHE  96           1HE      PHE  96  12.336   5.672  -2.106
  716    HE2  PHE  96           2HE      PHE  96  12.599   1.543  -3.052
  717    HZ   PHE  96           HZ       PHE  96  13.562   3.552  -2.032
  718    H    THR  97           H        THR  97   6.950   4.620  -7.446
  719    HA   THR  97           HA       THR  97   8.306   7.194  -7.618
  720    HB   THR  97           HB       THR  97   7.857   5.226  -9.882
  721    HG1  THR  97           1HG      THR  97   9.780   7.269  -9.017
  722   1HG2  THR  97          1HG2      THR  97   8.249   8.225 -10.295
  723   2HG2  THR  97          2HG2      THR  97   7.923   6.985 -11.528
  724   3HG2  THR  97          3HG2      THR  97   6.640   7.472 -10.395
  725    H    ILE  98           H        ILE  98   6.909   8.923  -8.412
  726    HA   ILE  98           HA       ILE  98   4.076   8.203  -8.121
  727    HB   ILE  98           HB       ILE  98   5.664  10.403  -6.849
  728   1HG1  ILE  98          1HG1      ILE  98   3.873   9.609  -5.013
  729   2HG1  ILE  98          2HG1      ILE  98   3.932   8.141  -5.969
  730   1HG2  ILE  98          1HG2      ILE  98   3.974  11.675  -7.901
  731   2HG2  ILE  98          2HG2      ILE  98   2.722  10.462  -7.540
  732   3HG2  ILE  98          3HG2      ILE  98   3.431  11.429  -6.224
  733   1HD1  ILE  98          1HD1      ILE  98   5.625   8.296  -4.049
  734   2HD1  ILE  98          2HD1      ILE  98   6.305   7.893  -5.644
  735   3HD1  ILE  98          3HD1      ILE  98   6.456   9.547  -5.004
  736    H    ARG  99           H        ARG  99   2.624   9.202  -9.544
  737    HA   ARG  99           HA       ARG  99   3.933  10.847 -11.559
  738   1HB   ARG  99          1HB       ARG  99   2.986   8.329 -12.045
  739   2HB   ARG  99          2HB       ARG  99   1.513   9.236 -12.328
  740   1HG   ARG  99          1HG       ARG  99   3.141  10.804 -13.770
  741   2HG   ARG  99          2HG       ARG  99   4.136   9.362 -13.821
  742   1HD   ARG  99          1HD       ARG  99   1.221   8.962 -14.408
  743   2HD   ARG  99          2HD       ARG  99   2.129   9.862 -15.608
  744    HE   ARG  99           HE       ARG  99   3.352   7.918 -16.139
  745   1HH1  ARG  99          2HH2      ARG  99   1.491   7.402 -13.198
  746   2HH1  ARG  99          1HH2      ARG  99   1.788   5.696 -13.157
  747   1HH2  ARG  99          2HH1      ARG  99   3.744   5.667 -16.086
  748   2HH2  ARG  99          1HH1      ARG  99   3.077   4.703 -14.811
  749    H    ASN 100           H        ASN 100   3.210  12.890 -10.872
  750    HA   ASN 100           HA       ASN 100   0.495  13.171 -10.027
  751   1HB   ASN 100          1HB       ASN 100   2.753  15.199 -10.445
  752   2HB   ASN 100          2HB       ASN 100   1.178  15.627  -9.806
  753   1HD2  ASN 100          1HD2      ASN 100   0.430  14.503  -7.873
  754   2HD2  ASN 100          2HD2      ASN 100   1.568  14.044  -6.651
  755    HA   PRO 101           HA       PRO 101  -0.628  14.185 -14.193
  756   1HB   PRO 101          1HB       PRO 101  -3.328  14.363 -13.806
  757   2HB   PRO 101          2HB       PRO 101  -2.503  12.850 -14.125
  758   1HG   PRO 101          1HG       PRO 101  -3.595  13.863 -11.572
  759   2HG   PRO 101          2HG       PRO 101  -3.161  12.222 -12.006
  760   1HD   PRO 101          1HD       PRO 101  -1.651  14.015 -10.354
  761   2HD   PRO 101          2HD       PRO 101  -1.164  12.417 -10.884
  Start of MODEL    3
    1    H    MET   1           H        MET   1 -20.942   3.493  19.765
    2    HA   MET   1           HA       MET   1 -18.493   3.462  20.332
    3   1HB   MET   1          1HB       MET   1 -20.074   1.969  18.520
    4   2HB   MET   1          2HB       MET   1 -18.643   2.354  17.585
    5   1HG   MET   1          1HG       MET   1 -18.122   0.291  18.685
    6   2HG   MET   1          2HG       MET   1 -17.251   1.513  19.589
    7   1HE   MET   1          1HE       MET   1 -18.196  -0.687  22.534
    8   2HE   MET   1          2HE       MET   1 -17.187  -0.685  21.068
    9   3HE   MET   1          3HE       MET   1 -17.160   0.714  22.169
   10    H    GLN   2           H        GLN   2 -16.714   4.741  20.099
   11    HA   GLN   2           HA       GLN   2 -16.617   6.753  18.203
   12   1HB   GLN   2          1HB       GLN   2 -15.069   5.861  20.449
   13   2HB   GLN   2          2HB       GLN   2 -13.956   6.087  19.114
   14   1HG   GLN   2          1HG       GLN   2 -15.882   8.282  19.184
   15   2HG   GLN   2          2HG       GLN   2 -15.122   8.105  20.754
   16   1HE2  GLN   2          1HE2      GLN   2 -14.886  10.132  18.591
   17   2HE2  GLN   2          2HE2      GLN   2 -13.196  10.280  18.241
   18    H    GLU   3           H        GLU   3 -16.894   5.946  16.074
   19    HA   GLU   3           HA       GLU   3 -15.297   3.813  15.147
   20   1HB   GLU   3          1HB       GLU   3 -17.625   5.107  14.302
   21   2HB   GLU   3          2HB       GLU   3 -16.458   5.573  13.081
   22   1HG   GLU   3          1HG       GLU   3 -16.047   3.337  12.420
   23   2HG   GLU   3          2HG       GLU   3 -16.604   2.674  13.944
   24    H    GLN   4           H        GLN   4 -13.390   3.841  13.925
   25    HA   GLN   4           HA       GLN   4 -12.129   6.457  13.808
   26   1HB   GLN   4          1HB       GLN   4 -10.981   3.636  13.796
   27   2HB   GLN   4          2HB       GLN   4 -10.003   5.061  13.504
   28   1HG   GLN   4          1HG       GLN   4 -10.414   5.934  15.707
   29   2HG   GLN   4          2HG       GLN   4 -11.756   4.841  15.982
   30   1HE2  GLN   4          1HE2      GLN   4  -9.125   5.372  17.351
   31   2HE2  GLN   4          2HE2      GLN   4  -8.387   3.820  17.567
   32    H    ALA   5           H        ALA   5 -12.518   7.435  11.853
   33    HA   ALA   5           HA       ALA   5 -13.204   6.125   9.523
   34   1HB   ALA   5          1HB       ALA   5 -13.643   8.464   9.788
   35   2HB   ALA   5          2HB       ALA   5 -11.924   8.824  10.076
   36   3HB   ALA   5          3HB       ALA   5 -12.469   8.323   8.457
   37    H    GLN   6           H        GLN   6 -12.082   4.779   8.214
   38    HA   GLN   6           HA       GLN   6  -9.216   5.251   8.034
   39   1HB   GLN   6          1HB       GLN   6  -8.827   2.796   8.023
   40   2HB   GLN   6          2HB       GLN   6  -9.523   3.338   9.537
   41   1HG   GLN   6          1HG       GLN   6 -11.801   2.789   8.048
   42   2HG   GLN   6          2HG       GLN   6 -10.689   1.577   7.444
   43   1HE2  GLN   6          1HE2      GLN   6 -11.638  -0.159   8.370
   44   2HE2  GLN   6          2HE2      GLN   6 -11.686  -0.470  10.074
   45    H    GLN   7           H        GLN   7 -10.747   6.429   6.181
   46    HA   GLN   7           HA       GLN   7 -10.640   4.563   3.940
   47   1HB   GLN   7          1HB       GLN   7 -12.515   5.820   2.914
   48   2HB   GLN   7          2HB       GLN   7 -12.976   5.130   4.457
   49   1HG   GLN   7          1HG       GLN   7 -12.210   7.471   5.438
   50   2HG   GLN   7          2HG       GLN   7 -12.386   8.026   3.785
   51   1HE2  GLN   7          1HE2      GLN   7 -13.966   6.900   6.643
   52   2HE2  GLN   7          2HE2      GLN   7 -15.607   7.187   6.170
   53    H    PHE   8           H        PHE   8  -8.687   5.075   2.983
   54    HA   PHE   8           HA       PHE   8  -8.081   7.917   2.661
   55   1HB   PHE   8          1HB       PHE   8  -6.474   6.175   3.721
   56   2HB   PHE   8          2HB       PHE   8  -6.411   5.382   2.160
   57    HD1  PHE   8           1HD      PHE   8  -5.881   7.161   0.160
   58    HD2  PHE   8           2HD      PHE   8  -4.694   7.538   4.217
   59    HE1  PHE   8           1HE      PHE   8  -3.998   8.671  -0.531
   60    HE2  PHE   8           2HE      PHE   8  -2.811   9.047   3.525
   61    HZ   PHE   8           HZ       PHE   8  -2.486   9.595   1.160
   62    H    ILE   9           H        ILE   9  -8.178   8.893   0.682
   63    HA   ILE   9           HA       ILE   9  -9.021   7.252  -1.541
   64    HB   ILE   9           HB       ILE   9  -8.801  10.214  -1.058
   65   1HG1  ILE   9          1HG1      ILE   9 -10.691   9.007  -0.019
   66   2HG1  ILE   9          2HG1      ILE   9 -11.205  10.185  -1.210
   67   1HG2  ILE   9          1HG2      ILE   9 -10.164   9.955  -3.434
   68   2HG2  ILE   9          2HG2      ILE   9  -8.474  10.484  -3.250
   69   3HG2  ILE   9          3HG2      ILE   9  -8.839   8.780  -3.612
   70   1HD1  ILE   9          1HD1      ILE   9 -11.138   7.161  -1.460
   71   2HD1  ILE   9          2HD1      ILE   9 -12.504   8.271  -1.725
   72   3HD1  ILE   9          3HD1      ILE   9 -11.176   8.196  -2.908
   73    H    PHE  10           H        PHE  10  -7.506   6.186  -2.696
   74    HA   PHE  10           HA       PHE  10  -5.338   7.696  -3.797
   75   1HB   PHE  10          1HB       PHE  10  -4.379   7.041  -1.609
   76   2HB   PHE  10          2HB       PHE  10  -5.004   5.412  -1.770
   77    HD1  PHE  10           1HD      PHE  10  -3.424   3.809  -2.218
   78    HD2  PHE  10           2HD      PHE  10  -2.847   7.708  -3.791
   79    HE1  PHE  10           1HE      PHE  10  -1.251   3.076  -3.239
   80    HE2  PHE  10           2HE      PHE  10  -0.674   6.975  -4.812
   81    HZ   PHE  10           HZ       PHE  10   0.098   4.668  -4.523
   82    H    LYS  11           H        LYS  11  -4.414   6.666  -5.645
   83    HA   LYS  11           HA       LYS  11  -5.687   4.115  -6.343
   84   1HB   LYS  11          1HB       LYS  11  -5.223   6.473  -8.194
   85   2HB   LYS  11          2HB       LYS  11  -5.855   4.909  -8.666
   86   1HG   LYS  11          1HG       LYS  11  -7.207   6.448  -6.432
   87   2HG   LYS  11          2HG       LYS  11  -7.519   6.896  -8.097
   88   1HD   LYS  11          1HD       LYS  11  -8.508   4.803  -8.620
   89   2HD   LYS  11          2HD       LYS  11  -7.732   3.986  -7.277
   90   1HE   LYS  11          1HE       LYS  11  -9.196   5.021  -5.661
   91   2HE   LYS  11          2HE       LYS  11  -9.767   6.206  -6.819
   92   1HZ   LYS  11          1HZ       LYS  11 -11.398   4.570  -6.683
   93   2HZ   LYS  11          2HZ       LYS  11 -10.641   4.260  -8.096
   94   3HZ   LYS  11          3HZ       LYS  11 -10.337   3.333  -6.787
   95    H    VAL  12           H        VAL  12  -4.148   2.572  -6.374
   96    HA   VAL  12           HA       VAL  12  -1.471   3.401  -7.255
   97    HB   VAL  12           HB       VAL  12  -2.133   2.376  -4.871
   98   1HG1  VAL  12          1HG1      VAL  12  -2.986   0.283  -6.104
   99   2HG1  VAL  12          2HG1      VAL  12  -1.269  -0.108  -6.361
  100   3HG1  VAL  12          3HG1      VAL  12  -1.910   0.040  -4.707
  101   1HG2  VAL  12          1HG2      VAL  12   0.158   1.953  -4.534
  102   2HG2  VAL  12          2HG2      VAL  12   0.408   1.454  -6.224
  103   3HG2  VAL  12          3HG2      VAL  12   0.117   3.166  -5.836
  104    H    THR  13           H        THR  13  -0.431   2.226  -8.888
  105    HA   THR  13           HA       THR  13  -2.074   1.025 -10.800
  106    HB   THR  13           HB       THR  13   0.313   0.282 -11.645
  107    HG1  THR  13           1HG      THR  13   1.063   0.523  -9.313
  108   1HG2  THR  13          1HG2      THR  13   0.621   2.381 -12.594
  109   2HG2  THR  13          2HG2      THR  13  -1.023   2.648 -11.967
  110   3HG2  THR  13          3HG2      THR  13   0.386   3.222 -11.043
  111    H    ASP  14           H        ASP  14  -1.569  -1.255 -11.732
  112    HA   ASP  14           HA       ASP  14  -2.336  -3.034  -9.680
  113   1HB   ASP  14          1HB       ASP  14  -2.267  -2.960 -12.583
  114   2HB   ASP  14          2HB       ASP  14  -1.548  -4.464 -12.044
  115    H    LYS  15           H        LYS  15   0.645  -2.088 -11.348
  116    HA   LYS  15           HA       LYS  15   2.140  -4.418 -10.860
  117   1HB   LYS  15          1HB       LYS  15   2.483  -2.060 -12.265
  118   2HB   LYS  15          2HB       LYS  15   3.643  -1.897 -10.962
  119   1HG   LYS  15          1HG       LYS  15   4.705  -3.044 -12.855
  120   2HG   LYS  15          2HG       LYS  15   4.577  -4.153 -11.504
  121   1HD   LYS  15          1HD       LYS  15   2.813  -5.383 -12.501
  122   2HD   LYS  15          2HD       LYS  15   2.352  -4.063 -13.558
  123   1HE   LYS  15          1HE       LYS  15   4.586  -4.345 -14.762
  124   2HE   LYS  15          2HE       LYS  15   4.875  -5.771 -13.785
  125   1HZ   LYS  15          1HZ       LYS  15   3.842  -6.700 -15.536
  126   2HZ   LYS  15          2HZ       LYS  15   2.497  -6.349 -14.679
  127   3HZ   LYS  15          3HZ       LYS  15   2.958  -5.379 -15.909
  128    H    ALA  16           H        ALA  16   1.679  -1.336  -9.029
  129    HA   ALA  16           HA       ALA  16   3.513  -1.863  -7.019
  130   1HB   ALA  16          1HB       ALA  16   2.106   0.257  -7.628
  131   2HB   ALA  16          2HB       ALA  16   0.890  -0.443  -6.533
  132   3HB   ALA  16          3HB       ALA  16   2.515  -0.047  -5.923
  133    H    VAL  17           H        VAL  17  -0.088  -2.406  -6.994
  134    HA   VAL  17           HA       VAL  17  -0.153  -3.743  -4.578
  135    HB   VAL  17           HB       VAL  17  -1.873  -3.469  -6.972
  136   1HG1  VAL  17          1HG1      VAL  17  -2.398  -5.628  -4.900
  137   2HG1  VAL  17          2HG1      VAL  17  -3.505  -5.122  -6.199
  138   3HG1  VAL  17          3HG1      VAL  17  -1.957  -5.903  -6.603
  139   1HG2  VAL  17          1HG2      VAL  17  -3.190  -3.403  -4.394
  140   2HG2  VAL  17          2HG2      VAL  17  -1.724  -2.395  -4.375
  141   3HG2  VAL  17          3HG2      VAL  17  -2.986  -2.108  -5.597
  142    H    GLU  18           H        GLU  18   0.385  -4.970  -7.930
  143    HA   GLU  18           HA       GLU  18   0.362  -7.648  -7.243
  144   1HB   GLU  18          1HB       GLU  18   0.199  -6.828  -9.566
  145   2HB   GLU  18          2HB       GLU  18   1.837  -6.209  -9.492
  146   1HG   GLU  18          1HG       GLU  18   1.429  -9.118  -8.824
  147   2HG   GLU  18          2HG       GLU  18   1.262  -8.649 -10.504
  148    H    GLU  19           H        GLU  19   2.718  -5.121  -6.683
  149    HA   GLU  19           HA       GLU  19   4.893  -6.951  -6.410
  150   1HB   GLU  19          1HB       GLU  19   5.393  -4.722  -7.217
  151   2HB   GLU  19          2HB       GLU  19   4.579  -3.974  -5.858
  152   1HG   GLU  19          1HG       GLU  19   6.869  -3.836  -5.264
  153   2HG   GLU  19          2HG       GLU  19   6.300  -5.221  -4.354
  154    H    ILE  20           H        ILE  20   2.434  -5.395  -4.375
  155    HA   ILE  20           HA       ILE  20   3.759  -5.876  -1.915
  156    HB   ILE  20           HB       ILE  20   0.806  -5.483  -2.375
  157   1HG1  ILE  20          1HG1      ILE  20   1.573  -3.666  -3.553
  158   2HG1  ILE  20          2HG1      ILE  20   1.499  -3.001  -1.933
  159   1HG2  ILE  20          1HG2      ILE  20   2.647  -5.331  -0.033
  160   2HG2  ILE  20          2HG2      ILE  20   1.311  -4.160  -0.127
  161   3HG2  ILE  20          3HG2      ILE  20   0.966  -5.906  -0.143
  162   1HD1  ILE  20          1HD1      ILE  20   3.913  -3.792  -3.556
  163   2HD1  ILE  20          2HD1      ILE  20   3.646  -2.342  -2.559
  164   3HD1  ILE  20          3HD1      ILE  20   4.010  -3.902  -1.782
  165    H    LYS  21           H        LYS  21   1.104  -7.556  -3.727
  166    HA   LYS  21           HA       LYS  21   0.932  -9.651  -1.836
  167   1HB   LYS  21          1HB       LYS  21  -0.521 -10.707  -3.488
  168   2HB   LYS  21          2HB       LYS  21  -0.940  -9.021  -3.266
  169   1HG   LYS  21          1HG       LYS  21   0.859  -8.766  -5.308
  170   2HG   LYS  21          2HG       LYS  21   0.270 -10.381  -5.647
  171   1HD   LYS  21          1HD       LYS  21  -2.092  -9.006  -5.105
  172   2HD   LYS  21          2HD       LYS  21  -1.127  -7.774  -5.894
  173   1HE   LYS  21          1HE       LYS  21  -2.326  -8.935  -7.641
  174   2HE   LYS  21          2HE       LYS  21  -0.653  -9.440  -7.764
  175   1HZ   LYS  21          1HZ       LYS  21  -1.486 -11.470  -7.640
  176   2HZ   LYS  21          2HZ       LYS  21  -1.709 -11.212  -6.043
  177   3HZ   LYS  21          3HZ       LYS  21  -2.942 -10.977  -7.087
  178    H    LYS  22           H        LYS  22   3.123  -8.879  -4.448
  179    HA   LYS  22           HA       LYS  22   3.933 -11.572  -4.926
  180   1HB   LYS  22          1HB       LYS  22   4.302 -10.258  -6.771
  181   2HB   LYS  22          2HB       LYS  22   4.756  -8.850  -5.833
  182   1HG   LYS  22          1HG       LYS  22   6.968  -9.489  -5.677
  183   2HG   LYS  22          2HG       LYS  22   6.579 -11.190  -5.520
  184   1HD   LYS  22          1HD       LYS  22   5.979 -11.212  -7.996
  185   2HD   LYS  22          2HD       LYS  22   6.557  -9.562  -8.103
  186   1HE   LYS  22          1HE       LYS  22   8.665 -10.877  -6.803
  187   2HE   LYS  22          2HE       LYS  22   8.097 -12.082  -7.942
  188   1HZ   LYS  22          1HZ       LYS  22   8.221 -10.327  -9.654
  189   2HZ   LYS  22          2HZ       LYS  22   8.937  -9.341  -8.567
  190   3HZ   LYS  22          3HZ       LYS  22   9.672 -10.727  -9.019
  191    H    VAL  23           H        VAL  23   5.307  -8.738  -3.128
  192    HA   VAL  23           HA       VAL  23   7.553 -10.113  -2.193
  193    HB   VAL  23           HB       VAL  23   6.106  -7.596  -1.616
  194   1HG1  VAL  23          1HG1      VAL  23   7.895  -7.298   0.322
  195   2HG1  VAL  23          2HG1      VAL  23   6.289  -7.998   0.639
  196   3HG1  VAL  23          3HG1      VAL  23   7.703  -9.063   0.451
  197   1HG2  VAL  23          1HG2      VAL  23   7.867  -7.527  -3.225
  198   2HG2  VAL  23          2HG2      VAL  23   8.478  -6.724  -1.758
  199   3HG2  VAL  23          3HG2      VAL  23   8.985  -8.387  -2.139
  200    H    ALA  24           H        ALA  24   4.195  -9.783  -0.967
  201    HA   ALA  24           HA       ALA  24   4.709 -10.959   1.540
  202   1HB   ALA  24          1HB       ALA  24   2.507 -10.518   1.874
  203   2HB   ALA  24          2HB       ALA  24   2.620  -9.641   0.329
  204   3HB   ALA  24          3HB       ALA  24   2.018 -11.316   0.361
  205    H    GLN  25           H        GLN  25   3.415 -12.266  -1.590
  206    HA   GLN  25           HA       GLN  25   3.021 -14.825  -0.734
  207   1HB   GLN  25          1HB       GLN  25   3.588 -13.537  -3.391
  208   2HB   GLN  25          2HB       GLN  25   3.677 -15.285  -3.309
  209   1HG   GLN  25          1HG       GLN  25   1.350 -15.098  -2.066
  210   2HG   GLN  25          2HG       GLN  25   1.292 -13.492  -2.765
  211   1HE2  GLN  25          1HE2      GLN  25   0.941 -16.843  -3.270
  212   2HE2  GLN  25          2HE2      GLN  25   0.572 -16.840  -4.963
  213    H    GLU  26           H        GLU  26   6.022 -13.101  -1.398
  214    HA   GLU  26           HA       GLU  26   7.546 -15.490  -1.684
  215   1HB   GLU  26          1HB       GLU  26   7.946 -12.951  -2.530
  216   2HB   GLU  26          2HB       GLU  26   8.856 -12.868  -1.034
  217   1HG   GLU  26          1HG       GLU  26   9.328 -15.291  -2.741
  218   2HG   GLU  26          2HG       GLU  26   9.919 -13.769  -3.377
  219    H    ASN  27           H        ASN  27   6.141 -13.788   0.927
  220    HA   ASN  27           HA       ASN  27   8.153 -14.880   2.732
  221   1HB   ASN  27          1HB       ASN  27   6.442 -12.394   2.805
  222   2HB   ASN  27          2HB       ASN  27   6.775 -13.171   4.340
  223   1HD2  ASN  27          1HD2      ASN  27   7.934 -11.177   1.856
  224   2HD2  ASN  27          2HD2      ASN  27   9.565 -10.955   2.395
  225    H    ASN  28           H        ASN  28   5.391 -15.777   1.326
  226    HA   ASN  28           HA       ASN  28   3.729 -17.085   1.803
  227   1HB   ASN  28          1HB       ASN  28   5.670 -18.140   3.321
  228   2HB   ASN  28          2HB       ASN  28   4.685 -17.553   4.646
  229   1HD2  ASN  28          1HD2      ASN  28   4.830 -19.663   1.858
  230   2HD2  ASN  28          2HD2      ASN  28   3.512 -20.708   2.271
  231    H    ILE  29           H        ILE  29   3.576 -14.207   2.424
  232    HA   ILE  29           HA       ILE  29   1.933 -14.153   4.839
  233    HB   ILE  29           HB       ILE  29   3.098 -11.919   3.175
  234   1HG1  ILE  29          1HG1      ILE  29   3.946 -12.971   5.890
  235   2HG1  ILE  29          2HG1      ILE  29   4.780 -13.291   4.382
  236   1HG2  ILE  29          1HG2      ILE  29   1.156 -11.970   5.409
  237   2HG2  ILE  29          2HG2      ILE  29   2.472 -10.779   5.540
  238   3HG2  ILE  29          3HG2      ILE  29   1.402 -10.770   4.118
  239   1HD1  ILE  29          1HD1      ILE  29   4.647 -10.582   4.211
  240   2HD1  ILE  29          2HD1      ILE  29   4.645 -10.765   5.982
  241   3HD1  ILE  29          3HD1      ILE  29   5.986 -11.432   5.020
  242    H    GLU  30           H        GLU  30  -0.259 -13.730   4.796
  243    HA   GLU  30           HA       GLU  30  -1.366 -13.516   2.106
  244   1HB   GLU  30          1HB       GLU  30  -1.876 -15.406   4.188
  245   2HB   GLU  30          2HB       GLU  30  -3.314 -14.413   4.060
  246   1HG   GLU  30          1HG       GLU  30  -3.698 -15.012   1.803
  247   2HG   GLU  30          2HG       GLU  30  -2.025 -15.457   1.528
  248    H    ASN  31           H        ASN  31  -0.503 -11.532   4.454
  249    HA   ASN  31           HA       ASN  31  -2.782  -9.836   4.003
  250   1HB   ASN  31          1HB       ASN  31  -2.955 -11.185   6.286
  251   2HB   ASN  31          2HB       ASN  31  -1.713 -10.081   6.842
  252   1HD2  ASN  31          1HD2      ASN  31  -4.329 -10.291   7.874
  253   2HD2  ASN  31          2HD2      ASN  31  -5.163  -8.794   7.624
  254    HA   PRO  32           HA       PRO  32   1.396  -7.907   4.015
  255   1HB   PRO  32          1HB       PRO  32   1.452  -7.037   1.425
  256   2HB   PRO  32          2HB       PRO  32   2.161  -8.554   1.942
  257   1HG   PRO  32          1HG       PRO  32  -0.351  -8.094   0.453
  258   2HG   PRO  32          2HG       PRO  32   0.580  -9.571   0.606
  259   1HD   PRO  32          1HD       PRO  32  -1.859  -8.929   1.973
  260   2HD   PRO  32          2HD       PRO  32  -0.867 -10.354   2.212
  261    H    ILE  33           H        ILE  33   1.213  -6.190   5.316
  262    HA   ILE  33           HA       ILE  33  -0.751  -4.208   4.492
  263    HB   ILE  33           HB       ILE  33   0.816  -4.678   7.022
  264   1HG1  ILE  33          1HG1      ILE  33  -2.106  -4.453   7.132
  265   2HG1  ILE  33          2HG1      ILE  33  -1.563  -5.764   6.104
  266   1HG2  ILE  33          1HG2      ILE  33  -1.243  -2.523   6.883
  267   2HG2  ILE  33          2HG2      ILE  33   0.191  -2.681   7.924
  268   3HG2  ILE  33          3HG2      ILE  33   0.376  -2.183   6.226
  269   1HD1  ILE  33          1HD1      ILE  33  -0.470  -5.320   8.915
  270   2HD1  ILE  33          2HD1      ILE  33  -1.864  -6.369   8.564
  271   3HD1  ILE  33          3HD1      ILE  33  -0.265  -6.758   7.887
  272    H    LEU  34           H        LEU  34  -0.044  -2.801   2.968
  273    HA   LEU  34           HA       LEU  34   2.759  -2.034   3.013
  274   1HB   LEU  34          1HB       LEU  34   2.103  -2.626   0.880
  275   2HB   LEU  34          2HB       LEU  34   0.525  -1.880   1.032
  276    HG   LEU  34           HG       LEU  34   2.106   0.322   1.226
  277   1HD1  LEU  34          1HD1      LEU  34   3.586  -0.533  -1.027
  278   2HD1  LEU  34          2HD1      LEU  34   4.193  -0.033   0.570
  279   3HD1  LEU  34          3HD1      LEU  34   3.839  -1.748   0.249
  280   1HD2  LEU  34          1HD2      LEU  34   1.402   0.867  -0.974
  281   2HD2  LEU  34          2HD2      LEU  34   1.269  -0.847  -1.435
  282   3HD2  LEU  34          3HD2      LEU  34   0.124  -0.149  -0.264
  283    H    ARG  35           H        ARG  35   3.492  -0.123   3.809
  284    HA   ARG  35           HA       ARG  35   1.412   1.749   4.603
  285   1HB   ARG  35          1HB       ARG  35   2.718   0.835   6.499
  286   2HB   ARG  35          2HB       ARG  35   4.222   1.301   5.729
  287   1HG   ARG  35          1HG       ARG  35   2.998   3.727   5.727
  288   2HG   ARG  35          2HG       ARG  35   2.176   3.021   7.105
  289   1HD   ARG  35          1HD       ARG  35   5.208   3.228   6.763
  290   2HD   ARG  35          2HD       ARG  35   4.230   4.236   7.811
  291    HE   ARG  35           HE       ARG  35   3.579   1.713   8.683
  292   1HH1  ARG  35          2HH2      ARG  35   6.664   3.308   8.113
  293   2HH1  ARG  35          1HH2      ARG  35   7.503   2.400   9.326
  294   1HH2  ARG  35          2HH1      ARG  35   4.686   0.516  10.285
  295   2HH2  ARG  35          1HH1      ARG  35   6.370   0.801  10.570
  296    H    ILE  36           H        ILE  36   1.418   3.779   3.648
  297    HA   ILE  36           HA       ILE  36   3.568   4.328   1.779
  298    HB   ILE  36           HB       ILE  36   0.762   5.207   2.172
  299   1HG1  ILE  36          1HG1      ILE  36   0.990   5.098  -0.420
  300   2HG1  ILE  36          2HG1      ILE  36   2.505   4.277  -0.102
  301   1HG2  ILE  36          1HG2      ILE  36   1.842   7.352   2.270
  302   2HG2  ILE  36          2HG2      ILE  36   2.868   6.953   0.871
  303   3HG2  ILE  36          3HG2      ILE  36   1.112   7.152   0.659
  304   1HD1  ILE  36          1HD1      ILE  36   0.253   3.263   1.539
  305   2HD1  ILE  36          2HD1      ILE  36   0.034   3.041  -0.213
  306   3HD1  ILE  36          3HD1      ILE  36   1.468   2.366   0.596
  307    H    ARG  37           H        ARG  37   5.365   5.274   2.586
  308    HA   ARG  37           HA       ARG  37   4.891   7.390   4.530
  309   1HB   ARG  37          1HB       ARG  37   6.102   5.209   5.324
  310   2HB   ARG  37          2HB       ARG  37   7.463   5.761   4.367
  311   1HG   ARG  37          1HG       ARG  37   8.074   6.880   6.266
  312   2HG   ARG  37          2HG       ARG  37   6.883   8.061   5.759
  313   1HD   ARG  37          1HD       ARG  37   5.532   7.580   7.528
  314   2HD   ARG  37          2HD       ARG  37   5.573   5.863   7.177
  315    HE   ARG  37           HE       ARG  37   7.193   5.602   8.837
  316   1HH1  ARG  37          2HH2      ARG  37   7.142   8.973   7.828
  317   2HH1  ARG  37          1HH2      ARG  37   8.271   9.485   9.039
  318   1HH2  ARG  37          2HH1      ARG  37   8.682   6.277  10.434
  319   2HH2  ARG  37          1HH1      ARG  37   9.152   7.941  10.531
  320    H    VAL  38           H        VAL  38   6.192   9.321   4.290
  321    HA   VAL  38           HA       VAL  38   6.995   9.818   1.604
  322    HB   VAL  38           HB       VAL  38   7.536  11.579   3.983
  323   1HG1  VAL  38          1HG1      VAL  38   8.394  12.622   2.104
  324   2HG1  VAL  38          2HG1      VAL  38   7.143  11.955   1.027
  325   3HG1  VAL  38          3HG1      VAL  38   6.741  13.280   2.146
  326   1HG2  VAL  38          1HG2      VAL  38   5.370  11.583   4.527
  327   2HG2  VAL  38          2HG2      VAL  38   5.039  12.327   2.944
  328   3HG2  VAL  38          3HG2      VAL  38   4.955  10.559   3.131
  329    H    VAL  39           H        VAL  39   9.153  10.531   0.922
  330    HA   VAL  39           HA       VAL  39  11.279   9.509   2.665
  331    HB   VAL  39           HB       VAL  39  10.859   8.973  -0.279
  332   1HG1  VAL  39          1HG1      VAL  39  13.312   9.406   0.987
  333   2HG1  VAL  39          2HG1      VAL  39  13.147   7.635   0.928
  334   3HG1  VAL  39          3HG1      VAL  39  13.043   8.589  -0.571
  335   1HG2  VAL  39          1HG2      VAL  39  11.412   6.586   1.020
  336   2HG2  VAL  39          2HG2      VAL  39  10.383   7.458   2.180
  337   3HG2  VAL  39          3HG2      VAL  39   9.804   7.165   0.523
  338    HA   PRO  40           HA       PRO  40  12.307  13.684   1.512
  339   1HB   PRO  40          1HB       PRO  40  13.524  14.362   3.864
  340   2HB   PRO  40          2HB       PRO  40  11.816  14.614   3.561
  341   1HG   PRO  40          1HG       PRO  40  13.117  12.552   5.232
  342   2HG   PRO  40          2HG       PRO  40  11.448  13.086   5.249
  343   1HD   PRO  40          1HD       PRO  40  12.463  10.665   4.095
  344   2HD   PRO  40          2HD       PRO  40  10.815  11.255   4.011
  345    H    GLY  41           H        GLY  41  13.630  12.703  -0.140
  346   1HA   GLY  41          1HA       GLY  41  16.435  13.052   0.595
  347   2HA   GLY  41          2HA       GLY  41  15.953  11.462   0.037
  348    H    GLY  42           H        GLY  42  17.495  14.078  -1.051
  349   1HA   GLY  42          1HA       GLY  42  18.078  14.298  -3.314
  350   2HA   GLY  42          2HA       GLY  42  16.497  13.714  -3.792
  351    H    CYS  43           H        CYS  43  17.701  16.128  -4.805
  352    HA   CYS  43           HA       CYS  43  16.562  18.326  -3.380
  353   1HB   CYS  43          1HB       CYS  43  18.583  18.008  -5.308
  354   2HB   CYS  43          2HB       CYS  43  17.331  18.925  -6.121
  355    HG   CYS  43           HG       CYS  43  16.970  20.610  -4.044
  356    H    SER  44           H        SER  44  15.992  16.582  -6.519
  357    HA   SER  44           HA       SER  44  13.382  17.865  -6.599
  358   1HB   SER  44          1HB       SER  44  13.360  17.247  -9.001
  359   2HB   SER  44          2HB       SER  44  14.760  18.223  -8.601
  360    HG   SER  44           HG       SER  44  15.456  16.475  -9.886
  361    H    GLY  45           H        GLY  45  15.138  14.725  -6.758
  362   1HA   GLY  45          1HA       GLY  45  12.997  13.028  -7.280
  363   2HA   GLY  45          2HA       GLY  45  14.462  12.611  -6.414
  364    H    PHE  46           H        PHE  46  11.312  12.227  -6.078
  365    HA   PHE  46           HA       PHE  46  11.422  12.069  -3.263
  366   1HB   PHE  46          1HB       PHE  46  10.988  14.610  -3.988
  367   2HB   PHE  46          2HB       PHE  46   9.386  14.041  -4.417
  368    HD1  PHE  46           1HD      PHE  46   7.855  13.211  -2.666
  369    HD2  PHE  46           2HD      PHE  46  11.635  14.877  -1.692
  370    HE1  PHE  46           1HE      PHE  46   7.116  13.496  -0.284
  371    HE2  PHE  46           2HE      PHE  46  10.895  15.163   0.689
  372    HZ   PHE  46           HZ       PHE  46   8.645  14.469   1.365
  373    H    GLN  47           H        GLN  47  10.640   9.973  -3.405
  374    HA   GLN  47           HA       GLN  47   7.905   9.797  -4.362
  375   1HB   GLN  47          1HB       GLN  47  10.031   7.704  -4.988
  376   2HB   GLN  47          2HB       GLN  47   8.357   7.673  -5.503
  377   1HG   GLN  47          1HG       GLN  47   9.063   8.727  -7.392
  378   2HG   GLN  47          2HG       GLN  47   9.196  10.171  -6.409
  379   1HE2  GLN  47          1HE2      GLN  47  10.835  10.753  -7.965
  380   2HE2  GLN  47          2HE2      GLN  47  12.467  10.209  -7.764
  381    H    TYR  48           H        TYR  48   6.710   7.910  -3.422
  382    HA   TYR  48           HA       TYR  48   7.648   7.450  -0.710
  383   1HB   TYR  48          1HB       TYR  48   5.091   6.839  -2.320
  384   2HB   TYR  48          2HB       TYR  48   5.246   6.491  -0.610
  385    HD1  TYR  48           1HD      TYR  48   5.465   9.335  -3.037
  386    HD2  TYR  48           2HD      TYR  48   4.602   8.096   0.966
  387    HE1  TYR  48           1HE      TYR  48   4.652  11.679  -2.479
  388    HE2  TYR  48           2HE      TYR  48   3.791  10.444   1.510
  389    HH   TYR  48           HH       TYR  48   4.133  12.694   0.709
  390    H    ALA  49           H        ALA  49   8.663   5.608  -0.101
  391    HA   ALA  49           HA       ALA  49   8.879   3.462  -1.998
  392   1HB   ALA  49          1HB       ALA  49   9.953   2.828   0.596
  393   2HB   ALA  49          2HB       ALA  49  10.825   3.204  -0.910
  394   3HB   ALA  49          3HB       ALA  49  10.363   4.515   0.202
  395    H    MET  50           H        MET  50   8.405   1.171  -1.380
  396    HA   MET  50           HA       MET  50   5.968   1.129   0.221
  397   1HB   MET  50          1HB       MET  50   6.968  -0.598  -2.104
  398   2HB   MET  50          2HB       MET  50   5.575  -1.053  -1.143
  399   1HG   MET  50          1HG       MET  50   4.471   1.128  -1.730
  400   2HG   MET  50          2HG       MET  50   5.856   1.555  -2.715
  401   1HE   MET  50          1HE       MET  50   2.551   0.943  -4.191
  402   2HE   MET  50          2HE       MET  50   2.261  -0.733  -3.668
  403   3HE   MET  50          3HE       MET  50   2.680   0.514  -2.469
  404    H    GLY  51           H        GLY  51   5.560  -1.325   1.046
  405   1HA   GLY  51          1HA       GLY  51   7.814  -2.891   1.710
  406   2HA   GLY  51          2HA       GLY  51   7.443  -1.816   3.044
  407    H    PHE  52           H        PHE  52   7.064  -4.089   4.047
  408    HA   PHE  52           HA       PHE  52   4.208  -4.637   3.792
  409   1HB   PHE  52          1HB       PHE  52   5.106  -7.138   4.176
  410   2HB   PHE  52          2HB       PHE  52   5.083  -6.473   2.555
  411    HD1  PHE  52           1HD      PHE  52   7.246  -5.396   1.688
  412    HD2  PHE  52           2HD      PHE  52   7.110  -7.895   5.115
  413    HE1  PHE  52           1HE      PHE  52   9.712  -5.814   1.481
  414    HE2  PHE  52           2HE      PHE  52   9.576  -8.312   4.909
  415    HZ   PHE  52           HZ       PHE  52  10.848  -7.267   3.094
  416    H    ASP  53           H        ASP  53   3.220  -4.674   5.761
  417    HA   ASP  53           HA       ASP  53   4.964  -5.184   8.041
  418   1HB   ASP  53          1HB       ASP  53   2.601  -3.255   7.870
  419   2HB   ASP  53          2HB       ASP  53   3.507  -3.592   9.331
  420    H    ASP  54           H        ASP  54   3.389  -5.690  10.085
  421    HA   ASP  54           HA       ASP  54   1.216  -7.350   9.071
  422   1HB   ASP  54          1HB       ASP  54   3.450  -7.946  10.983
  423   2HB   ASP  54          2HB       ASP  54   1.878  -8.588  11.417
  424    H    THR  55           H        THR  55   2.678  -5.532  11.847
  425    HA   THR  55           HA       THR  55   0.336  -5.575  13.446
  426    HB   THR  55           HB       THR  55   2.652  -5.282  14.328
  427    HG1  THR  55           1HG      THR  55   1.043  -4.318  15.625
  428   1HG2  THR  55          1HG2      THR  55   3.612  -2.912  14.112
  429   2HG2  THR  55          2HG2      THR  55   3.736  -3.898  12.636
  430   3HG2  THR  55          3HG2      THR  55   2.470  -2.654  12.772
  431    H    VAL  56           H        VAL  56  -0.434  -3.207  14.261
  432    HA   VAL  56           HA       VAL  56  -0.950  -1.564  11.911
  433    HB   VAL  56           HB       VAL  56  -2.874  -3.303  13.274
  434   1HG1  VAL  56          1HG1      VAL  56  -3.518  -0.364  12.884
  435   2HG1  VAL  56          2HG1      VAL  56  -4.748  -1.636  13.075
  436   3HG1  VAL  56          3HG1      VAL  56  -3.597  -1.306  14.392
  437   1HG2  VAL  56          1HG2      VAL  56  -2.166  -2.922  10.722
  438   2HG2  VAL  56          2HG2      VAL  56  -3.792  -3.476  11.189
  439   3HG2  VAL  56          3HG2      VAL  56  -3.514  -1.762  10.799
  440    H    GLU  57           H        GLU  57  -1.701   0.619  12.493
  441    HA   GLU  57           HA       GLU  57  -0.519   1.367  15.003
  442   1HB   GLU  57          1HB       GLU  57  -1.756   3.215  12.927
  443   2HB   GLU  57          2HB       GLU  57  -0.576   3.628  14.155
  444   1HG   GLU  57          1HG       GLU  57   0.365   1.419  12.450
  445   2HG   GLU  57          2HG       GLU  57  -0.033   2.838  11.502
  446    H    GLU  58           H        GLU  58  -1.751   3.287  16.205
  447    HA   GLU  58           HA       GLU  58  -4.292   2.167  16.881
  448   1HB   GLU  58          1HB       GLU  58  -2.438   3.170  18.464
  449   2HB   GLU  58          2HB       GLU  58  -3.158   4.716  18.060
  450   1HG   GLU  58          1HG       GLU  58  -5.442   3.484  18.670
  451   2HG   GLU  58          2HG       GLU  58  -4.392   2.382  19.539
  452    H    GLY  59           H        GLY  59  -4.293   3.126  14.220
  453   1HA   GLY  59          1HA       GLY  59  -6.492   4.285  13.638
  454   2HA   GLY  59          2HA       GLY  59  -5.748   5.686  14.383
  455    H    ASP  60           H        ASP  60  -4.956   3.106  11.941
  456    HA   ASP  60           HA       ASP  60  -3.493   5.161  10.494
  457   1HB   ASP  60          1HB       ASP  60  -2.633   2.691  11.231
  458   2HB   ASP  60          2HB       ASP  60  -3.379   2.260   9.705
  459    H    HIS  61           H        HIS  61  -4.033   5.534   8.248
  460    HA   HIS  61           HA       HIS  61  -6.696   5.015   7.554
  461   1HB   HIS  61          1HB       HIS  61  -4.423   6.495   6.509
  462   2HB   HIS  61          2HB       HIS  61  -5.309   5.713   5.215
  463    HD1  HIS  61           1HD      HIS  61  -8.005   6.252   5.183
  464    HD2  HIS  61           2HD      HIS  61  -5.569   8.817   7.438
  465    HE1  HIS  61           1HE      HIS  61  -9.368   8.374   5.572
  466    H    VAL  62           H        VAL  62  -6.895   2.682   7.790
  467    HA   VAL  62           HA       VAL  62  -5.320   0.996   6.101
  468    HB   VAL  62           HB       VAL  62  -6.586   0.635   8.427
  469   1HG1  VAL  62          1HG1      VAL  62  -8.528  -0.444   6.355
  470   2HG1  VAL  62          2HG1      VAL  62  -8.585  -0.770   8.104
  471   3HG1  VAL  62          3HG1      VAL  62  -8.836   0.885   7.498
  472   1HG2  VAL  62          1HG2      VAL  62  -5.082  -1.014   7.904
  473   2HG2  VAL  62          2HG2      VAL  62  -6.598  -1.917   7.672
  474   3HG2  VAL  62          3HG2      VAL  62  -5.736  -1.250   6.265
  475    H    PHE  63           H        PHE  63  -5.603   0.850   3.941
  476    HA   PHE  63           HA       PHE  63  -8.345   1.215   2.954
  477   1HB   PHE  63          1HB       PHE  63  -6.186   2.799   2.447
  478   2HB   PHE  63          2HB       PHE  63  -5.819   1.537   1.287
  479    HD1  PHE  63           1HD      PHE  63  -9.149   2.896   2.243
  480    HD2  PHE  63           2HD      PHE  63  -6.187   2.554  -0.776
  481    HE1  PHE  63           1HE      PHE  63 -10.710   3.960   0.591
  482    HE2  PHE  63           2HE      PHE  63  -7.748   3.618  -2.428
  483    HZ   PHE  63           HZ       PHE  63  -9.991   4.309  -1.725
  484    H    GLU  64           H        GLU  64  -9.253  -0.595   2.108
  485    HA   GLU  64           HA       GLU  64  -7.772  -2.938   1.855
  486   1HB   GLU  64          1HB       GLU  64 -10.516  -2.233   0.723
  487   2HB   GLU  64          2HB       GLU  64  -9.869  -3.857   0.844
  488   1HG   GLU  64          1HG       GLU  64  -9.762  -3.697   3.294
  489   2HG   GLU  64          2HG       GLU  64 -10.214  -2.004   3.246
  490    H    TYR  65           H        TYR  65  -6.769  -3.931   0.103
  491    HA   TYR  65           HA       TYR  65  -6.809  -2.380  -2.397
  492   1HB   TYR  65          1HB       TYR  65  -4.778  -3.824  -0.689
  493   2HB   TYR  65          2HB       TYR  65  -4.574  -4.048  -2.415
  494    HD1  TYR  65           1HD      TYR  65  -2.481  -2.887  -2.608
  495    HD2  TYR  65           2HD      TYR  65  -5.879  -0.924  -0.903
  496    HE1  TYR  65           1HE      TYR  65  -1.272  -0.656  -2.750
  497    HE2  TYR  65           2HE      TYR  65  -4.658   1.301  -1.051
  498    HH   TYR  65           HH       TYR  65  -2.634   2.227  -1.298
  499    H    ASP  66           H        ASP  66  -5.558  -4.257  -4.059
  500    HA   ASP  66           HA       ASP  66  -7.754  -5.846  -4.707
  501   1HB   ASP  66          1HB       ASP  66  -5.687  -4.926  -6.123
  502   2HB   ASP  66          2HB       ASP  66  -4.950  -6.452  -5.678
  503    H    GLY  67           H        GLY  67  -7.862  -6.894  -2.418
  504   1HA   GLY  67          1HA       GLY  67  -7.773  -8.845  -1.277
  505   2HA   GLY  67          2HA       GLY  67  -6.775  -9.537  -2.540
  506    H    VAL  68           H        VAL  68  -6.064  -6.505  -0.732
  507    HA   VAL  68           HA       VAL  68  -4.148  -7.859   0.942
  508    HB   VAL  68           HB       VAL  68  -3.351  -6.043  -1.327
  509   1HG1  VAL  68          1HG1      VAL  68  -1.107  -5.900  -0.335
  510   2HG1  VAL  68          2HG1      VAL  68  -2.331  -5.150   0.718
  511   3HG1  VAL  68          3HG1      VAL  68  -1.686  -6.762   1.110
  512   1HG2  VAL  68          1HG2      VAL  68  -1.553  -7.925  -1.474
  513   2HG2  VAL  68          2HG2      VAL  68  -2.690  -8.854  -0.467
  514   3HG2  VAL  68          3HG2      VAL  68  -3.202  -8.248  -2.061
  515    H    LYS  69           H        LYS  69  -3.155  -6.284   2.521
  516    HA   LYS  69           HA       LYS  69  -5.113  -4.172   3.046
  517   1HB   LYS  69          1HB       LYS  69  -3.875  -6.188   4.676
  518   2HB   LYS  69          2HB       LYS  69  -3.405  -4.612   5.279
  519   1HG   LYS  69          1HG       LYS  69  -6.000  -4.053   4.927
  520   2HG   LYS  69          2HG       LYS  69  -6.175  -5.794   5.017
  521   1HD   LYS  69          1HD       LYS  69  -4.703  -5.617   7.187
  522   2HD   LYS  69          2HD       LYS  69  -5.084  -3.907   7.134
  523   1HE   LYS  69          1HE       LYS  69  -7.331  -4.240   7.636
  524   2HE   LYS  69          2HE       LYS  69  -7.403  -5.786   6.813
  525   1HZ   LYS  69          1HZ       LYS  69  -6.542  -6.858   8.615
  526   2HZ   LYS  69          2HZ       LYS  69  -5.782  -5.544   9.218
  527   3HZ   LYS  69          3HZ       LYS  69  -7.402  -5.689   9.363
  528    H    VAL  70           H        VAL  70  -4.410  -2.039   3.599
  529    HA   VAL  70           HA       VAL  70  -1.582  -1.484   3.259
  530    HB   VAL  70           HB       VAL  70  -3.764  -0.456   1.448
  531   1HG1  VAL  70          1HG1      VAL  70  -2.092   1.114   0.518
  532   2HG1  VAL  70          2HG1      VAL  70  -2.497   1.481   2.212
  533   3HG1  VAL  70          3HG1      VAL  70  -0.965   0.664   1.820
  534   1HG2  VAL  70          1HG2      VAL  70  -1.423  -2.250   1.174
  535   2HG2  VAL  70          2HG2      VAL  70  -2.948  -2.198   0.258
  536   3HG2  VAL  70          3HG2      VAL  70  -1.636  -1.061  -0.134
  537    H    VAL  71           H        VAL  71  -1.056   0.771   3.949
  538    HA   VAL  71           HA       VAL  71  -3.168   2.094   5.435
  539    HB   VAL  71           HB       VAL  71  -2.241   1.909   7.520
  540   1HG1  VAL  71          1HG1      VAL  71  -1.578  -0.707   6.133
  541   2HG1  VAL  71          2HG1      VAL  71  -1.616  -0.489   7.899
  542   3HG1  VAL  71          3HG1      VAL  71  -3.100  -0.264   6.942
  543   1HG2  VAL  71          1HG2      VAL  71   0.090   1.222   7.995
  544   2HG2  VAL  71          2HG2      VAL  71   0.393   1.093   6.245
  545   3HG2  VAL  71          3HG2      VAL  71   0.006   2.673   6.968
  546    H    ILE  72           H        ILE  72  -2.568   4.316   6.025
  547    HA   ILE  72           HA       ILE  72  -0.097   5.273   4.838
  548    HB   ILE  72           HB       ILE  72  -2.696   6.572   4.071
  549   1HG1  ILE  72          1HG1      ILE  72  -1.207   4.515   2.416
  550   2HG1  ILE  72          2HG1      ILE  72  -2.681   4.187   3.304
  551   1HG2  ILE  72          1HG2      ILE  72  -0.961   8.074   3.725
  552   2HG2  ILE  72          2HG2      ILE  72   0.182   6.803   3.227
  553   3HG2  ILE  72          3HG2      ILE  72  -1.135   7.294   2.134
  554   1HD1  ILE  72          1HD1      ILE  72  -2.944   6.617   1.677
  555   2HD1  ILE  72          2HD1      ILE  72  -2.507   5.201   0.691
  556   3HD1  ILE  72          3HD1      ILE  72  -3.968   5.161   1.707
  557    H    ASP  73           H        ASP  73   0.861   6.406   6.431
  558    HA   ASP  73           HA       ASP  73  -0.200   7.030   8.786
  559   1HB   ASP  73          1HB       ASP  73   2.061   7.997   7.160
  560   2HB   ASP  73          2HB       ASP  73   1.485   9.230   8.264
  561    HA   PRO  74           HA       PRO  74  -2.762  10.541   8.195
  562   1HB   PRO  74          1HB       PRO  74  -2.422  11.995  10.484
  563   2HB   PRO  74          2HB       PRO  74  -3.437  10.569  10.396
  564   1HG   PRO  74          1HG       PRO  74  -0.758  10.864  11.609
  565   2HG   PRO  74          2HG       PRO  74  -1.949   9.607  11.873
  566   1HD   PRO  74          1HD       PRO  74   0.429   9.411  10.282
  567   2HD   PRO  74          2HD       PRO  74  -0.821   8.195  10.452
  568    H    PHE  75           H        PHE  75   0.576  11.116   8.746
  569    HA   PHE  75           HA       PHE  75   0.388  13.877   7.998
  570   1HB   PHE  75          1HB       PHE  75   2.506  11.782   8.636
  571   2HB   PHE  75          2HB       PHE  75   3.028  13.256   7.844
  572    HD1  PHE  75           1HD      PHE  75   2.818  11.769  10.908
  573    HD2  PHE  75           2HD      PHE  75   1.828  15.443   9.030
  574    HE1  PHE  75           1HE      PHE  75   2.911  12.931  13.131
  575    HE2  PHE  75           2HE      PHE  75   1.920  16.604  11.253
  576    HZ   PHE  75           HZ       PHE  75   2.461  15.334  13.277
  577    H    SER  76           H        SER  76   0.603  10.799   6.365
  578    HA   SER  76           HA       SER  76   1.835  11.957   4.046
  579   1HB   SER  76          1HB       SER  76   1.040   9.211   4.948
  580   2HB   SER  76          2HB       SER  76   1.062   9.485   3.217
  581    HG   SER  76           HG       SER  76   3.148   8.938   3.556
  582    H    MET  77           H        MET  77  -1.328  11.521   5.410
  583    HA   MET  77           HA       MET  77  -2.851  11.091   3.171
  584   1HB   MET  77          1HB       MET  77  -3.209  11.784   5.929
  585   2HB   MET  77          2HB       MET  77  -4.105  12.991   5.028
  586   1HG   MET  77          1HG       MET  77  -4.400  10.035   4.373
  587   2HG   MET  77          2HG       MET  77  -5.322  10.758   5.676
  588   1HE   MET  77          1HE       MET  77  -4.406  10.958   1.893
  589   2HE   MET  77          2HE       MET  77  -5.590   9.676   2.240
  590   3HE   MET  77          3HE       MET  77  -6.056  11.070   1.236
  591    HA   PRO  78           HA       PRO  78  -2.961  15.802   2.627
  592   1HB   PRO  78          1HB       PRO  78  -1.297  17.394   4.098
  593   2HB   PRO  78          2HB       PRO  78  -2.961  17.075   4.545
  594   1HG   PRO  78          1HG       PRO  78  -0.482  15.979   5.725
  595   2HG   PRO  78          2HG       PRO  78  -2.097  16.017   6.404
  596   1HD   PRO  78          1HD       PRO  78  -0.776  13.752   5.242
  597   2HD   PRO  78          2HD       PRO  78  -2.431  13.820   5.814
  598    H    TYR  79           H        TYR  79  -0.516  13.738   2.441
  599    HA   TYR  79           HA       TYR  79   1.135  15.568   0.851
  600   1HB   TYR  79          1HB       TYR  79   1.520  13.395   2.750
  601   2HB   TYR  79          2HB       TYR  79   2.112  12.827   1.201
  602    HD1  TYR  79           1HD      TYR  79   3.180  14.207   4.137
  603    HD2  TYR  79           2HD      TYR  79   3.507  14.893  -0.073
  604    HE1  TYR  79           1HE      TYR  79   5.361  15.463   4.503
  605    HE2  TYR  79           2HE      TYR  79   5.687  16.146   0.307
  606    HH   TYR  79           HH       TYR  79   7.486  16.139   2.036
  607    H    VAL  80           H        VAL  80  -0.550  12.370   0.803
  608    HA   VAL  80           HA       VAL  80  -0.403  12.515  -2.129
  609    HB   VAL  80           HB       VAL  80  -0.275  10.097  -2.173
  610   1HG1  VAL  80          1HG1      VAL  80   1.938  10.360  -2.181
  611   2HG1  VAL  80          2HG1      VAL  80   1.772  11.849  -1.219
  612   3HG1  VAL  80          3HG1      VAL  80   1.960  10.278  -0.403
  613   1HG2  VAL  80          1HG2      VAL  80  -0.710  10.384   0.763
  614   2HG2  VAL  80          2HG2      VAL  80  -1.293   9.141  -0.370
  615   3HG2  VAL  80          3HG2      VAL  80   0.385   9.088   0.223
  616    H    ASN  81           H        ASN  81  -2.430  13.868  -0.910
  617    HA   ASN  81           HA       ASN  81  -4.619  12.141  -0.410
  618   1HB   ASN  81          1HB       ASN  81  -5.918  14.352  -0.408
  619   2HB   ASN  81          2HB       ASN  81  -4.591  14.281   0.735
  620   1HD2  ASN  81          1HD2      ASN  81  -5.912  15.784  -2.038
  621   2HD2  ASN  81          2HD2      ASN  81  -4.677  16.962  -2.334
  622    H    GLY  82           H        GLY  82  -5.289  10.967  -2.256
  623   1HA   GLY  82          1HA       GLY  82  -6.588  10.802  -4.145
  624   2HA   GLY  82          2HA       GLY  82  -6.373  12.510  -4.469
  625    H    ALA  83           H        ALA  83  -3.334  12.194  -3.975
  626    HA   ALA  83           HA       ALA  83  -2.562  11.976  -6.619
  627   1HB   ALA  83          1HB       ALA  83  -0.400  12.275  -5.792
  628   2HB   ALA  83          2HB       ALA  83  -1.389  12.925  -4.462
  629   3HB   ALA  83          3HB       ALA  83  -0.705  11.286  -4.344
  630    H    GLU  84           H        GLU  84  -0.677  10.264  -7.217
  631    HA   GLU  84           HA       GLU  84  -1.646   7.640  -6.416
  632   1HB   GLU  84          1HB       GLU  84  -1.399   6.876  -8.795
  633   2HB   GLU  84          2HB       GLU  84  -2.674   8.059  -8.577
  634   1HG   GLU  84          1HG       GLU  84  -1.319   9.841  -9.489
  635   2HG   GLU  84          2HG       GLU  84   0.144   8.881  -9.391
  636    H    LEU  85           H        LEU  85  -0.019   5.882  -6.770
  637    HA   LEU  85           HA       LEU  85   2.700   6.902  -7.101
  638   1HB   LEU  85          1HB       LEU  85   3.082   6.756  -4.936
  639   2HB   LEU  85          2HB       LEU  85   1.506   6.051  -4.632
  640    HG   LEU  85           HG       LEU  85   2.388   3.810  -5.100
  641   1HD1  LEU  85          1HD1      LEU  85   5.126   3.974  -5.049
  642   2HD1  LEU  85          2HD1      LEU  85   4.130   3.695  -6.497
  643   3HD1  LEU  85          3HD1      LEU  85   4.683   5.340  -6.101
  644   1HD2  LEU  85          1HD2      LEU  85   3.759   3.558  -3.110
  645   2HD2  LEU  85          2HD2      LEU  85   4.076   5.309  -3.079
  646   3HD2  LEU  85          3HD2      LEU  85   2.426   4.698  -2.807
  647    H    ASP  86           H        ASP  86   3.360   5.884  -8.923
  648    HA   ASP  86           HA       ASP  86   2.397   3.195  -9.351
  649   1HB   ASP  86          1HB       ASP  86   2.427   5.087 -11.135
  650   2HB   ASP  86          2HB       ASP  86   4.163   4.856 -11.196
  651    H    TYR  87           H        TYR  87   3.752   1.443  -8.903
  652    HA   TYR  87           HA       TYR  87   6.460   2.002  -8.069
  653   1HB   TYR  87          1HB       TYR  87   4.466   0.317  -7.248
  654   2HB   TYR  87          2HB       TYR  87   5.191  -0.742  -8.442
  655    HD1  TYR  87           1HD      TYR  87   6.879  -2.186  -7.759
  656    HD2  TYR  87           2HD      TYR  87   6.210   1.408  -5.537
  657    HE1  TYR  87           1HE      TYR  87   8.620  -2.908  -6.053
  658    HE2  TYR  87           2HE      TYR  87   7.953   0.674  -3.838
  659    HH   TYR  87           HH       TYR  87   9.312  -0.882  -3.216
  660    H    VAL  88           H        VAL  88   8.347   1.391  -9.114
  661    HA   VAL  88           HA       VAL  88   7.982   0.577 -11.887
  662    HB   VAL  88           HB       VAL  88  10.318   1.701 -10.333
  663   1HG1  VAL  88          1HG1      VAL  88  11.294   1.946 -12.719
  664   2HG1  VAL  88          2HG1      VAL  88  11.377   0.354 -11.927
  665   3HG1  VAL  88          3HG1      VAL  88  10.135   0.669 -13.163
  666   1HG2  VAL  88          1HG2      VAL  88   8.372   2.851 -12.339
  667   2HG2  VAL  88          2HG2      VAL  88   8.783   3.443 -10.712
  668   3HG2  VAL  88          3HG2      VAL  88   9.961   3.594 -12.038
  669    H    VAL  89           H        VAL  89   8.923  -1.298 -12.773
  670    HA   VAL  89           HA       VAL  89  10.119  -3.116 -10.804
  671    HB   VAL  89           HB       VAL  89   8.157  -3.907 -12.960
  672   1HG1  VAL  89          1HG1      VAL  89   9.494  -5.397 -10.688
  673   2HG1  VAL  89          2HG1      VAL  89   8.053  -6.012 -11.533
  674   3HG1  VAL  89          3HG1      VAL  89   9.566  -5.744 -12.432
  675   1HG2  VAL  89          1HG2      VAL  89   6.462  -3.305 -11.645
  676   2HG2  VAL  89          2HG2      VAL  89   7.100  -4.327 -10.336
  677   3HG2  VAL  89          3HG2      VAL  89   7.613  -2.628 -10.468
  678    H    ASP  90           H        ASP  90  12.210  -3.355 -11.403
  679    HA   ASP  90           HA       ASP  90  12.760  -4.316 -13.993
  680   1HB   ASP  90          1HB       ASP  90  14.071  -1.664 -13.267
  681   2HB   ASP  90          2HB       ASP  90  14.189  -2.523 -14.790
  682    H    PHE  91           H        PHE  91  15.617  -3.167 -13.764
  683    HA   PHE  91           HA       PHE  91  16.761  -5.203 -12.295
  684   1HB   PHE  91          1HB       PHE  91  17.573  -3.293 -14.062
  685   2HB   PHE  91          2HB       PHE  91  18.057  -2.466 -12.594
  686    HD1  PHE  91           1HD      PHE  91  20.126  -2.929 -11.638
  687    HD2  PHE  91           2HD      PHE  91  18.454  -5.719 -14.363
  688    HE1  PHE  91           1HE      PHE  91  22.262  -4.246 -11.600
  689    HE2  PHE  91           2HE      PHE  91  20.590  -7.037 -14.324
  690    HZ   PHE  91           HZ       PHE  91  22.469  -6.284 -12.944
  691    H    MET  92           H        MET  92  15.162  -2.357 -11.176
  692    HA   MET  92           HA       MET  92  16.745  -2.038  -8.839
  693   1HB   MET  92          1HB       MET  92  14.545  -0.698 -10.216
  694   2HB   MET  92          2HB       MET  92  14.118  -0.887  -8.527
  695   1HG   MET  92          1HG       MET  92  15.981   0.386  -7.774
  696   2HG   MET  92          2HG       MET  92  16.873   0.148  -9.263
  697   1HE   MET  92          1HE       MET  92  16.655   2.485  -7.724
  698   2HE   MET  92          2HE       MET  92  16.735   3.622  -9.091
  699   3HE   MET  92          3HE       MET  92  15.348   3.666  -7.977
  700    H    GLY  93           H        GLY  93  14.830  -4.544  -9.752
  701   1HA   GLY  93          1HA       GLY  93  13.741  -6.183  -8.668
  702   2HA   GLY  93          2HA       GLY  93  14.591  -5.675  -7.223
  703    H    GLY  94           H        GLY  94  12.492  -3.402  -8.976
  704   1HA   GLY  94          1HA       GLY  94  10.222  -2.975  -8.575
  705   2HA   GLY  94          2HA       GLY  94  10.308  -3.860  -7.065
  706    H    GLY  95           H        GLY  95  10.905  -0.773  -8.691
  707   1HA   GLY  95          1HA       GLY  95  11.853   0.434  -6.182
  708   2HA   GLY  95          2HA       GLY  95  11.962   1.124  -7.789
  709    H    PHE  96           H        PHE  96  11.004   3.052  -6.576
  710    HA   PHE  96           HA       PHE  96   8.081   2.805  -6.638
  711   1HB   PHE  96          1HB       PHE  96   8.391   4.716  -4.790
  712   2HB   PHE  96          2HB       PHE  96   8.557   3.038  -4.313
  713    HD1  PHE  96           1HD      PHE  96  10.636   5.870  -5.575
  714    HD2  PHE  96           2HD      PHE  96  10.440   2.406  -3.132
  715    HE1  PHE  96           1HE      PHE  96  12.948   6.343  -4.720
  716    HE2  PHE  96           2HE      PHE  96  12.752   2.878  -2.277
  717    HZ   PHE  96           HZ       PHE  96  13.979   4.841  -3.081
  718    H    THR  97           H        THR  97   6.930   4.671  -7.387
  719    HA   THR  97           HA       THR  97   8.440   6.994  -8.190
  720    HB   THR  97           HB       THR  97   7.368   4.924 -10.151
  721    HG1  THR  97           1HG      THR  97   9.642   4.955  -9.591
  722   1HG2  THR  97          1HG2      THR  97   8.073   6.833 -11.846
  723   2HG2  THR  97          2HG2      THR  97   6.430   6.862 -11.160
  724   3HG2  THR  97          3HG2      THR  97   7.692   7.928 -10.495
  725    H    ILE  98           H        ILE  98   7.159   8.822  -8.494
  726    HA   ILE  98           HA       ILE  98   4.351   8.373  -7.767
  727    HB   ILE  98           HB       ILE  98   6.228  10.668  -7.223
  728   1HG1  ILE  98          1HG1      ILE  98   6.291   8.595  -5.769
  729   2HG1  ILE  98          2HG1      ILE  98   6.008  10.115  -4.944
  730   1HG2  ILE  98          1HG2      ILE  98   3.896  11.383  -7.945
  731   2HG2  ILE  98          2HG2      ILE  98   3.306  10.595  -6.462
  732   3HG2  ILE  98          3HG2      ILE  98   4.454  11.951  -6.353
  733   1HD1  ILE  98          1HD1      ILE  98   4.490   8.072  -4.345
  734   2HD1  ILE  98          2HD1      ILE  98   3.712   9.654  -4.587
  735   3HD1  ILE  98          3HD1      ILE  98   3.664   8.432  -5.880
  736    H    ARG  99           H        ARG  99   2.711   9.284  -9.014
  737    HA   ARG  99           HA       ARG  99   3.663  10.685 -11.380
  738   1HB   ARG  99          1HB       ARG  99   1.781   8.334 -11.134
  739   2HB   ARG  99          2HB       ARG  99   1.448   9.511 -12.390
  740   1HG   ARG  99          1HG       ARG  99   4.224   9.081 -12.602
  741   2HG   ARG  99          2HG       ARG  99   3.585   7.488 -12.248
  742   1HD   ARG  99          1HD       ARG  99   1.756   8.316 -14.120
  743   2HD   ARG  99          2HD       ARG  99   3.163   9.209 -14.663
  744    HE   ARG  99           HE       ARG  99   3.861   6.456 -14.088
  745   1HH1  ARG  99          2HH2      ARG  99   2.300   8.496 -16.494
  746   2HH1  ARG  99          1HH2      ARG  99   2.630   7.418 -17.809
  747   1HH2  ARG  99          2HH1      ARG  99   4.297   5.034 -15.822
  748   2HH2  ARG  99          1HH1      ARG  99   3.774   5.435 -17.424
  749    H    ASN 100           H        ASN 100   3.048  12.785 -10.754
  750    HA   ASN 100           HA       ASN 100   0.818  13.359  -9.256
  751   1HB   ASN 100          1HB       ASN 100   2.138  15.149 -11.363
  752   2HB   ASN 100          2HB       ASN 100   1.171  15.702 -10.011
  753   1HD2  ASN 100          1HD2      ASN 100   1.934  15.419  -7.873
  754   2HD2  ASN 100          2HD2      ASN 100   3.625  15.286  -7.519
  755    HA   PRO 101           HA       PRO 101  -2.139  12.769 -12.510
  756   1HB   PRO 101          1HB       PRO 101  -4.396  13.039 -10.993
  757   2HB   PRO 101          2HB       PRO 101  -3.534  11.523 -11.166
  758   1HG   PRO 101          1HG       PRO 101  -3.586  13.372  -8.860
  759   2HG   PRO 101          2HG       PRO 101  -3.098  11.690  -8.908
  760   1HD   PRO 101          1HD       PRO 101  -1.369  13.976  -8.800
  761   2HD   PRO 101          2HD       PRO 101  -0.882  12.301  -8.964
  Start of MODEL    4
    1    H    MET   1           H        MET   1 -19.135  -2.717  17.077
    2    HA   MET   1           HA       MET   1 -16.984  -4.140  18.238
    3   1HB   MET   1          1HB       MET   1 -17.835  -3.193  15.497
    4   2HB   MET   1          2HB       MET   1 -16.138  -3.586  15.695
    5   1HG   MET   1          1HG       MET   1 -18.065  -5.584  16.824
    6   2HG   MET   1          2HG       MET   1 -18.061  -5.441  15.078
    7   1HE   MET   1          1HE       MET   1 -16.511  -6.539  18.192
    8   2HE   MET   1          2HE       MET   1 -14.897  -7.180  17.802
    9   3HE   MET   1          3HE       MET   1 -15.137  -5.426  17.988
   10    H    GLN   2           H        GLN   2 -14.620  -3.420  17.318
   11    HA   GLN   2           HA       GLN   2 -14.369  -0.559  17.763
   12   1HB   GLN   2          1HB       GLN   2 -13.380  -2.718  19.496
   13   2HB   GLN   2          2HB       GLN   2 -12.081  -1.671  18.961
   14   1HG   GLN   2          1HG       GLN   2 -13.056   0.264  19.935
   15   2HG   GLN   2          2HG       GLN   2 -14.657  -0.446  19.987
   16   1HE2  GLN   2          1HE2      GLN   2 -12.495   0.661  21.942
   17   2HE2  GLN   2          2HE2      GLN   2 -12.528  -0.447  23.272
   18    H    GLU   3           H        GLU   3 -14.044  -0.341  15.467
   19    HA   GLU   3           HA       GLU   3 -11.353  -1.052  14.722
   20   1HB   GLU   3          1HB       GLU   3 -12.978  -2.895  13.934
   21   2HB   GLU   3          2HB       GLU   3 -13.655  -1.703  12.842
   22   1HG   GLU   3          1HG       GLU   3 -12.035  -2.374  11.383
   23   2HG   GLU   3          2HG       GLU   3 -10.946  -1.402  12.351
   24    H    GLN   4           H        GLN   4 -10.381   0.570  13.511
   25    HA   GLN   4           HA       GLN   4 -11.916   2.938  13.190
   26   1HB   GLN   4          1HB       GLN   4  -9.025   2.159  12.821
   27   2HB   GLN   4          2HB       GLN   4  -9.588   3.648  12.089
   28   1HG   GLN   4          1HG       GLN   4 -10.158   4.620  14.183
   29   2HG   GLN   4          2HG       GLN   4 -10.235   3.069  14.994
   30   1HE2  GLN   4          1HE2      GLN   4  -8.583   2.479  16.175
   31   2HE2  GLN   4          2HE2      GLN   4  -6.965   3.093  16.095
   32    H    ALA   5           H        ALA   5 -13.528   2.169  11.622
   33    HA   ALA   5           HA       ALA   5 -12.653   1.264   9.063
   34   1HB   ALA   5          1HB       ALA   5 -15.367   2.298   9.139
   35   2HB   ALA   5          2HB       ALA   5 -14.804   0.620   8.953
   36   3HB   ALA   5          3HB       ALA   5 -15.037   1.305  10.579
   37    H    GLN   6           H        GLN   6 -11.910   2.493   7.410
   38    HA   GLN   6           HA       GLN   6 -13.090   4.869   6.667
   39   1HB   GLN   6          1HB       GLN   6 -12.025   5.760   8.747
   40   2HB   GLN   6          2HB       GLN   6 -10.453   5.272   8.147
   41   1HG   GLN   6          1HG       GLN   6 -10.390   6.942   6.516
   42   2HG   GLN   6          2HG       GLN   6 -12.132   6.985   6.332
   43   1HE2  GLN   6          1HE2      GLN   6 -13.222   8.558   7.248
   44   2HE2  GLN   6          2HE2      GLN   6 -12.659   9.632   8.485
   45    H    GLN   7           H        GLN   7 -12.561   5.200   4.523
   46    HA   GLN   7           HA       GLN   7 -10.106   3.894   3.637
   47   1HB   GLN   7          1HB       GLN   7 -12.028   2.595   2.872
   48   2HB   GLN   7          2HB       GLN   7 -12.815   4.031   2.247
   49   1HG   GLN   7          1HG       GLN   7 -10.580   4.283   0.818
   50   2HG   GLN   7          2HG       GLN   7 -10.393   2.574   1.161
   51   1HE2  GLN   7          1HE2      GLN   7 -11.907   1.083   0.418
   52   2HE2  GLN   7          2HE2      GLN   7 -13.003   1.425  -0.879
   53    H    PHE   8           H        PHE   8  -8.670   5.539   3.248
   54    HA   PHE   8           HA       PHE   8  -9.575   8.122   2.478
   55   1HB   PHE   8          1HB       PHE   8  -7.194   6.717   3.403
   56   2HB   PHE   8          2HB       PHE   8  -6.754   7.599   1.955
   57    HD1  PHE   8           1HD      PHE   8  -8.632   9.959   2.335
   58    HD2  PHE   8           2HD      PHE   8  -6.010   7.967   5.013
   59    HE1  PHE   8           1HE      PHE   8  -8.411  12.063   3.685
   60    HE2  PHE   8           2HE      PHE   8  -5.790  10.072   6.362
   61    HZ   PHE   8           HZ       PHE   8  -6.993  12.095   5.682
   62    H    ILE   9           H        ILE   9  -8.797   9.279   0.499
   63    HA   ILE   9           HA       ILE   9  -9.356   7.686  -1.797
   64    HB   ILE   9           HB       ILE   9  -8.457  10.560  -1.575
   65   1HG1  ILE   9          1HG1      ILE   9 -10.508  10.051  -0.260
   66   2HG1  ILE   9          2HG1      ILE   9 -10.765  11.189  -1.568
   67   1HG2  ILE   9          1HG2      ILE   9  -8.331  10.474  -3.792
   68   2HG2  ILE   9          2HG2      ILE   9  -9.007   8.828  -3.838
   69   3HG2  ILE   9          3HG2      ILE   9 -10.095  10.236  -3.808
   70   1HD1  ILE   9          1HD1      ILE   9 -11.224   8.719  -2.799
   71   2HD1  ILE   9          2HD1      ILE   9 -11.914   8.508  -1.172
   72   3HD1  ILE   9          3HD1      ILE   9 -12.476   9.839  -2.211
   73    H    PHE  10           H        PHE  10  -7.897   6.298  -2.638
   74    HA   PHE  10           HA       PHE  10  -5.316   7.311  -3.345
   75   1HB   PHE  10          1HB       PHE  10  -5.317   6.442  -0.847
   76   2HB   PHE  10          2HB       PHE  10  -5.548   4.846  -1.533
   77    HD1  PHE  10           1HD      PHE  10  -3.770   3.834  -2.936
   78    HD2  PHE  10           2HD      PHE  10  -3.184   7.521  -0.918
   79    HE1  PHE  10           1HE      PHE  10  -1.288   3.603  -3.234
   80    HE2  PHE  10           2HE      PHE  10  -0.702   7.290  -1.217
   81    HZ   PHE  10           HZ       PHE  10   0.216   5.334  -2.371
   82    H    LYS  11           H        LYS  11  -4.500   6.230  -5.137
   83    HA   LYS  11           HA       LYS  11  -5.747   3.672  -5.803
   84   1HB   LYS  11          1HB       LYS  11  -5.631   6.097  -7.618
   85   2HB   LYS  11          2HB       LYS  11  -5.977   4.472  -8.175
   86   1HG   LYS  11          1HG       LYS  11  -7.574   5.666  -5.885
   87   2HG   LYS  11          2HG       LYS  11  -7.975   6.074  -7.542
   88   1HD   LYS  11          1HD       LYS  11  -8.481   3.797  -8.105
   89   2HD   LYS  11          2HD       LYS  11  -7.668   3.173  -6.684
   90   1HE   LYS  11          1HE       LYS  11  -9.418   4.408  -5.265
   91   2HE   LYS  11          2HE       LYS  11 -10.280   4.751  -6.752
   92   1HZ   LYS  11          1HZ       LYS  11 -10.944   2.698  -5.536
   93   2HZ   LYS  11          2HZ       LYS  11 -10.611   2.483  -7.120
   94   3HZ   LYS  11          3HZ       LYS  11  -9.527   2.024  -5.987
   95    H    VAL  12           H        VAL  12  -4.172   2.198  -6.099
   96    HA   VAL  12           HA       VAL  12  -1.590   3.215  -7.069
   97    HB   VAL  12           HB       VAL  12  -2.010   2.205  -4.635
   98   1HG1  VAL  12          1HG1      VAL  12  -1.578  -0.124  -4.455
   99   2HG1  VAL  12          2HG1      VAL  12  -2.858   0.046  -5.680
  100   3HG1  VAL  12          3HG1      VAL  12  -1.179  -0.261  -6.185
  101   1HG2  VAL  12          1HG2      VAL  12   0.371   1.660  -4.549
  102   2HG2  VAL  12          2HG2      VAL  12   0.436   1.583  -6.326
  103   3HG2  VAL  12          3HG2      VAL  12   0.102   3.131  -5.514
  104    H    THR  13           H        THR  13  -0.706   2.239  -8.865
  105    HA   THR  13           HA       THR  13  -2.360   0.809 -10.575
  106    HB   THR  13           HB       THR  13  -0.317   0.616 -11.919
  107    HG1  THR  13           1HG      THR  13   0.845   1.169  -9.281
  108   1HG2  THR  13          1HG2      THR  13  -1.159   3.067 -10.913
  109   2HG2  THR  13          2HG2      THR  13   0.548   3.032 -10.409
  110   3HG2  THR  13          3HG2      THR  13   0.125   2.869 -12.130
  111    H    ASP  14           H        ASP  14  -2.209  -1.392 -11.390
  112    HA   ASP  14           HA       ASP  14  -2.385  -3.204  -9.318
  113   1HB   ASP  14          1HB       ASP  14  -2.364  -3.279 -12.301
  114   2HB   ASP  14          2HB       ASP  14  -1.908  -4.787 -11.534
  115    H    LYS  15           H        LYS  15   0.312  -1.996 -11.246
  116    HA   LYS  15           HA       LYS  15   2.046  -4.187 -11.007
  117   1HB   LYS  15          1HB       LYS  15   2.051  -1.776 -12.329
  118   2HB   LYS  15          2HB       LYS  15   3.273  -1.509 -11.102
  119   1HG   LYS  15          1HG       LYS  15   4.427  -2.472 -12.978
  120   2HG   LYS  15          2HG       LYS  15   4.319  -3.745 -11.778
  121   1HD   LYS  15          1HD       LYS  15   2.899  -5.023 -13.060
  122   2HD   LYS  15          2HD       LYS  15   1.993  -3.635 -13.629
  123   1HE   LYS  15          1HE       LYS  15   3.387  -3.287 -15.460
  124   2HE   LYS  15          2HE       LYS  15   4.815  -3.869 -14.626
  125   1HZ   LYS  15          1HZ       LYS  15   3.940  -6.103 -14.824
  126   2HZ   LYS  15          2HZ       LYS  15   2.619  -5.556 -15.613
  127   3HZ   LYS  15          3HZ       LYS  15   4.096  -5.412 -16.295
  128    H    ALA  16           H        ALA  16   1.366  -1.332  -8.924
  129    HA   ALA  16           HA       ALA  16   3.451  -1.945  -7.094
  130   1HB   ALA  16          1HB       ALA  16   1.094  -0.071  -7.218
  131   2HB   ALA  16          2HB       ALA  16   1.940  -0.311  -5.671
  132   3HB   ALA  16          3HB       ALA  16   2.830   0.299  -7.086
  133    H    VAL  17           H        VAL  17  -0.153  -2.384  -7.100
  134    HA   VAL  17           HA       VAL  17  -0.269  -3.648  -4.620
  135    HB   VAL  17           HB       VAL  17  -1.992  -3.271  -6.987
  136   1HG1  VAL  17          1HG1      VAL  17  -3.710  -4.870  -5.857
  137   2HG1  VAL  17          2HG1      VAL  17  -2.461  -5.552  -6.927
  138   3HG1  VAL  17          3HG1      VAL  17  -2.270  -5.651  -5.160
  139   1HG2  VAL  17          1HG2      VAL  17  -3.175  -2.004  -5.557
  140   2HG2  VAL  17          2HG2      VAL  17  -3.182  -3.265  -4.301
  141   3HG2  VAL  17          3HG2      VAL  17  -1.782  -2.177  -4.462
  142    H    GLU  18           H        GLU  18   0.119  -4.942  -7.974
  143    HA   GLU  18           HA       GLU  18   0.156  -7.610  -7.054
  144   1HB   GLU  18          1HB       GLU  18   0.466  -8.204  -9.326
  145   2HB   GLU  18          2HB       GLU  18  -0.479  -6.730  -9.399
  146   1HG   GLU  18          1HG       GLU  18   1.158  -6.124 -10.910
  147   2HG   GLU  18          2HG       GLU  18   1.980  -5.605  -9.452
  148    H    GLU  19           H        GLU  19   2.347  -5.095  -6.684
  149    HA   GLU  19           HA       GLU  19   4.684  -6.727  -7.093
  150   1HB   GLU  19          1HB       GLU  19   5.122  -4.543  -7.798
  151   2HB   GLU  19          2HB       GLU  19   4.153  -3.818  -6.531
  152   1HG   GLU  19          1HG       GLU  19   6.525  -3.416  -6.057
  153   2HG   GLU  19          2HG       GLU  19   5.869  -4.487  -4.835
  154    H    ILE  20           H        ILE  20   2.407  -5.957  -4.607
  155    HA   ILE  20           HA       ILE  20   4.305  -6.397  -2.463
  156    HB   ILE  20           HB       ILE  20   1.340  -6.123  -2.133
  157   1HG1  ILE  20          1HG1      ILE  20   1.662  -4.327  -3.589
  158   2HG1  ILE  20          2HG1      ILE  20   1.795  -3.609  -1.997
  159   1HG2  ILE  20          1HG2      ILE  20   3.713  -5.232  -0.471
  160   2HG2  ILE  20          2HG2      ILE  20   1.998  -5.009  -0.052
  161   3HG2  ILE  20          3HG2      ILE  20   2.680  -6.649  -0.164
  162   1HD1  ILE  20          1HD1      ILE  20   3.712  -2.708  -2.906
  163   2HD1  ILE  20          2HD1      ILE  20   4.407  -4.259  -2.377
  164   3HD1  ILE  20          3HD1      ILE  20   3.908  -4.039  -4.072
  165    H    LYS  21           H        LYS  21   1.820  -8.092  -4.351
  166    HA   LYS  21           HA       LYS  21   1.382 -10.213  -2.597
  167   1HB   LYS  21          1HB       LYS  21   1.120  -9.876  -5.584
  168   2HB   LYS  21          2HB       LYS  21   0.773 -11.408  -4.809
  169   1HG   LYS  21          1HG       LYS  21  -0.985 -10.455  -3.463
  170   2HG   LYS  21          2HG       LYS  21  -0.477  -8.815  -3.817
  171   1HD   LYS  21          1HD       LYS  21  -1.188  -9.012  -6.143
  172   2HD   LYS  21          2HD       LYS  21  -1.461 -10.735  -5.975
  173   1HE   LYS  21          1HE       LYS  21  -3.196 -10.130  -4.141
  174   2HE   LYS  21          2HE       LYS  21  -3.052  -8.473  -4.693
  175   1HZ   LYS  21          1HZ       LYS  21  -3.402  -9.773  -6.981
  176   2HZ   LYS  21          2HZ       LYS  21  -4.293 -10.705  -5.980
  177   3HZ   LYS  21          3HZ       LYS  21  -4.618  -9.111  -6.116
  178    H    LYS  22           H        LYS  22   3.970  -9.531  -4.973
  179    HA   LYS  22           HA       LYS  22   5.086 -12.148  -4.756
  180   1HB   LYS  22          1HB       LYS  22   6.783 -11.340  -6.215
  181   2HB   LYS  22          2HB       LYS  22   5.262 -10.666  -6.767
  182   1HG   LYS  22          1HG       LYS  22   6.023  -8.549  -6.475
  183   2HG   LYS  22          2HG       LYS  22   6.419  -8.872  -4.799
  184   1HD   LYS  22          1HD       LYS  22   8.297 -10.074  -6.784
  185   2HD   LYS  22          2HD       LYS  22   8.281  -8.322  -6.754
  186   1HE   LYS  22          1HE       LYS  22   9.060  -8.206  -4.542
  187   2HE   LYS  22          2HE       LYS  22   8.395  -9.769  -4.108
  188   1HZ   LYS  22          1HZ       LYS  22  10.083 -10.709  -5.676
  189   2HZ   LYS  22          2HZ       LYS  22  10.788  -9.236  -5.710
  190   3HZ   LYS  22          3HZ       LYS  22  10.681 -10.057  -4.303
  191    H    VAL  23           H        VAL  23   5.319  -9.080  -3.013
  192    HA   VAL  23           HA       VAL  23   7.782  -9.770  -1.727
  193    HB   VAL  23           HB       VAL  23   5.842  -7.543  -1.757
  194   1HG1  VAL  23          1HG1      VAL  23   7.277  -8.388   0.740
  195   2HG1  VAL  23          2HG1      VAL  23   7.112  -6.653   0.377
  196   3HG1  VAL  23          3HG1      VAL  23   5.660  -7.671   0.539
  197   1HG2  VAL  23          1HG2      VAL  23   7.613  -6.437  -2.561
  198   2HG2  VAL  23          2HG2      VAL  23   8.636  -6.930  -1.190
  199   3HG2  VAL  23          3HG2      VAL  23   8.461  -8.001  -2.601
  200    H    ALA  24           H        ALA  24   4.266  -9.989  -1.040
  201    HA   ALA  24           HA       ALA  24   4.682 -10.850   1.651
  202   1HB   ALA  24          1HB       ALA  24   2.662  -9.630   0.908
  203   2HB   ALA  24          2HB       ALA  24   2.242 -10.985  -0.167
  204   3HB   ALA  24          3HB       ALA  24   2.246 -11.217   1.597
  205    H    GLN  25           H        GLN  25   4.092 -12.381  -1.553
  206    HA   GLN  25           HA       GLN  25   3.564 -14.910  -0.722
  207   1HB   GLN  25          1HB       GLN  25   4.613 -13.624  -3.169
  208   2HB   GLN  25          2HB       GLN  25   5.127 -15.291  -2.999
  209   1HG   GLN  25          1HG       GLN  25   2.763 -16.008  -2.685
  210   2HG   GLN  25          2HG       GLN  25   2.229 -14.343  -2.796
  211   1HE2  GLN  25          1HE2      GLN  25   0.936 -14.804  -4.563
  212   2HE2  GLN  25          2HE2      GLN  25   1.563 -15.054  -6.158
  213    H    GLU  26           H        GLU  26   6.765 -13.300  -1.179
  214    HA   GLU  26           HA       GLU  26   8.225 -15.625  -0.606
  215   1HB   GLU  26          1HB       GLU  26   8.907 -13.343  -1.776
  216   2HB   GLU  26          2HB       GLU  26   9.320 -12.844  -0.147
  217   1HG   GLU  26          1HG       GLU  26  10.330 -15.547  -0.788
  218   2HG   GLU  26          2HG       GLU  26  10.953 -14.325  -1.879
  219    H    ASN  27           H        ASN  27   6.374 -13.474   1.346
  220    HA   ASN  27           HA       ASN  27   7.940 -14.181   3.690
  221   1HB   ASN  27          1HB       ASN  27   6.024 -11.947   3.006
  222   2HB   ASN  27          2HB       ASN  27   6.100 -12.450   4.682
  223   1HD2  ASN  27          1HD2      ASN  27   7.463 -10.566   2.273
  224   2HD2  ASN  27          2HD2      ASN  27   8.945 -10.103   3.040
  225    H    ASN  28           H        ASN  28   5.640 -15.575   1.889
  226    HA   ASN  28           HA       ASN  28   4.003 -16.961   2.195
  227   1HB   ASN  28          1HB       ASN  28   5.717 -17.593   4.207
  228   2HB   ASN  28          2HB       ASN  28   4.353 -17.102   5.192
  229   1HD2  ASN  28          1HD2      ASN  28   5.781 -19.705   4.153
  230   2HD2  ASN  28          2HD2      ASN  28   4.467 -20.787   3.832
  231    H    ILE  29           H        ILE  29   3.677 -13.966   2.694
  232    HA   ILE  29           HA       ILE  29   1.449 -13.978   4.586
  233    HB   ILE  29           HB       ILE  29   3.215 -11.835   3.442
  234   1HG1  ILE  29          1HG1      ILE  29   2.553 -12.765   6.249
  235   2HG1  ILE  29          2HG1      ILE  29   4.072 -12.964   5.398
  236   1HG2  ILE  29          1HG2      ILE  29   0.594 -11.432   4.909
  237   2HG2  ILE  29          2HG2      ILE  29   1.802 -10.164   4.588
  238   3HG2  ILE  29          3HG2      ILE  29   0.967 -10.962   3.233
  239   1HD1  ILE  29          1HD1      ILE  29   4.039 -10.340   5.189
  240   2HD1  ILE  29          2HD1      ILE  29   2.845 -10.426   6.506
  241   3HD1  ILE  29          3HD1      ILE  29   4.484 -11.076   6.747
  242    H    GLU  30           H        GLU  30  -0.659 -13.584   3.957
  243    HA   GLU  30           HA       GLU  30  -1.001 -13.340   1.070
  244   1HB   GLU  30          1HB       GLU  30  -1.994 -15.294   2.884
  245   2HB   GLU  30          2HB       GLU  30  -3.376 -14.310   2.447
  246   1HG   GLU  30          1HG       GLU  30  -3.317 -14.952   0.220
  247   2HG   GLU  30          2HG       GLU  30  -1.570 -15.078   0.186
  248    H    ASN  31           H        ASN  31  -0.877 -11.415   3.639
  249    HA   ASN  31           HA       ASN  31  -2.928  -9.708   2.576
  250   1HB   ASN  31          1HB       ASN  31  -3.814 -11.144   4.619
  251   2HB   ASN  31          2HB       ASN  31  -2.805 -10.095   5.595
  252   1HD2  ASN  31          1HD2      ASN  31  -3.279  -7.934   5.820
  253   2HD2  ASN  31          2HD2      ASN  31  -4.799  -7.234   5.373
  254    HA   PRO  32           HA       PRO  32   0.969  -7.706   3.883
  255   1HB   PRO  32          1HB       PRO  32   1.556  -6.461   1.522
  256   2HB   PRO  32          2HB       PRO  32   2.195  -8.032   1.962
  257   1HG   PRO  32          1HG       PRO  32   0.054  -7.376   0.032
  258   2HG   PRO  32          2HG       PRO  32   0.987  -8.852   0.176
  259   1HD   PRO  32          1HD       PRO  32  -1.716  -8.439   1.043
  260   2HD   PRO  32          2HD       PRO  32  -0.744  -9.876   1.290
  261    H    ILE  33           H        ILE  33   1.591  -5.444   4.217
  262    HA   ILE  33           HA       ILE  33  -0.739  -3.715   3.805
  263    HB   ILE  33           HB       ILE  33   0.808  -4.139   6.358
  264   1HG1  ILE  33          1HG1      ILE  33  -2.156  -4.124   6.286
  265   2HG1  ILE  33          2HG1      ILE  33  -1.388  -5.465   5.459
  266   1HG2  ILE  33          1HG2      ILE  33   0.536  -1.731   5.941
  267   2HG2  ILE  33          2HG2      ILE  33  -1.218  -1.967   5.751
  268   3HG2  ILE  33          3HG2      ILE  33  -0.441  -2.289   7.320
  269   1HD1  ILE  33          1HD1      ILE  33  -0.678  -6.418   7.407
  270   2HD1  ILE  33          2HD1      ILE  33  -0.149  -4.857   8.079
  271   3HD1  ILE  33          3HD1      ILE  33  -1.859  -5.339   8.188
  272    H    LEU  34           H        LEU  34  -0.109  -2.134   2.444
  273    HA   LEU  34           HA       LEU  34   2.704  -1.431   2.368
  274   1HB   LEU  34          1HB       LEU  34   0.377  -0.569   0.643
  275   2HB   LEU  34          2HB       LEU  34   2.056  -0.143   0.377
  276    HG   LEU  34           HG       LEU  34   1.551  -1.890  -1.133
  277   1HD1  LEU  34          1HD1      LEU  34   2.877  -3.545   0.970
  278   2HD1  LEU  34          2HD1      LEU  34   3.298  -3.308  -0.743
  279   3HD1  LEU  34          3HD1      LEU  34   3.669  -2.038   0.448
  280   1HD2  LEU  34          1HD2      LEU  34   0.717  -3.857   0.953
  281   2HD2  LEU  34          2HD2      LEU  34  -0.459  -2.628   0.428
  282   3HD2  LEU  34          3HD2      LEU  34   0.262  -3.737  -0.764
  283    H    ARG  35           H        ARG  35   3.436   0.029   3.815
  284    HA   ARG  35           HA       ARG  35   1.542   2.017   4.722
  285   1HB   ARG  35          1HB       ARG  35   2.769   0.738   6.460
  286   2HB   ARG  35          2HB       ARG  35   4.306   1.218   5.767
  287   1HG   ARG  35          1HG       ARG  35   4.215   3.335   6.672
  288   2HG   ARG  35          2HG       ARG  35   2.489   3.490   6.412
  289   1HD   ARG  35          1HD       ARG  35   1.956   2.622   8.485
  290   2HD   ARG  35          2HD       ARG  35   3.250   1.442   8.444
  291    HE   ARG  35           HE       ARG  35   3.375   4.083   9.627
  292   1HH1  ARG  35          2HH2      ARG  35   5.330   1.675   7.965
  293   2HH1  ARG  35          1HH2      ARG  35   6.820   2.218   8.662
  294   1HH2  ARG  35          2HH1      ARG  35   5.340   4.799  10.547
  295   2HH2  ARG  35          1HH1      ARG  35   6.826   4.007  10.140
  296    H    ILE  36           H        ILE  36   1.652   4.103   3.936
  297    HA   ILE  36           HA       ILE  36   3.907   4.771   2.243
  298    HB   ILE  36           HB       ILE  36   1.112   5.629   2.565
  299   1HG1  ILE  36          1HG1      ILE  36   1.638   6.085   0.023
  300   2HG1  ILE  36          2HG1      ILE  36   3.070   5.128   0.346
  301   1HG2  ILE  36          1HG2      ILE  36   3.285   7.623   1.891
  302   2HG2  ILE  36          2HG2      ILE  36   1.569   7.842   1.476
  303   3HG2  ILE  36          3HG2      ILE  36   2.064   7.727   3.182
  304   1HD1  ILE  36          1HD1      ILE  36   1.158   3.576   1.569
  305   2HD1  ILE  36          2HD1      ILE  36   0.217   4.290   0.237
  306   3HD1  ILE  36          3HD1      ILE  36   1.691   3.358  -0.115
  307    H    ARG  37           H        ARG  37   5.577   6.072   2.826
  308    HA   ARG  37           HA       ARG  37   5.159   7.904   4.988
  309   1HB   ARG  37          1HB       ARG  37   6.249   5.396   5.582
  310   2HB   ARG  37          2HB       ARG  37   7.681   6.380   5.356
  311   1HG   ARG  37          1HG       ARG  37   6.734   8.075   6.971
  312   2HG   ARG  37          2HG       ARG  37   5.359   7.021   7.236
  313   1HD   ARG  37          1HD       ARG  37   6.816   6.472   9.027
  314   2HD   ARG  37          2HD       ARG  37   7.106   5.188   7.871
  315    HE   ARG  37           HE       ARG  37   8.876   7.510   7.535
  316   1HH1  ARG  37          2HH2      ARG  37   8.428   4.405   9.129
  317   2HH1  ARG  37          1HH2      ARG  37  10.118   4.164   9.417
  318   1HH2  ARG  37          2HH1      ARG  37  11.107   7.193   7.915
  319   2HH2  ARG  37          1HH1      ARG  37  11.653   5.761   8.722
  320    H    VAL  38           H        VAL  38   6.178   9.814   4.430
  321    HA   VAL  38           HA       VAL  38   7.634  10.023   2.064
  322    HB   VAL  38           HB       VAL  38   7.741  11.962   4.367
  323   1HG1  VAL  38          1HG1      VAL  38   9.096  12.339   2.259
  324   2HG1  VAL  38          2HG1      VAL  38   7.550  12.497   1.390
  325   3HG1  VAL  38          3HG1      VAL  38   7.961  13.642   2.690
  326   1HG2  VAL  38          1HG2      VAL  38   5.392  11.039   2.840
  327   2HG2  VAL  38          2HG2      VAL  38   5.488  11.896   4.397
  328   3HG2  VAL  38          3HG2      VAL  38   5.605  12.806   2.872
  329    H    VAL  39           H        VAL  39   9.688   9.454   1.588
  330    HA   VAL  39           HA       VAL  39  11.474   8.931   3.836
  331    HB   VAL  39           HB       VAL  39  11.011   7.189   2.125
  332   1HG1  VAL  39          1HG1      VAL  39  12.806   8.358   0.113
  333   2HG1  VAL  39          2HG1      VAL  39  11.263   7.494  -0.087
  334   3HG1  VAL  39          3HG1      VAL  39  11.266   9.233   0.291
  335   1HG2  VAL  39          1HG2      VAL  39  13.532   6.776   1.617
  336   2HG2  VAL  39          2HG2      VAL  39  13.798   8.227   2.613
  337   3HG2  VAL  39          3HG2      VAL  39  12.981   6.807   3.309
  338    HA   PRO  40           HA       PRO  40  13.373  12.747   2.850
  339   1HB   PRO  40          1HB       PRO  40  15.057  12.847   5.000
  340   2HB   PRO  40          2HB       PRO  40  13.401  13.419   5.052
  341   1HG   PRO  40          1HG       PRO  40  14.542  10.939   6.187
  342   2HG   PRO  40          2HG       PRO  40  13.029  11.730   6.578
  343   1HD   PRO  40          1HD       PRO  40  13.372   9.382   4.968
  344   2HD   PRO  40          2HD       PRO  40  11.873  10.240   5.264
  345    H    GLY  41           H        GLY  41  14.130  11.486   0.915
  346   1HA   GLY  41          1HA       GLY  41  17.062  11.320   1.157
  347   2HA   GLY  41          2HA       GLY  41  16.159   9.990   0.460
  348    H    GLY  42           H        GLY  42  17.471  13.195  -0.050
  349   1HA   GLY  42          1HA       GLY  42  17.965  14.126  -2.087
  350   2HA   GLY  42          2HA       GLY  42  16.909  12.982  -2.891
  351    H    CYS  43           H        CYS  43  17.270  16.217  -2.009
  352    HA   CYS  43           HA       CYS  43  14.528  16.783  -1.462
  353   1HB   CYS  43          1HB       CYS  43  15.257  19.157  -1.595
  354   2HB   CYS  43          2HB       CYS  43  16.197  18.203  -0.465
  355    HG   CYS  43           HG       CYS  43  17.252  18.015  -3.496
  356    H    SER  44           H        SER  44  16.351  15.936  -4.218
  357    HA   SER  44           HA       SER  44  14.594  17.476  -5.953
  358   1HB   SER  44          1HB       SER  44  17.392  16.462  -6.183
  359   2HB   SER  44          2HB       SER  44  16.436  16.347  -7.647
  360    HG   SER  44           HG       SER  44  17.167  18.389  -7.837
  361    H    GLY  45           H        GLY  45  15.908  14.192  -5.237
  362   1HA   GLY  45          1HA       GLY  45  13.704  13.053  -6.852
  363   2HA   GLY  45          2HA       GLY  45  15.300  12.339  -6.732
  364    H    PHE  46           H        PHE  46  12.144  12.287  -5.488
  365    HA   PHE  46           HA       PHE  46  12.946  10.448  -3.438
  366   1HB   PHE  46          1HB       PHE  46  11.707  11.776  -1.670
  367   2HB   PHE  46          2HB       PHE  46  13.099  12.652  -2.276
  368    HD1  PHE  46           1HD      PHE  46  12.770  14.533  -3.876
  369    HD2  PHE  46           2HD      PHE  46   9.496  12.613  -1.978
  370    HE1  PHE  46           1HE      PHE  46  11.296  16.483  -4.447
  371    HE2  PHE  46           2HE      PHE  46   8.022  14.562  -2.549
  372    HZ   PHE  46           HZ       PHE  46   8.939  16.474  -3.776
  373    H    GLN  47           H        GLN  47  11.356   8.906  -3.081
  374    HA   GLN  47           HA       GLN  47   8.714   9.553  -4.102
  375   1HB   GLN  47          1HB       GLN  47   8.678   7.113  -5.002
  376   2HB   GLN  47          2HB       GLN  47   9.534   8.323  -5.937
  377   1HG   GLN  47          1HG       GLN  47  11.301   7.148  -3.917
  378   2HG   GLN  47          2HG       GLN  47  10.586   5.894  -4.911
  379   1HE2  GLN  47          1HE2      GLN  47  12.771   5.565  -5.638
  380   2HE2  GLN  47          2HE2      GLN  47  13.426   6.520  -6.926
  381    H    TYR  48           H        TYR  48   7.039   7.869  -3.327
  382    HA   TYR  48           HA       TYR  48   7.584   7.366  -0.525
  383   1HB   TYR  48          1HB       TYR  48   5.149   6.975  -2.377
  384   2HB   TYR  48          2HB       TYR  48   5.085   6.854  -0.630
  385    HD1  TYR  48           1HD      TYR  48   4.970   9.078  -3.473
  386    HD2  TYR  48           2HD      TYR  48   5.543   8.930   0.764
  387    HE1  TYR  48           1HE      TYR  48   4.478  11.567  -3.312
  388    HE2  TYR  48           2HE      TYR  48   5.050  11.420   0.911
  389    HH   TYR  48           HH       TYR  48   5.275  13.440  -1.423
  390    H    ALA  49           H        ALA  49   8.775   5.520  -0.175
  391    HA   ALA  49           HA       ALA  49   8.309   3.199  -1.816
  392   1HB   ALA  49          1HB       ALA  49  10.301   4.174   0.140
  393   2HB   ALA  49          2HB       ALA  49   9.978   2.426   0.233
  394   3HB   ALA  49          3HB       ALA  49  10.517   3.152  -1.301
  395    H    MET  50           H        MET  50   7.236   1.313  -1.215
  396    HA   MET  50           HA       MET  50   5.933   1.459   1.394
  397   1HB   MET  50          1HB       MET  50   3.923   0.552   0.389
  398   2HB   MET  50          2HB       MET  50   4.456   1.813  -0.705
  399   1HG   MET  50          1HG       MET  50   5.734  -0.059  -1.986
  400   2HG   MET  50          2HG       MET  50   4.802  -1.197  -1.032
  401   1HE   MET  50          1HE       MET  50   4.326   0.268  -4.732
  402   2HE   MET  50          2HE       MET  50   5.081  -1.077  -3.845
  403   3HE   MET  50          3HE       MET  50   3.456  -1.273  -4.545
  404    H    GLY  51           H        GLY  51   5.156  -0.806   2.161
  405   1HA   GLY  51          1HA       GLY  51   6.260  -3.161   1.127
  406   2HA   GLY  51          2HA       GLY  51   7.382  -2.520   2.311
  407    H    PHE  52           H        PHE  52   6.031  -4.996   2.685
  408    HA   PHE  52           HA       PHE  52   3.691  -4.665   4.226
  409   1HB   PHE  52          1HB       PHE  52   4.032  -7.063   4.605
  410   2HB   PHE  52          2HB       PHE  52   4.592  -6.740   2.976
  411    HD1  PHE  52           1HD      PHE  52   5.554  -7.755   6.324
  412    HD2  PHE  52           2HD      PHE  52   7.016  -6.674   2.490
  413    HE1  PHE  52           1HE      PHE  52   7.785  -8.753   6.893
  414    HE2  PHE  52           2HE      PHE  52   9.247  -7.672   3.059
  415    HZ   PHE  52           HZ       PHE  52   9.606  -8.699   5.254
  416    H    ASP  53           H        ASP  53   3.558  -3.741   6.212
  417    HA   ASP  53           HA       ASP  53   5.944  -3.522   7.768
  418   1HB   ASP  53          1HB       ASP  53   4.242  -2.383   9.395
  419   2HB   ASP  53          2HB       ASP  53   4.624  -1.576   7.887
  420    H    ASP  54           H        ASP  54   5.454  -3.896  10.346
  421    HA   ASP  54           HA       ASP  54   5.071  -6.636  10.613
  422   1HB   ASP  54          1HB       ASP  54   6.314  -4.819  12.113
  423   2HB   ASP  54          2HB       ASP  54   4.767  -4.706  12.928
  424    H    THR  55           H        THR  55   3.051  -3.714  11.286
  425    HA   THR  55           HA       THR  55   0.639  -5.190  11.001
  426    HB   THR  55           HB       THR  55   1.716  -5.554  13.476
  427    HG1  THR  55           1HG      THR  55  -0.591  -5.866  14.010
  428   1HG2  THR  55          1HG2      THR  55   1.134  -3.935  15.031
  429   2HG2  THR  55          2HG2      THR  55   1.285  -2.843  13.633
  430   3HG2  THR  55          3HG2      THR  55  -0.316  -3.450  14.120
  431    H    VAL  56           H        VAL  56  -1.255  -3.594  11.942
  432    HA   VAL  56           HA       VAL  56  -0.782  -1.187  10.426
  433    HB   VAL  56           HB       VAL  56  -2.886  -2.830  10.646
  434   1HG1  VAL  56          1HG1      VAL  56  -3.891  -0.550  12.314
  435   2HG1  VAL  56          2HG1      VAL  56  -4.509  -2.212  12.157
  436   3HG1  VAL  56          3HG1      VAL  56  -3.044  -1.894  13.117
  437   1HG2  VAL  56          1HG2      VAL  56  -4.279  -0.866   9.795
  438   2HG2  VAL  56          2HG2      VAL  56  -2.832   0.138  10.056
  439   3HG2  VAL  56          3HG2      VAL  56  -2.777  -1.224   8.911
  440    H    GLU  57           H        GLU  57  -1.251   0.981  11.296
  441    HA   GLU  57           HA       GLU  57  -0.159   1.172  13.941
  442   1HB   GLU  57          1HB       GLU  57  -1.034   3.477  12.161
  443   2HB   GLU  57          2HB       GLU  57   0.145   3.510  13.457
  444   1HG   GLU  57          1HG       GLU  57   1.139   1.513  11.761
  445   2HG   GLU  57          2HG       GLU  57   0.479   2.685  10.638
  446    H    GLU  58           H        GLU  58  -1.200   3.011  15.402
  447    HA   GLU  58           HA       GLU  58  -3.927   2.190  15.735
  448   1HB   GLU  58          1HB       GLU  58  -2.166   2.434  17.611
  449   2HB   GLU  58          2HB       GLU  58  -2.379   4.166  17.454
  450   1HG   GLU  58          1HG       GLU  58  -4.100   3.941  18.926
  451   2HG   GLU  58          2HG       GLU  58  -5.013   3.278  17.585
  452    H    GLY  59           H        GLY  59  -2.970   4.000  13.448
  453   1HA   GLY  59          1HA       GLY  59  -5.195   5.747  13.428
  454   2HA   GLY  59          2HA       GLY  59  -3.746   6.643  13.840
  455    H    ASP  60           H        ASP  60  -4.256   3.798  11.637
  456    HA   ASP  60           HA       ASP  60  -3.172   5.487   9.521
  457   1HB   ASP  60          1HB       ASP  60  -2.157   3.058  10.564
  458   2HB   ASP  60          2HB       ASP  60  -2.930   2.594   9.062
  459    H    HIS  61           H        HIS  61  -4.568   5.702   7.751
  460    HA   HIS  61           HA       HIS  61  -7.109   4.529   7.841
  461   1HB   HIS  61          1HB       HIS  61  -5.592   6.120   5.777
  462   2HB   HIS  61          2HB       HIS  61  -7.182   5.471   5.427
  463    HD1  HIS  61           1HD      HIS  61  -5.981   7.107   8.680
  464    HD2  HIS  61           2HD      HIS  61  -8.779   7.689   5.610
  465    HE1  HIS  61           1HE      HIS  61  -7.392   9.118   9.371
  466    H    VAL  62           H        VAL  62  -7.290   2.321   7.739
  467    HA   VAL  62           HA       VAL  62  -5.569   0.800   6.037
  468    HB   VAL  62           HB       VAL  62  -7.116   0.363   8.306
  469   1HG1  VAL  62          1HG1      VAL  62  -9.116  -0.034   6.993
  470   2HG1  VAL  62          2HG1      VAL  62  -8.252  -1.200   5.963
  471   3HG1  VAL  62          3HG1      VAL  62  -8.545  -1.574   7.678
  472   1HG2  VAL  62          1HG2      VAL  62  -5.846  -1.776   6.570
  473   2HG2  VAL  62          2HG2      VAL  62  -4.924  -0.661   7.608
  474   3HG2  VAL  62          3HG2      VAL  62  -6.083  -1.800   8.334
  475    H    PHE  63           H        PHE  63  -5.832   0.500   3.890
  476    HA   PHE  63           HA       PHE  63  -8.552   0.858   2.845
  477   1HB   PHE  63          1HB       PHE  63  -6.437   2.417   2.292
  478   2HB   PHE  63          2HB       PHE  63  -5.929   1.073   1.290
  479    HD1  PHE  63           1HD      PHE  63  -6.632   3.923   0.413
  480    HD2  PHE  63           2HD      PHE  63  -8.893   0.334   0.541
  481    HE1  PHE  63           1HE      PHE  63  -8.080   4.768  -1.455
  482    HE2  PHE  63           2HE      PHE  63 -10.341   1.179  -1.327
  483    HZ   PHE  63           HZ       PHE  63  -9.917   3.387  -2.303
  484    H    GLU  64           H        GLU  64  -9.469  -1.063   2.303
  485    HA   GLU  64           HA       GLU  64  -7.881  -3.355   1.949
  486   1HB   GLU  64          1HB       GLU  64 -10.832  -2.890   1.330
  487   2HB   GLU  64          2HB       GLU  64 -10.057  -4.459   1.407
  488   1HG   GLU  64          1HG       GLU  64  -9.469  -4.085   3.789
  489   2HG   GLU  64          2HG       GLU  64 -10.153  -2.473   3.727
  490    H    TYR  65           H        TYR  65  -7.127  -4.347   0.083
  491    HA   TYR  65           HA       TYR  65  -7.872  -3.031  -2.443
  492   1HB   TYR  65          1HB       TYR  65  -5.336  -3.645  -1.034
  493   2HB   TYR  65          2HB       TYR  65  -5.354  -4.403  -2.614
  494    HD1  TYR  65           1HD      TYR  65  -5.692  -2.958  -4.672
  495    HD2  TYR  65           2HD      TYR  65  -4.970  -1.304  -0.793
  496    HE1  TYR  65           1HE      TYR  65  -5.017  -0.748  -5.732
  497    HE2  TYR  65           2HE      TYR  65  -4.298   0.900  -1.866
  498    HH   TYR  65           HH       TYR  65  -4.241   2.056  -3.714
  499    H    ASP  66           H        ASP  66  -6.475  -4.867  -4.127
  500    HA   ASP  66           HA       ASP  66  -8.429  -6.831  -4.331
  501   1HB   ASP  66          1HB       ASP  66  -6.857  -5.851  -6.144
  502   2HB   ASP  66          2HB       ASP  66  -5.634  -6.951  -5.540
  503    H    GLY  67           H        GLY  67  -8.157  -7.609  -1.955
  504   1HA   GLY  67          1HA       GLY  67  -7.663  -9.394  -0.651
  505   2HA   GLY  67          2HA       GLY  67  -6.654 -10.049  -1.925
  506    H    VAL  68           H        VAL  68  -6.010  -6.716  -1.085
  507    HA   VAL  68           HA       VAL  68  -3.850  -7.560   0.708
  508    HB   VAL  68           HB       VAL  68  -3.665  -5.815  -1.748
  509   1HG1  VAL  68          1HG1      VAL  68  -1.254  -5.480  -1.023
  510   2HG1  VAL  68          2HG1      VAL  68  -2.480  -4.590  -0.088
  511   3HG1  VAL  68          3HG1      VAL  68  -1.747  -6.066   0.584
  512   1HG2  VAL  68          1HG2      VAL  68  -2.173  -7.395  -2.603
  513   2HG2  VAL  68          2HG2      VAL  68  -1.840  -8.097  -1.001
  514   3HG2  VAL  68          3HG2      VAL  68  -3.403  -8.399  -1.798
  515    H    LYS  69           H        LYS  69  -3.026  -5.728   2.060
  516    HA   LYS  69           HA       LYS  69  -5.214  -3.830   2.538
  517   1HB   LYS  69          1HB       LYS  69  -4.456  -5.665   4.278
  518   2HB   LYS  69          2HB       LYS  69  -3.165  -4.530   4.616
  519   1HG   LYS  69          1HG       LYS  69  -4.917  -2.718   4.936
  520   2HG   LYS  69          2HG       LYS  69  -6.159  -3.938   4.734
  521   1HD   LYS  69          1HD       LYS  69  -4.334  -4.987   6.667
  522   2HD   LYS  69          2HD       LYS  69  -4.585  -3.309   7.103
  523   1HE   LYS  69          1HE       LYS  69  -6.999  -3.607   7.212
  524   2HE   LYS  69          2HE       LYS  69  -6.900  -5.194   6.475
  525   1HZ   LYS  69          1HZ       LYS  69  -5.367  -4.805   8.887
  526   2HZ   LYS  69          2HZ       LYS  69  -6.990  -4.840   9.061
  527   3HZ   LYS  69          3HZ       LYS  69  -6.213  -6.110   8.390
  528    H    VAL  70           H        VAL  70  -4.704  -1.618   2.918
  529    HA   VAL  70           HA       VAL  70  -1.921  -0.884   2.411
  530    HB   VAL  70           HB       VAL  70  -4.352  -0.096   0.835
  531   1HG1  VAL  70          1HG1      VAL  70  -2.610   1.660  -0.154
  532   2HG1  VAL  70          2HG1      VAL  70  -3.683   2.064   1.207
  533   3HG1  VAL  70          3HG1      VAL  70  -1.990   1.609   1.514
  534   1HG2  VAL  70          1HG2      VAL  70  -1.526  -0.925   0.097
  535   2HG2  VAL  70          2HG2      VAL  70  -3.011  -1.891  -0.079
  536   3HG2  VAL  70          3HG2      VAL  70  -2.777  -0.430  -1.069
  537    H    VAL  71           H        VAL  71  -1.315   1.158   3.337
  538    HA   VAL  71           HA       VAL  71  -3.356   2.497   4.915
  539    HB   VAL  71           HB       VAL  71  -2.163   2.328   6.959
  540   1HG1  VAL  71          1HG1      VAL  71  -2.141  -0.157   7.346
  541   2HG1  VAL  71          2HG1      VAL  71  -3.629   0.464   6.591
  542   3HG1  VAL  71          3HG1      VAL  71  -2.409  -0.373   5.600
  543   1HG2  VAL  71          1HG2      VAL  71   0.000   0.925   5.363
  544   2HG2  VAL  71          2HG2      VAL  71   0.119   2.466   6.246
  545   3HG2  VAL  71          3HG2      VAL  71  -0.068   0.939   7.141
  546    H    ILE  72           H        ILE  72  -2.554   4.633   5.731
  547    HA   ILE  72           HA       ILE  72  -0.148   5.567   4.396
  548    HB   ILE  72           HB       ILE  72  -2.731   7.064   4.040
  549   1HG1  ILE  72          1HG1      ILE  72  -1.505   5.180   2.009
  550   2HG1  ILE  72          2HG1      ILE  72  -2.873   4.763   3.022
  551   1HG2  ILE  72          1HG2      ILE  72  -1.522   8.253   2.325
  552   2HG2  ILE  72          2HG2      ILE  72  -0.590   8.297   3.841
  553   3HG2  ILE  72          3HG2      ILE  72  -0.108   7.193   2.530
  554   1HD1  ILE  72          1HD1      ILE  72  -4.250   6.494   2.057
  555   2HD1  ILE  72          2HD1      ILE  72  -2.851   7.245   1.254
  556   3HD1  ILE  72          3HD1      ILE  72  -3.454   5.665   0.698
  557    H    ASP  73           H        ASP  73   0.974   7.005   5.651
  558    HA   ASP  73           HA       ASP  73   0.298   7.256   8.289
  559   1HB   ASP  73          1HB       ASP  73   2.318   8.329   6.443
  560   2HB   ASP  73          2HB       ASP  73   1.901   9.506   7.672
  561    HA   PRO  74           HA       PRO  74  -2.340  10.758   8.325
  562   1HB   PRO  74          1HB       PRO  74  -1.775  11.943  10.722
  563   2HB   PRO  74          2HB       PRO  74  -2.797  10.528  10.570
  564   1HG   PRO  74          1HG       PRO  74  -0.011  10.706  11.542
  565   2HG   PRO  74          2HG       PRO  74  -1.175   9.416  11.774
  566   1HD   PRO  74          1HD       PRO  74   1.036   9.425   9.947
  567   2HD   PRO  74          2HD       PRO  74  -0.194   8.186  10.097
  568    H    PHE  75           H        PHE  75   1.036  11.292   8.599
  569    HA   PHE  75           HA       PHE  75   0.668  14.110   7.987
  570   1HB   PHE  75          1HB       PHE  75   2.725  12.251   9.094
  571   2HB   PHE  75          2HB       PHE  75   3.411  13.401   7.964
  572    HD1  PHE  75           1HD      PHE  75   1.928  12.954  11.248
  573    HD2  PHE  75           2HD      PHE  75   3.304  15.822   8.439
  574    HE1  PHE  75           1HE      PHE  75   1.989  14.695  13.055
  575    HE2  PHE  75           2HE      PHE  75   3.364  17.563  10.246
  576    HZ   PHE  75           HZ       PHE  75   2.706  16.978  12.532
  577    H    SER  76           H        SER  76   1.518  11.019   6.488
  578    HA   SER  76           HA       SER  76   2.615  12.357   4.192
  579   1HB   SER  76          1HB       SER  76   2.080   9.383   4.604
  580   2HB   SER  76          2HB       SER  76   3.092  10.097   3.365
  581    HG   SER  76           HG       SER  76   3.844  10.933   5.908
  582    H    MET  77           H        MET  77  -0.428  11.157   5.396
  583    HA   MET  77           HA       MET  77  -1.641  10.362   3.059
  584   1HB   MET  77          1HB       MET  77  -2.390  11.161   5.798
  585   2HB   MET  77          2HB       MET  77  -3.612  11.671   4.650
  586   1HG   MET  77          1HG       MET  77  -2.546   8.833   5.027
  587   2HG   MET  77          2HG       MET  77  -4.149   9.409   5.440
  588   1HE   MET  77          1HE       MET  77  -5.692  10.377   2.103
  589   2HE   MET  77          2HE       MET  77  -5.228  11.041   3.688
  590   3HE   MET  77          3HE       MET  77  -4.228  11.378   2.254
  591    HA   PRO  78           HA       PRO  78  -2.910  14.909   2.540
  592   1HB   PRO  78          1HB       PRO  78  -1.687  16.838   4.041
  593   2HB   PRO  78          2HB       PRO  78  -3.235  16.133   4.463
  594   1HG   PRO  78          1HG       PRO  78  -0.582  15.644   5.674
  595   2HG   PRO  78          2HG       PRO  78  -2.169  15.295   6.330
  596   1HD   PRO  78          1HD       PRO  78  -0.337  13.413   5.177
  597   2HD   PRO  78          2HD       PRO  78  -1.968  13.085   5.727
  598    H    TYR  79           H        TYR  79  -0.003  13.513   2.443
  599    HA   TYR  79           HA       TYR  79   1.123  15.667   0.794
  600   1HB   TYR  79          1HB       TYR  79   2.059  13.827   2.838
  601   2HB   TYR  79          2HB       TYR  79   2.821  13.333   1.339
  602    HD1  TYR  79           1HD      TYR  79   4.213  15.022   0.050
  603    HD2  TYR  79           2HD      TYR  79   2.804  15.752   4.023
  604    HE1  TYR  79           1HE      TYR  79   5.950  16.857   0.336
  605    HE2  TYR  79           2HE      TYR  79   4.545  17.584   4.296
  606    HH   TYR  79           HH       TYR  79   6.948  17.972   3.117
  607    H    VAL  80           H        VAL  80  -0.327  12.489   0.748
  608    HA   VAL  80           HA       VAL  80   0.452  12.260  -2.074
  609    HB   VAL  80           HB       VAL  80   0.726   9.942  -1.872
  610   1HG1  VAL  80          1HG1      VAL  80   2.226  11.717  -0.200
  611   2HG1  VAL  80          2HG1      VAL  80   2.091  10.144   0.623
  612   3HG1  VAL  80          3HG1      VAL  80   2.765  10.233  -1.022
  613   1HG2  VAL  80          1HG2      VAL  80  -0.238  10.041   1.003
  614   2HG2  VAL  80          2HG2      VAL  80  -1.266   9.595  -0.380
  615   3HG2  VAL  80          3HG2      VAL  80   0.150   8.599   0.034
  616    H    ASN  81           H        ASN  81  -1.958  13.063   0.009
  617    HA   ASN  81           HA       ASN  81  -4.066  11.458  -0.544
  618   1HB   ASN  81          1HB       ASN  81  -4.277  13.274   1.064
  619   2HB   ASN  81          2HB       ASN  81  -3.897  14.482  -0.147
  620   1HD2  ASN  81          1HD2      ASN  81  -6.263  12.129   0.944
  621   2HD2  ASN  81          2HD2      ASN  81  -7.656  12.812   0.174
  622    H    GLY  82           H        GLY  82  -5.878  11.710  -2.140
  623   1HA   GLY  82          1HA       GLY  82  -6.502  11.708  -4.320
  624   2HA   GLY  82          2HA       GLY  82  -6.191  13.426  -4.175
  625    H    ALA  83           H        ALA  83  -3.989  10.531  -4.248
  626    HA   ALA  83           HA       ALA  83  -2.968  11.347  -6.816
  627   1HB   ALA  83          1HB       ALA  83  -1.806  12.523  -4.614
  628   2HB   ALA  83          2HB       ALA  83  -0.794  11.075  -4.830
  629   3HB   ALA  83          3HB       ALA  83  -0.984  12.235  -6.166
  630    H    GLU  84           H        GLU  84  -1.554   9.677  -7.745
  631    HA   GLU  84           HA       GLU  84  -2.032   7.133  -6.405
  632   1HB   GLU  84          1HB       GLU  84  -1.739   7.846  -9.348
  633   2HB   GLU  84          2HB       GLU  84  -1.655   6.191  -8.780
  634   1HG   GLU  84          1HG       GLU  84  -3.915   6.068  -8.642
  635   2HG   GLU  84          2HG       GLU  84  -3.967   7.456  -7.574
  636    H    LEU  85           H        LEU  85  -0.298   5.425  -6.759
  637    HA   LEU  85           HA       LEU  85   2.336   6.641  -7.154
  638   1HB   LEU  85          1HB       LEU  85   2.680   6.550  -4.971
  639   2HB   LEU  85          2HB       LEU  85   1.225   5.616  -4.687
  640    HG   LEU  85           HG       LEU  85   2.425   3.539  -5.208
  641   1HD1  LEU  85          1HD1      LEU  85   4.488   5.420  -6.133
  642   2HD1  LEU  85          2HD1      LEU  85   5.104   4.074  -5.143
  643   3HD1  LEU  85          3HD1      LEU  85   4.158   3.738  -6.613
  644   1HD2  LEU  85          1HD2      LEU  85   4.321   4.581  -3.255
  645   2HD2  LEU  85          2HD2      LEU  85   2.648   5.087  -2.918
  646   3HD2  LEU  85          3HD2      LEU  85   3.041   3.358  -3.075
  647    H    ASP  86           H        ASP  86   3.090   5.677  -8.965
  648    HA   ASP  86           HA       ASP  86   2.288   2.949  -9.445
  649   1HB   ASP  86          1HB       ASP  86   2.570   5.108 -11.115
  650   2HB   ASP  86          2HB       ASP  86   4.145   4.367 -11.318
  651    H    TYR  87           H        TYR  87   3.695   1.265  -8.919
  652    HA   TYR  87           HA       TYR  87   6.358   1.936  -8.026
  653   1HB   TYR  87          1HB       TYR  87   4.832   0.314  -6.847
  654   2HB   TYR  87          2HB       TYR  87   4.671  -0.627  -8.316
  655    HD1  TYR  87           1HD      TYR  87   6.936   0.260  -5.541
  656    HD2  TYR  87           2HD      TYR  87   6.400  -2.178  -9.015
  657    HE1  TYR  87           1HE      TYR  87   8.914  -1.178  -4.846
  658    HE2  TYR  87           2HE      TYR  87   8.379  -3.608  -8.309
  659    HH   TYR  87           HH       TYR  87   9.953  -3.912  -6.869
  660    H    VAL  88           H        VAL  88   8.215   1.713  -9.183
  661    HA   VAL  88           HA       VAL  88   8.028   0.962 -11.919
  662    HB   VAL  88           HB       VAL  88  10.224   1.797 -10.045
  663   1HG1  VAL  88          1HG1      VAL  88  10.573   0.966 -12.946
  664   2HG1  VAL  88          2HG1      VAL  88  11.808   1.746 -11.929
  665   3HG1  VAL  88          3HG1      VAL  88  11.220   0.116 -11.523
  666   1HG2  VAL  88          1HG2      VAL  88  10.241   3.466 -12.229
  667   2HG2  VAL  88          2HG2      VAL  88   8.514   3.060 -12.082
  668   3HG2  VAL  88          3HG2      VAL  88   9.381   3.777 -10.702
  669    H    VAL  89           H        VAL  89   9.246  -0.792 -12.959
  670    HA   VAL  89           HA       VAL  89   9.754  -3.026 -11.125
  671    HB   VAL  89           HB       VAL  89   8.408  -3.221 -13.823
  672   1HG1  VAL  89          1HG1      VAL  89   9.038  -5.364 -13.630
  673   2HG1  VAL  89          2HG1      VAL  89   9.512  -5.161 -11.926
  674   3HG1  VAL  89          3HG1      VAL  89   7.813  -5.487 -12.344
  675   1HG2  VAL  89          1HG2      VAL  89   6.311  -3.550 -12.696
  676   2HG2  VAL  89          2HG2      VAL  89   7.097  -3.484 -11.100
  677   3HG2  VAL  89          3HG2      VAL  89   7.014  -2.022 -12.112
  678    H    ASP  90           H        ASP  90  11.818  -3.724 -11.287
  679    HA   ASP  90           HA       ASP  90  13.010  -4.000 -13.829
  680   1HB   ASP  90          1HB       ASP  90  14.123  -1.912 -11.897
  681   2HB   ASP  90          2HB       ASP  90  14.998  -2.519 -13.288
  682    H    PHE  91           H        PHE  91  15.479  -4.727 -13.409
  683    HA   PHE  91           HA       PHE  91  16.590  -6.483 -12.562
  684   1HB   PHE  91          1HB       PHE  91  17.019  -4.137 -11.268
  685   2HB   PHE  91          2HB       PHE  91  16.329  -5.003  -9.910
  686    HD1  PHE  91           1HD      PHE  91  18.004  -5.591  -8.444
  687    HD2  PHE  91           2HD      PHE  91  18.709  -6.026 -12.606
  688    HE1  PHE  91           1HE      PHE  91  20.244  -6.613  -7.958
  689    HE2  PHE  91           2HE      PHE  91  20.950  -7.048 -12.119
  690    HZ   PHE  91           HZ       PHE  91  21.690  -7.328  -9.801
  691    H    MET  92           H        MET  92  16.513  -6.862  -9.436
  692    HA   MET  92           HA       MET  92  14.486  -8.896  -9.595
  693   1HB   MET  92          1HB       MET  92  16.978  -8.386  -8.114
  694   2HB   MET  92          2HB       MET  92  15.703  -8.857  -7.008
  695   1HG   MET  92          1HG       MET  92  15.403 -10.643  -9.170
  696   2HG   MET  92          2HG       MET  92  17.140 -10.489  -8.996
  697   1HE   MET  92          1HE       MET  92  18.444 -11.563  -7.633
  698   2HE   MET  92          2HE       MET  92  18.208 -10.721  -6.083
  699   3HE   MET  92          3HE       MET  92  18.080 -12.494  -6.161
  700    H    GLY  93           H        GLY  93  13.776  -5.958  -9.425
  701   1HA   GLY  93          1HA       GLY  93  11.512  -5.869  -8.099
  702   2HA   GLY  93          2HA       GLY  93  12.618  -5.745  -6.746
  703    H    GLY  94           H        GLY  94  11.110  -4.079  -9.412
  704   1HA   GLY  94          1HA       GLY  94  12.805  -1.935  -9.857
  705   2HA   GLY  94          2HA       GLY  94  11.059  -1.912 -10.003
  706    H    GLY  95           H        GLY  95  11.387   0.398  -9.239
  707   1HA   GLY  95          1HA       GLY  95  11.701   0.510  -6.300
  708   2HA   GLY  95          2HA       GLY  95  12.090   1.810  -7.409
  709    H    PHE  96           H        PHE  96  10.636   3.244  -6.242
  710    HA   PHE  96           HA       PHE  96   7.825   2.686  -6.880
  711   1HB   PHE  96          1HB       PHE  96   8.814   4.391  -4.547
  712   2HB   PHE  96          2HB       PHE  96   7.264   3.589  -4.704
  713    HD1  PHE  96           1HD      PHE  96  10.875   2.961  -4.154
  714    HD2  PHE  96           2HD      PHE  96   6.931   1.430  -3.827
  715    HE1  PHE  96           1HE      PHE  96  11.736   1.032  -2.798
  716    HE2  PHE  96           2HE      PHE  96   7.792  -0.498  -2.471
  717    HZ   PHE  96           HZ       PHE  96  10.184  -0.675  -1.973
  718    H    THR  97           H        THR  97   6.651   4.361  -7.810
  719    HA   THR  97           HA       THR  97   7.938   6.988  -7.930
  720    HB   THR  97           HB       THR  97   7.227   5.136 -10.233
  721    HG1  THR  97           1HG      THR  97   9.440   5.464  -9.358
  722   1HG2  THR  97          1HG2      THR  97   6.612   7.984 -10.101
  723   2HG2  THR  97          2HG2      THR  97   7.971   7.717 -11.219
  724   3HG2  THR  97          3HG2      THR  97   6.425   6.875 -11.480
  725    H    ILE  98           H        ILE  98   6.559   8.695  -7.775
  726    HA   ILE  98           HA       ILE  98   3.706   7.994  -7.797
  727    HB   ILE  98           HB       ILE  98   4.406   8.279  -5.530
  728   1HG1  ILE  98          1HG1      ILE  98   3.179  10.889  -5.613
  729   2HG1  ILE  98          2HG1      ILE  98   2.422   9.849  -6.803
  730   1HG2  ILE  98          1HG2      ILE  98   5.901  10.607  -6.624
  731   2HG2  ILE  98          2HG2      ILE  98   5.218  10.768  -4.988
  732   3HG2  ILE  98          3HG2      ILE  98   6.347   9.441  -5.355
  733   1HD1  ILE  98          1HD1      ILE  98   1.608   8.366  -5.213
  734   2HD1  ILE  98          2HD1      ILE  98   2.962   8.658  -4.095
  735   3HD1  ILE  98          3HD1      ILE  98   1.646   9.849  -4.230
  736    H    ARG  99           H        ARG  99   2.304   9.419  -8.845
  737    HA   ARG  99           HA       ARG  99   3.667  11.631 -10.159
  738   1HB   ARG  99          1HB       ARG  99   2.235   9.379 -11.312
  739   2HB   ARG  99          2HB       ARG  99   1.365  10.850 -11.698
  740   1HG   ARG  99          1HG       ARG  99   3.250  11.822 -12.807
  741   2HG   ARG  99          2HG       ARG  99   4.377  10.700 -12.070
  742   1HD   ARG  99          1HD       ARG  99   4.128   9.887 -14.296
  743   2HD   ARG  99          2HD       ARG  99   3.113   8.823 -13.343
  744    HE   ARG  99           HE       ARG  99   1.231   9.678 -14.438
  745   1HH1  ARG  99          2HH2      ARG  99   3.924  11.898 -14.885
  746   2HH1  ARG  99          1HH2      ARG  99   3.072  12.907 -16.006
  747   1HH2  ARG  99          2HH1      ARG  99   0.107  11.009 -15.916
  748   2HH2  ARG  99          1HH1      ARG  99   0.886  12.398 -16.596
  749    H    ASN 100           H        ASN 100   2.927  13.436  -9.046
  750    HA   ASN 100           HA       ASN 100   0.216  13.425  -8.101
  751   1HB   ASN 100          1HB       ASN 100   2.714  14.915  -7.538
  752   2HB   ASN 100          2HB       ASN 100   1.319  15.973  -7.607
  753   1HD2  ASN 100          1HD2      ASN 100   3.090  13.778  -5.775
  754   2HD2  ASN 100          2HD2      ASN 100   2.011  13.556  -4.438
  755    HA   PRO 101           HA       PRO 101  -1.154  15.921 -11.440
  756   1HB   PRO 101          1HB       PRO 101  -3.398  17.060 -10.373
  757   2HB   PRO 101          2HB       PRO 101  -3.363  15.429 -11.013
  758   1HG   PRO 101          1HG       PRO 101  -3.407  16.313  -8.192
  759   2HG   PRO 101          2HG       PRO 101  -3.795  14.738  -8.855
  760   1HD   PRO 101          1HD       PRO 101  -1.381  15.479  -7.495
  761   2HD   PRO 101          2HD       PRO 101  -1.723  13.940  -8.259
  Start of MODEL    5
    1    H    MET   1           H        MET   1 -18.192  -0.598  20.533
    2    HA   MET   1           HA       MET   1 -16.017   0.564  21.001
    3   1HB   MET   1          1HB       MET   1 -15.217  -2.162  20.925
    4   2HB   MET   1          2HB       MET   1 -14.602  -1.499  19.424
    5   1HG   MET   1          1HG       MET   1 -13.472   0.338  20.685
    6   2HG   MET   1          2HG       MET   1 -14.108  -0.294  22.191
    7   1HE   MET   1          1HE       MET   1 -10.850  -0.156  20.364
    8   2HE   MET   1          2HE       MET   1 -10.622  -1.799  19.718
    9   3HE   MET   1          3HE       MET   1 -11.975  -0.795  19.141
   10    H    GLN   2           H        GLN   2 -14.900   1.631  19.140
   11    HA   GLN   2           HA       GLN   2 -16.133   0.967  16.596
   12   1HB   GLN   2          1HB       GLN   2 -16.639   3.317  16.134
   13   2HB   GLN   2          2HB       GLN   2 -17.444   2.825  17.611
   14   1HG   GLN   2          1HG       GLN   2 -15.669   3.871  18.978
   15   2HG   GLN   2          2HG       GLN   2 -14.751   4.267  17.538
   16   1HE2  GLN   2          1HE2      GLN   2 -17.958   4.684  19.011
   17   2HE2  GLN   2          2HE2      GLN   2 -18.252   6.298  18.454
   18    H    GLU   3           H        GLU   3 -14.708   1.059  14.866
   19    HA   GLU   3           HA       GLU   3 -11.997   1.716  15.576
   20   1HB   GLU   3          1HB       GLU   3 -13.348   0.009  13.572
   21   2HB   GLU   3          2HB       GLU   3 -11.971   0.875  12.921
   22   1HG   GLU   3          1HG       GLU   3 -10.532  -0.522  13.977
   23   2HG   GLU   3          2HG       GLU   3 -11.244  -0.138  15.532
   24    H    GLN   4           H        GLN   4 -10.631   3.057  14.086
   25    HA   GLN   4           HA       GLN   4 -11.966   5.459  13.527
   26   1HB   GLN   4          1HB       GLN   4  -9.413   4.857  14.129
   27   2HB   GLN   4          2HB       GLN   4  -9.240   4.894  12.385
   28   1HG   GLN   4          1HG       GLN   4 -10.623   7.189  12.646
   29   2HG   GLN   4          2HG       GLN   4  -9.968   7.134  14.271
   30   1HE2  GLN   4          1HE2      GLN   4  -9.490   8.461  11.409
   31   2HE2  GLN   4          2HE2      GLN   4  -7.765   8.601  11.335
   32    H    ALA   5           H        ALA   5 -13.654   4.734  12.014
   33    HA   ALA   5           HA       ALA   5 -12.956   3.570   9.534
   34   1HB   ALA   5          1HB       ALA   5 -15.234   3.577   9.157
   35   2HB   ALA   5          2HB       ALA   5 -15.228   3.743  10.929
   36   3HB   ALA   5          3HB       ALA   5 -15.463   5.178   9.901
   37    H    GLN   6           H        GLN   6 -12.132   4.500   7.724
   38    HA   GLN   6           HA       GLN   6 -12.845   7.060   6.916
   39   1HB   GLN   6          1HB       GLN   6 -11.027   7.284   8.934
   40   2HB   GLN   6          2HB       GLN   6  -9.927   7.125   7.579
   41   1HG   GLN   6          1HG       GLN   6 -10.329   9.261   6.933
   42   2HG   GLN   6          2HG       GLN   6 -12.050   8.949   6.826
   43   1HE2  GLN   6          1HE2      GLN   6  -9.492  10.339   8.618
   44   2HE2  GLN   6          2HE2      GLN   6 -10.399  10.994   9.940
   45    H    GLN   7           H        GLN   7 -12.791   6.843   4.724
   46    HA   GLN   7           HA       GLN   7 -10.686   5.121   3.667
   47   1HB   GLN   7          1HB       GLN   7 -13.127   4.337   3.461
   48   2HB   GLN   7          2HB       GLN   7 -13.375   5.668   2.349
   49   1HG   GLN   7          1HG       GLN   7 -11.955   4.752   0.707
   50   2HG   GLN   7          2HG       GLN   7 -11.035   3.817   1.870
   51   1HE2  GLN   7          1HE2      GLN   7 -14.149   4.121   0.246
   52   2HE2  GLN   7          2HE2      GLN   7 -14.622   2.456   0.329
   53    H    PHE   8           H        PHE   8  -9.091   6.585   3.076
   54    HA   PHE   8           HA       PHE   8  -9.829   9.086   1.881
   55   1HB   PHE   8          1HB       PHE   8  -7.117   7.656   2.128
   56   2HB   PHE   8          2HB       PHE   8  -7.349   9.378   1.903
   57    HD1  PHE   8           1HD      PHE   8  -7.870  10.811   3.754
   58    HD2  PHE   8           2HD      PHE   8  -7.638   6.610   4.306
   59    HE1  PHE   8           1HE      PHE   8  -7.848  11.139   6.242
   60    HE2  PHE   8           2HE      PHE   8  -7.615   6.938   6.795
   61    HZ   PHE   8           HZ       PHE   8  -7.720   9.199   7.733
   62    H    ILE   9           H        ILE   9  -8.857   9.807  -0.234
   63    HA   ILE   9           HA       ILE   9  -9.294   7.720  -2.187
   64    HB   ILE   9           HB       ILE   9  -8.754  10.667  -2.561
   65   1HG1  ILE   9          1HG1      ILE   9 -10.823   9.923  -1.161
   66   2HG1  ILE   9          2HG1      ILE   9 -11.007  11.122  -2.426
   67   1HG2  ILE   9          1HG2      ILE   9  -8.290   9.547  -4.593
   68   2HG2  ILE   9          2HG2      ILE   9  -9.711   8.488  -4.425
   69   3HG2  ILE   9          3HG2      ILE   9  -9.928  10.223  -4.759
   70   1HD1  ILE   9          1HD1      ILE   9 -12.642   9.010  -2.272
   71   2HD1  ILE   9          2HD1      ILE   9 -12.143   9.669  -3.848
   72   3HD1  ILE   9          3HD1      ILE   9 -11.334   8.226  -3.190
   73    H    PHE  10           H        PHE  10  -7.672   6.470  -2.927
   74    HA   PHE  10           HA       PHE  10  -5.165   7.677  -3.591
   75   1HB   PHE  10          1HB       PHE  10  -5.287   6.998  -1.011
   76   2HB   PHE  10          2HB       PHE  10  -5.209   5.350  -1.601
   77    HD1  PHE  10           1HD      PHE  10  -3.417   8.336  -2.910
   78    HD2  PHE  10           2HD      PHE  10  -3.114   4.622  -0.879
   79    HE1  PHE  10           1HE      PHE  10  -0.914   8.488  -3.005
   80    HE2  PHE  10           2HE      PHE  10  -0.610   4.774  -0.975
   81    HZ   PHE  10           HZ       PHE  10   0.460   6.705  -2.037
   82    H    LYS  11           H        LYS  11  -4.856   6.835  -5.596
   83    HA   LYS  11           HA       LYS  11  -5.669   4.048  -6.004
   84   1HB   LYS  11          1HB       LYS  11  -5.677   6.487  -7.715
   85   2HB   LYS  11          2HB       LYS  11  -5.302   4.969  -8.504
   86   1HG   LYS  11          1HG       LYS  11  -7.445   4.199  -8.308
   87   2HG   LYS  11          2HG       LYS  11  -7.576   4.718  -6.640
   88   1HD   LYS  11          1HD       LYS  11  -7.568   6.853  -8.769
   89   2HD   LYS  11          2HD       LYS  11  -9.012   5.873  -8.609
   90   1HE   LYS  11          1HE       LYS  11  -9.165   6.457  -6.193
   91   2HE   LYS  11          2HE       LYS  11  -7.689   7.393  -6.311
   92   1HZ   LYS  11          1HZ       LYS  11  -8.816   9.075  -7.151
   93   2HZ   LYS  11          2HZ       LYS  11  -9.554   8.161  -8.284
   94   3HZ   LYS  11          3HZ       LYS  11 -10.201   8.290  -6.790
   95    H    VAL  12           H        VAL  12  -4.166   2.500  -6.476
   96    HA   VAL  12           HA       VAL  12  -1.448   3.467  -7.025
   97    HB   VAL  12           HB       VAL  12  -2.178   2.454  -4.647
   98   1HG1  VAL  12          1HG1      VAL  12  -1.326   0.043  -6.286
   99   2HG1  VAL  12          2HG1      VAL  12  -1.486   0.087  -4.514
  100   3HG1  VAL  12          3HG1      VAL  12  -2.921   0.308  -5.543
  101   1HG2  VAL  12          1HG2      VAL  12   0.204   1.861  -4.314
  102   2HG2  VAL  12          2HG2      VAL  12   0.456   1.955  -6.074
  103   3HG2  VAL  12          3HG2      VAL  12   0.000   3.413  -5.161
  104    H    THR  13           H        THR  13  -0.492   2.561  -8.796
  105    HA   THR  13           HA       THR  13  -1.976   1.091 -10.608
  106    HB   THR  13           HB       THR  13   0.188   0.890 -11.774
  107    HG1  THR  13           1HG      THR  13   1.212   1.750  -9.162
  108   1HG2  THR  13          1HG2      THR  13   0.608   3.407 -10.143
  109   2HG2  THR  13          2HG2      THR  13   0.807   3.160 -11.895
  110   3HG2  THR  13          3HG2      THR  13  -0.823   3.303 -11.196
  111    H    ASP  14           H        ASP  14  -1.956  -1.090 -11.309
  112    HA   ASP  14           HA       ASP  14  -2.209  -2.898  -9.295
  113   1HB   ASP  14          1HB       ASP  14  -1.726  -3.109 -12.271
  114   2HB   ASP  14          2HB       ASP  14  -1.687  -4.579 -11.318
  115    H    LYS  15           H        LYS  15   0.648  -1.726 -11.022
  116    HA   LYS  15           HA       LYS  15   2.349  -3.909 -10.557
  117   1HB   LYS  15          1HB       LYS  15   2.464  -1.508 -11.938
  118   2HB   LYS  15          2HB       LYS  15   3.636  -1.276 -10.656
  119   1HG   LYS  15          1HG       LYS  15   4.718  -3.457 -11.258
  120   2HG   LYS  15          2HG       LYS  15   3.551  -3.677 -12.546
  121   1HD   LYS  15          1HD       LYS  15   4.397  -1.253 -13.302
  122   2HD   LYS  15          2HD       LYS  15   5.809  -1.677 -12.355
  123   1HE   LYS  15          1HE       LYS  15   6.538  -2.711 -14.260
  124   2HE   LYS  15          2HE       LYS  15   5.444  -4.002 -13.803
  125   1HZ   LYS  15          1HZ       LYS  15   4.530  -3.569 -15.763
  126   2HZ   LYS  15          2HZ       LYS  15   3.816  -2.290 -15.042
  127   3HZ   LYS  15          3HZ       LYS  15   5.191  -2.082 -15.898
  128    H    ALA  16           H        ALA  16   1.479  -0.990  -8.649
  129    HA   ALA  16           HA       ALA  16   3.431  -1.361  -6.666
  130   1HB   ALA  16          1HB       ALA  16   0.704  -0.009  -6.568
  131   2HB   ALA  16          2HB       ALA  16   2.012   0.208  -5.380
  132   3HB   ALA  16          3HB       ALA  16   2.234   0.755  -7.060
  133    H    VAL  17           H        VAL  17  -0.121  -2.156  -6.692
  134    HA   VAL  17           HA       VAL  17  -0.130  -3.488  -4.270
  135    HB   VAL  17           HB       VAL  17  -1.834  -3.262  -6.659
  136   1HG1  VAL  17          1HG1      VAL  17  -3.361  -5.116  -5.642
  137   2HG1  VAL  17          2HG1      VAL  17  -2.017  -5.582  -6.713
  138   3HG1  VAL  17          3HG1      VAL  17  -1.846  -5.742  -4.948
  139   1HG2  VAL  17          1HG2      VAL  17  -2.877  -1.972  -5.166
  140   2HG2  VAL  17          2HG2      VAL  17  -3.358  -3.450  -4.300
  141   3HG2  VAL  17          3HG2      VAL  17  -1.865  -2.597  -3.841
  142    H    GLU  18           H        GLU  18   0.315  -4.787  -7.629
  143    HA   GLU  18           HA       GLU  18   0.523  -7.411  -6.967
  144   1HB   GLU  18          1HB       GLU  18   1.686  -5.710  -9.170
  145   2HB   GLU  18          2HB       GLU  18   2.207  -7.378  -9.041
  146   1HG   GLU  18          1HG       GLU  18  -0.401  -7.882  -8.856
  147   2HG   GLU  18          2HG       GLU  18  -0.568  -6.300  -9.592
  148    H    GLU  19           H        GLU  19   3.008  -4.819  -6.795
  149    HA   GLU  19           HA       GLU  19   5.182  -6.450  -6.356
  150   1HB   GLU  19          1HB       GLU  19   5.333  -4.034  -6.875
  151   2HB   GLU  19          2HB       GLU  19   4.630  -3.634  -5.321
  152   1HG   GLU  19          1HG       GLU  19   6.907  -3.413  -4.837
  153   2HG   GLU  19          2HG       GLU  19   6.627  -5.068  -4.335
  154    H    ILE  20           H        ILE  20   2.472  -5.600  -4.289
  155    HA   ILE  20           HA       ILE  20   3.869  -6.314  -1.867
  156    HB   ILE  20           HB       ILE  20   0.913  -5.930  -2.047
  157   1HG1  ILE  20          1HG1      ILE  20   1.589  -4.148  -3.451
  158   2HG1  ILE  20          2HG1      ILE  20   1.305  -3.449  -1.870
  159   1HG2  ILE  20          1HG2      ILE  20   2.403  -6.455   0.057
  160   2HG2  ILE  20          2HG2      ILE  20   2.730  -4.707  -0.006
  161   3HG2  ILE  20          3HG2      ILE  20   1.057  -5.294   0.152
  162   1HD1  ILE  20          1HD1      ILE  20   3.544  -2.987  -1.507
  163   2HD1  ILE  20          2HD1      ILE  20   4.094  -4.409  -2.426
  164   3HD1  ILE  20          3HD1      ILE  20   3.550  -2.948  -3.286
  165    H    LYS  21           H        LYS  21   1.431  -7.685  -4.130
  166    HA   LYS  21           HA       LYS  21   0.921  -9.970  -2.560
  167   1HB   LYS  21          1HB       LYS  21   0.469  -9.295  -5.474
  168   2HB   LYS  21          2HB       LYS  21   0.008 -10.838  -4.784
  169   1HG   LYS  21          1HG       LYS  21  -1.780  -9.946  -3.667
  170   2HG   LYS  21          2HG       LYS  21  -0.869  -8.549  -3.129
  171   1HD   LYS  21          1HD       LYS  21  -2.551  -7.682  -4.600
  172   2HD   LYS  21          2HD       LYS  21  -1.059  -7.630  -5.519
  173   1HE   LYS  21          1HE       LYS  21  -2.698  -8.565  -7.005
  174   2HE   LYS  21          2HE       LYS  21  -1.699  -9.914  -6.501
  175   1HZ   LYS  21          1HZ       LYS  21  -4.255  -9.193  -5.242
  176   2HZ   LYS  21          2HZ       LYS  21  -4.069 -10.372  -6.357
  177   3HZ   LYS  21          3HZ       LYS  21  -3.347 -10.507  -4.899
  178    H    LYS  22           H        LYS  22   3.243  -9.202  -5.204
  179    HA   LYS  22           HA       LYS  22   4.220 -11.830  -5.433
  180   1HB   LYS  22          1HB       LYS  22   4.533  -9.408  -6.774
  181   2HB   LYS  22          2HB       LYS  22   6.125  -9.721  -6.113
  182   1HG   LYS  22          1HG       LYS  22   5.444 -12.236  -7.031
  183   2HG   LYS  22          2HG       LYS  22   4.607 -11.225  -8.193
  184   1HD   LYS  22          1HD       LYS  22   7.268 -10.144  -7.728
  185   2HD   LYS  22          2HD       LYS  22   7.398 -11.850  -8.109
  186   1HE   LYS  22          1HE       LYS  22   6.749 -11.541 -10.285
  187   2HE   LYS  22          2HE       LYS  22   5.458 -10.441  -9.845
  188   1HZ   LYS  22          1HZ       LYS  22   7.141  -9.298 -11.061
  189   2HZ   LYS  22          2HZ       LYS  22   7.139  -8.726  -9.532
  190   3HZ   LYS  22          3HZ       LYS  22   8.310  -9.756 -10.017
  191    H    VAL  23           H        VAL  23   5.304  -8.935  -3.553
  192    HA   VAL  23           HA       VAL  23   7.591 -10.077  -2.487
  193    HB   VAL  23           HB       VAL  23   5.725  -7.868  -1.748
  194   1HG1  VAL  23          1HG1      VAL  23   7.658  -7.481   0.107
  195   2HG1  VAL  23          2HG1      VAL  23   6.102  -8.273   0.452
  196   3HG1  VAL  23          3HG1      VAL  23   7.551  -9.257   0.137
  197   1HG2  VAL  23          1HG2      VAL  23   7.809  -7.934  -3.417
  198   2HG2  VAL  23          2HG2      VAL  23   7.408  -6.490  -2.456
  199   3HG2  VAL  23          3HG2      VAL  23   8.695  -7.592  -1.912
  200    H    ALA  24           H        ALA  24   4.293  -9.804  -0.970
  201    HA   ALA  24           HA       ALA  24   4.896 -11.377   1.234
  202   1HB   ALA  24          1HB       ALA  24   2.132 -11.627   0.319
  203   2HB   ALA  24          2HB       ALA  24   2.780 -10.813   1.763
  204   3HB   ALA  24          3HB       ALA  24   2.712  -9.948   0.209
  205    H    GLN  25           H        GLN  25   3.923 -12.208  -2.106
  206    HA   GLN  25           HA       GLN  25   3.214 -14.826  -1.631
  207   1HB   GLN  25          1HB       GLN  25   4.053 -13.197  -3.983
  208   2HB   GLN  25          2HB       GLN  25   4.256 -14.927  -4.170
  209   1HG   GLN  25          1HG       GLN  25   1.684 -14.436  -2.927
  210   2HG   GLN  25          2HG       GLN  25   1.825 -13.404  -4.337
  211   1HE2  GLN  25          1HE2      GLN  25   0.061 -15.601  -4.000
  212   2HE2  GLN  25          2HE2      GLN  25   0.420 -16.798  -5.199
  213    H    GLU  26           H        GLU  26   6.373 -13.242  -1.797
  214    HA   GLU  26           HA       GLU  26   7.733 -15.751  -2.081
  215   1HB   GLU  26          1HB       GLU  26   8.367 -13.197  -2.835
  216   2HB   GLU  26          2HB       GLU  26   9.258 -13.296  -1.329
  217   1HG   GLU  26          1HG       GLU  26  10.112 -15.612  -2.242
  218   2HG   GLU  26          2HG       GLU  26   9.545 -15.041  -3.799
  219    H    ASN  27           H        ASN  27   6.145 -14.204   0.417
  220    HA   ASN  27           HA       ASN  27   8.028 -15.298   2.357
  221   1HB   ASN  27          1HB       ASN  27   6.411 -12.762   2.316
  222   2HB   ASN  27          2HB       ASN  27   6.507 -13.581   3.862
  223   1HD2  ASN  27          1HD2      ASN  27   7.987 -11.462   1.746
  224   2HD2  ASN  27          2HD2      ASN  27   9.570 -11.375   2.443
  225    H    ASN  28           H        ASN  28   5.517 -16.310   0.746
  226    HA   ASN  28           HA       ASN  28   3.721 -17.490   1.057
  227   1HB   ASN  28          1HB       ASN  28   5.597 -18.607   2.675
  228   2HB   ASN  28          2HB       ASN  28   4.436 -18.168   3.913
  229   1HD2  ASN  28          1HD2      ASN  28   5.023 -20.043   1.024
  230   2HD2  ASN  28          2HD2      ASN  28   3.700 -21.152   1.173
  231    H    ILE  29           H        ILE  29   3.664 -14.629   1.912
  232    HA   ILE  29           HA       ILE  29   1.940 -14.655   4.252
  233    HB   ILE  29           HB       ILE  29   3.333 -12.516   2.666
  234   1HG1  ILE  29          1HG1      ILE  29   3.436 -13.213   5.614
  235   2HG1  ILE  29          2HG1      ILE  29   4.559 -13.829   4.418
  236   1HG2  ILE  29          1HG2      ILE  29   1.264 -12.085   4.840
  237   2HG2  ILE  29          2HG2      ILE  29   2.293 -10.832   4.106
  238   3HG2  ILE  29          3HG2      ILE  29   1.082 -11.681   3.116
  239   1HD1  ILE  29          1HD1      ILE  29   4.083 -10.877   5.040
  240   2HD1  ILE  29          2HD1      ILE  29   5.492 -11.837   5.550
  241   3HD1  ILE  29          3HD1      ILE  29   5.222 -11.501   3.823
  242    H    GLU  30           H        GLU  30  -0.252 -14.116   4.225
  243    HA   GLU  30           HA       GLU  30  -1.359 -13.867   1.536
  244   1HB   GLU  30          1HB       GLU  30  -1.827 -15.896   3.497
  245   2HB   GLU  30          2HB       GLU  30  -3.291 -14.936   3.416
  246   1HG   GLU  30          1HG       GLU  30  -3.631 -15.396   1.116
  247   2HG   GLU  30          2HG       GLU  30  -1.949 -15.804   0.843
  248    H    ASN  31           H        ASN  31  -0.580 -12.056   4.083
  249    HA   ASN  31           HA       ASN  31  -2.846 -10.341   3.668
  250   1HB   ASN  31          1HB       ASN  31  -2.720  -9.966   6.334
  251   2HB   ASN  31          2HB       ASN  31  -3.765 -11.191   5.641
  252   1HD2  ASN  31          1HD2      ASN  31  -0.972 -10.514   7.519
  253   2HD2  ASN  31          2HD2      ASN  31  -0.543 -12.132   7.965
  254    HA   PRO  32           HA       PRO  32   1.315  -8.422   4.128
  255   1HB   PRO  32          1HB       PRO  32   1.546  -7.335   1.631
  256   2HB   PRO  32          2HB       PRO  32   2.227  -8.890   2.067
  257   1HG   PRO  32          1HG       PRO  32  -0.178  -8.308   0.449
  258   2HG   PRO  32          2HG       PRO  32   0.750  -9.792   0.542
  259   1HD   PRO  32          1HD       PRO  32  -1.783  -9.270   1.784
  260   2HD   PRO  32          2HD       PRO  32  -0.801 -10.709   1.970
  261    H    ILE  33           H        ILE  33   1.578  -6.519   5.132
  262    HA   ILE  33           HA       ILE  33  -0.616  -4.643   4.648
  263    HB   ILE  33           HB       ILE  33   1.140  -5.264   6.986
  264   1HG1  ILE  33          1HG1      ILE  33  -1.840  -4.862   6.603
  265   2HG1  ILE  33          2HG1      ILE  33  -1.006  -6.385   6.839
  266   1HG2  ILE  33          1HG2      ILE  33   0.384  -3.192   8.096
  267   2HG2  ILE  33          2HG2      ILE  33   1.453  -2.880   6.707
  268   3HG2  ILE  33          3HG2      ILE  33  -0.304  -2.635   6.552
  269   1HD1  ILE  33          1HD1      ILE  33  -0.107  -4.939   9.020
  270   2HD1  ILE  33          2HD1      ILE  33  -1.766  -4.322   8.828
  271   3HD1  ILE  33          3HD1      ILE  33  -1.484  -6.066   9.049
  272    H    LEU  34           H        LEU  34  -0.096  -3.276   3.005
  273    HA   LEU  34           HA       LEU  34   2.666  -2.390   2.796
  274   1HB   LEU  34          1HB       LEU  34   1.725  -3.162   0.770
  275   2HB   LEU  34          2HB       LEU  34   0.260  -2.227   0.994
  276    HG   LEU  34           HG       LEU  34   1.663  -0.135   0.763
  277   1HD1  LEU  34          1HD1      LEU  34   3.868  -0.476   1.022
  278   2HD1  LEU  34          2HD1      LEU  34   3.776  -2.177   0.507
  279   3HD1  LEU  34          3HD1      LEU  34   3.822  -0.880  -0.711
  280   1HD2  LEU  34          1HD2      LEU  34   1.107  -0.061  -1.406
  281   2HD2  LEU  34          2HD2      LEU  34   2.056  -1.512  -1.807
  282   3HD2  LEU  34          3HD2      LEU  34   0.423  -1.679  -1.118
  283    H    ARG  35           H        ARG  35   3.353  -0.511   3.664
  284    HA   ARG  35           HA       ARG  35   1.258   1.392   4.347
  285   1HB   ARG  35          1HB       ARG  35   2.499   2.019   6.292
  286   2HB   ARG  35          2HB       ARG  35   2.636   0.273   6.242
  287   1HG   ARG  35          1HG       ARG  35   4.831   0.736   4.837
  288   2HG   ARG  35          2HG       ARG  35   4.723   2.349   5.514
  289   1HD   ARG  35          1HD       ARG  35   4.541   1.228   7.835
  290   2HD   ARG  35          2HD       ARG  35   4.967  -0.278   7.047
  291    HE   ARG  35           HE       ARG  35   7.171   0.516   6.709
  292   1HH1  ARG  35          2HH2      ARG  35   5.103   3.093   7.918
  293   2HH1  ARG  35          1HH2      ARG  35   6.421   4.163   8.262
  294   1HH2  ARG  35          2HH1      ARG  35   8.910   1.927   7.164
  295   2HH2  ARG  35          1HH1      ARG  35   8.601   3.496   7.831
  296    H    ILE  36           H        ILE  36   1.404   3.438   3.427
  297    HA   ILE  36           HA       ILE  36   3.784   3.940   1.809
  298    HB   ILE  36           HB       ILE  36   0.938   4.881   1.725
  299   1HG1  ILE  36          1HG1      ILE  36   1.572   4.281  -0.799
  300   2HG1  ILE  36          2HG1      ILE  36   2.783   3.291  -0.007
  301   1HG2  ILE  36          1HG2      ILE  36   2.346   6.897   1.571
  302   2HG2  ILE  36          2HG2      ILE  36   3.238   6.158   0.220
  303   3HG2  ILE  36          3HG2      ILE  36   1.507   6.534   0.044
  304   1HD1  ILE  36          1HD1      ILE  36   0.236   2.445  -0.466
  305   2HD1  ILE  36          2HD1      ILE  36   1.227   1.846   0.886
  306   3HD1  ILE  36          3HD1      ILE  36   0.034   3.138   1.161
  307    H    ARG  37           H        ARG  37   5.368   5.041   2.833
  308    HA   ARG  37           HA       ARG  37   4.467   7.220   4.541
  309   1HB   ARG  37          1HB       ARG  37   6.002   4.952   5.291
  310   2HB   ARG  37          2HB       ARG  37   7.170   6.253   5.177
  311   1HG   ARG  37          1HG       ARG  37   4.647   7.031   6.542
  312   2HG   ARG  37          2HG       ARG  37   5.530   5.763   7.367
  313   1HD   ARG  37          1HD       ARG  37   7.057   8.184   6.382
  314   2HD   ARG  37          2HD       ARG  37   6.084   8.337   7.831
  315    HE   ARG  37           HE       ARG  37   7.525   6.002   8.265
  316   1HH1  ARG  37          2HH2      ARG  37   8.394   9.317   7.466
  317   2HH1  ARG  37          1HH2      ARG  37   9.928   9.243   8.266
  318   1HH2  ARG  37          2HH1      ARG  37   9.549   5.904   9.321
  319   2HH2  ARG  37          1HH1      ARG  37  10.590   7.288   9.328
  320    H    VAL  38           H        VAL  38   6.074   9.071   4.680
  321    HA   VAL  38           HA       VAL  38   7.194   9.535   2.063
  322    HB   VAL  38           HB       VAL  38   7.070  11.285   4.527
  323   1HG1  VAL  38          1HG1      VAL  38   8.693  12.274   3.185
  324   2HG1  VAL  38          2HG1      VAL  38   7.900  11.771   1.673
  325   3HG1  VAL  38          3HG1      VAL  38   7.205  13.089   2.646
  326   1HG2  VAL  38          1HG2      VAL  38   5.271  12.068   2.414
  327   2HG2  VAL  38          2HG2      VAL  38   4.962  10.376   2.873
  328   3HG2  VAL  38          3HG2      VAL  38   4.911  11.657   4.108
  329    H    VAL  39           H        VAL  39   9.245   9.012   1.530
  330    HA   VAL  39           HA       VAL  39  11.258   9.179   3.645
  331    HB   VAL  39           HB       VAL  39  12.255   7.080   2.809
  332   1HG1  VAL  39          1HG1      VAL  39  11.164   5.959   4.416
  333   2HG1  VAL  39          2HG1      VAL  39  10.155   7.415   4.587
  334   3HG1  VAL  39          3HG1      VAL  39   9.609   6.071   3.556
  335   1HG2  VAL  39          1HG2      VAL  39  11.486   6.777   0.625
  336   2HG2  VAL  39          2HG2      VAL  39  10.583   5.550   1.545
  337   3HG2  VAL  39          3HG2      VAL  39   9.789   7.072   1.074
  338    HA   PRO  40           HA       PRO  40  12.621  11.411   0.026
  339   1HB   PRO  40          1HB       PRO  40  13.776  13.498   1.360
  340   2HB   PRO  40          2HB       PRO  40  12.110  13.513   0.816
  341   1HG   PRO  40          1HG       PRO  40  13.162  13.151   3.555
  342   2HG   PRO  40          2HG       PRO  40  11.542  13.590   3.050
  343   1HD   PRO  40          1HD       PRO  40  12.413  11.019   3.977
  344   2HD   PRO  40          2HD       PRO  40  10.824  11.428   3.363
  345    H    GLY  41           H        GLY  41  13.830   9.144   0.430
  346   1HA   GLY  41          1HA       GLY  41  16.388   9.241   1.535
  347   2HA   GLY  41          2HA       GLY  41  15.827   8.123   0.308
  348    H    GLY  42           H        GLY  42  15.561   9.226  -2.010
  349   1HA   GLY  42          1HA       GLY  42  18.154  10.129  -2.756
  350   2HA   GLY  42          2HA       GLY  42  16.744   9.963  -3.783
  351    H    CYS  43           H        CYS  43  18.914  12.181  -3.185
  352    HA   CYS  43           HA       CYS  43  17.705  14.362  -2.047
  353   1HB   CYS  43          1HB       CYS  43  20.142  13.997  -2.910
  354   2HB   CYS  43          2HB       CYS  43  19.542  14.651  -4.421
  355    HG   CYS  43           HG       CYS  43  20.389  16.031  -1.725
  356    H    SER  44           H        SER  44  17.707  13.195  -5.483
  357    HA   SER  44           HA       SER  44  15.519  15.063  -5.957
  358   1HB   SER  44          1HB       SER  44  17.917  14.694  -7.381
  359   2HB   SER  44          2HB       SER  44  16.722  13.863  -8.358
  360    HG   SER  44           HG       SER  44  15.533  16.137  -7.659
  361    H    GLY  45           H        GLY  45  15.741  12.121  -4.848
  362   1HA   GLY  45          1HA       GLY  45  13.698  11.004  -6.670
  363   2HA   GLY  45          2HA       GLY  45  15.010  10.029  -6.039
  364    H    PHE  46           H        PHE  46  12.862  12.558  -4.543
  365    HA   PHE  46           HA       PHE  46  12.576  10.877  -2.222
  366   1HB   PHE  46          1HB       PHE  46  11.280  12.929  -1.450
  367   2HB   PHE  46          2HB       PHE  46  12.885  13.334  -2.027
  368    HD1  PHE  46           1HD      PHE  46   9.303  13.566  -2.717
  369    HD2  PHE  46           2HD      PHE  46  13.188  14.546  -4.115
  370    HE1  PHE  46           1HE      PHE  46   8.307  15.203  -4.337
  371    HE2  PHE  46           2HE      PHE  46  12.191  16.184  -5.735
  372    HZ   PHE  46           HZ       PHE  46   9.763  16.493  -5.827
  373    H    GLN  47           H        GLN  47  11.103   9.242  -2.231
  374    HA   GLN  47           HA       GLN  47   8.438   9.921  -3.081
  375   1HB   GLN  47          1HB       GLN  47  10.092   7.698  -4.327
  376   2HB   GLN  47          2HB       GLN  47   8.341   7.638  -4.326
  377   1HG   GLN  47          1HG       GLN  47   8.509   8.823  -6.275
  378   2HG   GLN  47          2HG       GLN  47   8.738  10.207  -5.225
  379   1HE2  GLN  47          1HE2      GLN  47   9.725  10.317  -7.706
  380   2HE2  GLN  47          2HE2      GLN  47  11.454  10.221  -7.728
  381    H    TYR  48           H        TYR  48   6.964   7.807  -2.615
  382    HA   TYR  48           HA       TYR  48   7.592   7.116   0.131
  383   1HB   TYR  48          1HB       TYR  48   5.217   6.352  -1.667
  384   2HB   TYR  48          2HB       TYR  48   5.212   6.431   0.084
  385    HD1  TYR  48           1HD      TYR  48   5.029   8.576   1.251
  386    HD2  TYR  48           2HD      TYR  48   5.056   8.389  -3.023
  387    HE1  TYR  48           1HE      TYR  48   4.173  10.966   1.134
  388    HE2  TYR  48           2HE      TYR  48   4.199  10.780  -3.125
  389    HH   TYR  48           HH       TYR  48   4.034  12.685  -1.887
  390    H    ALA  49           H        ALA  49   8.614   5.259   0.669
  391    HA   ALA  49           HA       ALA  49   8.873   3.198  -1.342
  392   1HB   ALA  49          1HB       ALA  49   9.951   3.222   1.497
  393   2HB   ALA  49          2HB       ALA  49  10.567   2.318   0.093
  394   3HB   ALA  49          3HB       ALA  49  10.745   4.088   0.159
  395    H    MET  50           H        MET  50   8.436   0.886  -0.779
  396    HA   MET  50           HA       MET  50   5.942   0.781   0.696
  397   1HB   MET  50          1HB       MET  50   7.296  -1.203  -1.216
  398   2HB   MET  50          2HB       MET  50   5.721  -1.457  -0.493
  399   1HG   MET  50          1HG       MET  50   4.860   0.605  -1.607
  400   2HG   MET  50          2HG       MET  50   6.441   0.901  -2.303
  401   1HE   MET  50          1HE       MET  50   3.197  -1.135  -4.307
  402   2HE   MET  50          2HE       MET  50   3.176  -0.195  -2.795
  403   3HE   MET  50          3HE       MET  50   3.789   0.543  -4.294
  404    H    GLY  51           H        GLY  51   5.611  -1.614   1.717
  405   1HA   GLY  51          1HA       GLY  51   7.855  -2.948   2.767
  406   2HA   GLY  51          2HA       GLY  51   7.311  -1.759   3.935
  407    H    PHE  52           H        PHE  52   7.165  -4.419   4.653
  408    HA   PHE  52           HA       PHE  52   4.270  -4.863   4.581
  409   1HB   PHE  52          1HB       PHE  52   5.159  -7.391   4.729
  410   2HB   PHE  52          2HB       PHE  52   5.065  -6.604   3.166
  411    HD1  PHE  52           1HD      PHE  52   7.216  -8.167   5.563
  412    HD2  PHE  52           2HD      PHE  52   7.177  -5.546   2.226
  413    HE1  PHE  52           1HE      PHE  52   9.665  -8.585   5.206
  414    HE2  PHE  52           2HE      PHE  52   9.626  -5.964   1.869
  415    HZ   PHE  52           HZ       PHE  52  10.841  -7.478   3.364
  416    H    ASP  53           H        ASP  53   3.822  -4.133   6.663
  417    HA   ASP  53           HA       ASP  53   5.196  -5.630   8.748
  418   1HB   ASP  53          1HB       ASP  53   4.473  -2.674   8.655
  419   2HB   ASP  53          2HB       ASP  53   4.739  -3.494  10.181
  420    H    ASP  54           H        ASP  54   3.710  -6.712  10.071
  421    HA   ASP  54           HA       ASP  54   1.006  -6.593   9.477
  422   1HB   ASP  54          1HB       ASP  54   2.719  -8.230  10.973
  423   2HB   ASP  54          2HB       ASP  54   1.673  -7.545  12.201
  424    H    THR  55           H        THR  55   3.028  -5.296  12.199
  425    HA   THR  55           HA       THR  55   1.154  -4.325  13.892
  426    HB   THR  55           HB       THR  55   3.703  -4.247  14.061
  427    HG1  THR  55           1HG      THR  55   2.778  -2.982  15.649
  428   1HG2  THR  55          1HG2      THR  55   3.312  -2.356  11.853
  429   2HG2  THR  55          2HG2      THR  55   4.082  -1.553  13.243
  430   3HG2  THR  55          3HG2      THR  55   4.835  -2.994  12.518
  431    H    VAL  56           H        VAL  56   0.299  -2.116  14.268
  432    HA   VAL  56           HA       VAL  56  -0.129  -0.627  11.801
  433    HB   VAL  56           HB       VAL  56  -2.115  -2.254  13.220
  434   1HG1  VAL  56          1HG1      VAL  56  -3.966  -0.612  12.848
  435   2HG1  VAL  56          2HG1      VAL  56  -2.836  -0.146  14.143
  436   3HG1  VAL  56          3HG1      VAL  56  -2.736   0.640  12.549
  437   1HG2  VAL  56          1HG2      VAL  56  -1.326  -2.164  10.701
  438   2HG2  VAL  56          2HG2      VAL  56  -3.019  -2.525  11.117
  439   3HG2  VAL  56          3HG2      VAL  56  -2.562  -0.889  10.586
  440    H    GLU  57           H        GLU  57  -0.882   1.594  12.217
  441    HA   GLU  57           HA       GLU  57   0.238   2.503  14.697
  442   1HB   GLU  57          1HB       GLU  57  -0.966   4.180  12.458
  443   2HB   GLU  57          2HB       GLU  57   0.137   4.721  13.708
  444   1HG   GLU  57          1HG       GLU  57   1.184   2.419  12.166
  445   2HG   GLU  57          2HG       GLU  57   0.870   3.823  11.165
  446    H    GLU  58           H        GLU  58  -1.022   4.484  15.761
  447    HA   GLU  58           HA       GLU  58  -3.581   3.396  16.443
  448   1HB   GLU  58          1HB       GLU  58  -1.735   4.474  18.008
  449   2HB   GLU  58          2HB       GLU  58  -2.483   5.990  17.547
  450   1HG   GLU  58          1HG       GLU  58  -4.625   5.327  18.448
  451   2HG   GLU  58          2HG       GLU  58  -4.130   3.652  18.596
  452    H    GLY  59           H        GLY  59  -3.064   4.613  13.715
  453   1HA   GLY  59          1HA       GLY  59  -5.493   5.838  13.274
  454   2HA   GLY  59          2HA       GLY  59  -4.374   7.142  13.617
  455    H    ASP  60           H        ASP  60  -4.101   3.971  11.845
  456    HA   ASP  60           HA       ASP  60  -2.696   5.413   9.772
  457   1HB   ASP  60          1HB       ASP  60  -2.677   2.698  10.859
  458   2HB   ASP  60          2HB       ASP  60  -2.902   2.644   9.122
  459    H    HIS  61           H        HIS  61  -3.464   5.386   7.551
  460    HA   HIS  61           HA       HIS  61  -6.284   5.147   7.312
  461   1HB   HIS  61          1HB       HIS  61  -4.243   5.594   5.121
  462   2HB   HIS  61          2HB       HIS  61  -5.956   5.959   5.063
  463    HD1  HIS  61           1HD      HIS  61  -5.945   7.276   8.050
  464    HD2  HIS  61           2HD      HIS  61  -3.489   8.282   4.801
  465    HE1  HIS  61           1HE      HIS  61  -5.160   9.669   8.461
  466    H    VAL  62           H        VAL  62  -7.149   3.110   7.392
  467    HA   VAL  62           HA       VAL  62  -5.742   0.889   6.272
  468    HB   VAL  62           HB       VAL  62  -7.879   1.376   8.088
  469   1HG1  VAL  62          1HG1      VAL  62  -9.502   0.975   6.377
  470   2HG1  VAL  62          2HG1      VAL  62  -8.609  -0.441   5.772
  471   3HG1  VAL  62          3HG1      VAL  62  -9.403  -0.503   7.364
  472   1HG2  VAL  62          1HG2      VAL  62  -6.106  -0.053   8.708
  473   2HG2  VAL  62          2HG2      VAL  62  -7.516  -1.124   8.525
  474   3HG2  VAL  62          3HG2      VAL  62  -6.282  -1.051   7.245
  475    H    PHE  63           H        PHE  63  -5.632   0.470   4.133
  476    HA   PHE  63           HA       PHE  63  -7.937   1.305   2.515
  477   1HB   PHE  63          1HB       PHE  63  -4.942   1.425   2.273
  478   2HB   PHE  63          2HB       PHE  63  -5.753   0.902   0.810
  479    HD1  PHE  63           1HD      PHE  63  -6.729   2.468  -0.629
  480    HD2  PHE  63           2HD      PHE  63  -5.699   3.643   3.317
  481    HE1  PHE  63           1HE      PHE  63  -7.222   4.859  -1.212
  482    HE2  PHE  63           2HE      PHE  63  -6.191   6.034   2.733
  483    HZ   PHE  63           HZ       PHE  63  -6.947   6.613   0.476
  484    H    GLU  64           H        GLU  64  -9.174  -0.419   1.947
  485    HA   GLU  64           HA       GLU  64  -8.066  -3.026   2.024
  486   1HB   GLU  64          1HB       GLU  64 -10.784  -2.088   1.005
  487   2HB   GLU  64          2HB       GLU  64 -10.347  -3.746   1.366
  488   1HG   GLU  64          1HG       GLU  64  -9.848  -3.029   3.756
  489   2HG   GLU  64          2HG       GLU  64 -10.456  -1.434   3.359
  490    H    TYR  65           H        TYR  65  -7.208  -4.224   0.358
  491    HA   TYR  65           HA       TYR  65  -7.573  -3.131  -2.351
  492   1HB   TYR  65          1HB       TYR  65  -5.229  -3.984  -0.657
  493   2HB   TYR  65          2HB       TYR  65  -5.180  -4.587  -2.301
  494    HD1  TYR  65           1HD      TYR  65  -5.582  -2.768  -4.188
  495    HD2  TYR  65           2HD      TYR  65  -4.335  -1.882  -0.192
  496    HE1  TYR  65           1HE      TYR  65  -4.639  -0.540  -4.968
  497    HE2  TYR  65           2HE      TYR  65  -3.396   0.343  -0.987
  498    HH   TYR  65           HH       TYR  65  -2.872   1.553  -2.730
  499    H    ASP  66           H        ASP  66  -6.285  -5.196  -3.756
  500    HA   ASP  66           HA       ASP  66  -8.351  -7.054  -3.852
  501   1HB   ASP  66          1HB       ASP  66  -6.555  -6.309  -5.639
  502   2HB   ASP  66          2HB       ASP  66  -5.561  -7.568  -4.936
  503    H    GLY  67           H        GLY  67  -8.203  -7.623  -1.408
  504   1HA   GLY  67          1HA       GLY  67  -7.833  -9.254   0.108
  505   2HA   GLY  67          2HA       GLY  67  -6.912 -10.144  -1.088
  506    H    VAL  68           H        VAL  68  -6.256  -6.761  -0.048
  507    HA   VAL  68           HA       VAL  68  -4.021  -7.672   1.564
  508    HB   VAL  68           HB       VAL  68  -3.685  -5.831  -0.813
  509   1HG1  VAL  68          1HG1      VAL  68  -1.313  -5.846  -0.266
  510   2HG1  VAL  68          2HG1      VAL  68  -2.254  -5.267   1.130
  511   3HG1  VAL  68          3HG1      VAL  68  -1.611  -6.927   1.117
  512   1HG2  VAL  68          1HG2      VAL  68  -2.888  -8.723  -0.380
  513   2HG2  VAL  68          2HG2      VAL  68  -3.913  -8.044  -1.667
  514   3HG2  VAL  68          3HG2      VAL  68  -2.169  -7.689  -1.638
  515    H    LYS  69           H        LYS  69  -3.372  -6.122   3.130
  516    HA   LYS  69           HA       LYS  69  -5.285  -3.914   3.370
  517   1HB   LYS  69          1HB       LYS  69  -4.666  -5.926   5.155
  518   2HB   LYS  69          2HB       LYS  69  -3.668  -4.604   5.727
  519   1HG   LYS  69          1HG       LYS  69  -5.909  -3.180   5.353
  520   2HG   LYS  69          2HG       LYS  69  -6.677  -4.749   5.495
  521   1HD   LYS  69          1HD       LYS  69  -4.660  -4.446   7.583
  522   2HD   LYS  69          2HD       LYS  69  -5.751  -3.075   7.610
  523   1HE   LYS  69          1HE       LYS  69  -7.507  -5.215   7.256
  524   2HE   LYS  69          2HE       LYS  69  -6.277  -5.912   8.292
  525   1HZ   LYS  69          1HZ       LYS  69  -8.270  -4.112   8.982
  526   2HZ   LYS  69          2HZ       LYS  69  -7.156  -4.802   9.956
  527   3HZ   LYS  69          3HZ       LYS  69  -6.837  -3.372   9.235
  528    H    VAL  70           H        VAL  70  -4.544  -1.791   3.840
  529    HA   VAL  70           HA       VAL  70  -1.646  -1.432   3.598
  530    HB   VAL  70           HB       VAL  70  -3.833  -0.347   1.881
  531   1HG1  VAL  70          1HG1      VAL  70  -2.488   1.586   1.229
  532   2HG1  VAL  70          2HG1      VAL  70  -2.880   1.657   2.963
  533   3HG1  VAL  70          3HG1      VAL  70  -1.254   1.159   2.438
  534   1HG2  VAL  70          1HG2      VAL  70  -1.013  -0.696   0.973
  535   2HG2  VAL  70          2HG2      VAL  70  -1.923  -2.165   1.401
  536   3HG2  VAL  70          3HG2      VAL  70  -2.543  -1.069   0.143
  537    H    VAL  71           H        VAL  71  -0.916   0.699   4.453
  538    HA   VAL  71           HA       VAL  71  -2.856   2.027   6.160
  539    HB   VAL  71           HB       VAL  71  -1.495   1.809   8.134
  540   1HG1  VAL  71          1HG1      VAL  71  -1.914  -0.949   6.938
  541   2HG1  VAL  71          2HG1      VAL  71  -1.892  -0.511   8.663
  542   3HG1  VAL  71          3HG1      VAL  71  -3.211   0.065   7.615
  543   1HG2  VAL  71          1HG2      VAL  71   0.704   1.480   7.900
  544   2HG2  VAL  71          2HG2      VAL  71   0.333  -0.240   7.630
  545   3HG2  VAL  71          3HG2      VAL  71   0.508   0.862   6.242
  546    H    ILE  72           H        ILE  72  -2.700   4.091   5.448
  547    HA   ILE  72           HA       ILE  72  -0.088   5.023   4.555
  548    HB   ILE  72           HB       ILE  72  -2.687   6.517   4.360
  549   1HG1  ILE  72          1HG1      ILE  72  -1.689   4.525   2.308
  550   2HG1  ILE  72          2HG1      ILE  72  -2.932   4.154   3.486
  551   1HG2  ILE  72          1HG2      ILE  72  -1.440   7.226   2.180
  552   2HG2  ILE  72          2HG2      ILE  72  -0.983   7.945   3.743
  553   3HG2  ILE  72          3HG2      ILE  72   0.006   6.643   3.040
  554   1HD1  ILE  72          1HD1      ILE  72  -4.063   4.858   1.472
  555   2HD1  ILE  72          2HD1      ILE  72  -4.222   6.193   2.638
  556   3HD1  ILE  72          3HD1      ILE  72  -3.028   6.298   1.322
  557    H    ASP  73           H        ASP  73   0.310   7.480   5.135
  558    HA   ASP  73           HA       ASP  73   0.045   7.571   8.020
  559   1HB   ASP  73          1HB       ASP  73   2.146   8.179   6.156
  560   2HB   ASP  73          2HB       ASP  73   1.692   9.692   6.915
  561    HA   PRO  74           HA       PRO  74  -2.475  11.145   7.696
  562   1HB   PRO  74          1HB       PRO  74  -1.791  12.617   9.894
  563   2HB   PRO  74          2HB       PRO  74  -2.854  11.226   9.966
  564   1HG   PRO  74          1HG       PRO  74  -0.030  11.447  10.811
  565   2HG   PRO  74          2HG       PRO  74  -1.216  10.234  11.251
  566   1HD   PRO  74          1HD       PRO  74   0.925   9.936   9.366
  567   2HD   PRO  74          2HD       PRO  74  -0.330   8.765   9.721
  568    H    PHE  75           H        PHE  75   0.916  11.579   7.729
  569    HA   PHE  75           HA       PHE  75   0.646  14.331   6.866
  570   1HB   PHE  75          1HB       PHE  75   2.769  12.370   7.750
  571   2HB   PHE  75          2HB       PHE  75   3.310  13.607   6.633
  572    HD1  PHE  75           1HD      PHE  75   2.430  12.863  10.032
  573    HD2  PHE  75           2HD      PHE  75   3.005  16.034   7.271
  574    HE1  PHE  75           1HE      PHE  75   2.670  14.479  11.938
  575    HE2  PHE  75           2HE      PHE  75   3.245  17.650   9.177
  576    HZ   PHE  75           HZ       PHE  75   3.074  16.853  11.488
  577    H    SER  76           H        SER  76   0.489  11.239   5.458
  578    HA   SER  76           HA       SER  76   1.855  12.023   3.054
  579   1HB   SER  76          1HB       SER  76   1.906   9.667   4.069
  580   2HB   SER  76          2HB       SER  76   0.239   9.491   3.559
  581    HG   SER  76           HG       SER  76   2.586   9.826   1.920
  582    H    MET  77           H        MET  77  -1.380  11.916   4.444
  583    HA   MET  77           HA       MET  77  -2.892  11.704   2.164
  584   1HB   MET  77          1HB       MET  77  -3.275  12.216   4.922
  585   2HB   MET  77          2HB       MET  77  -3.935  13.644   4.150
  586   1HG   MET  77          1HG       MET  77  -5.672  11.879   4.434
  587   2HG   MET  77          2HG       MET  77  -5.418  12.257   2.742
  588   1HE   MET  77          1HE       MET  77  -5.344  10.951   1.224
  589   2HE   MET  77          2HE       MET  77  -3.874   9.968   1.019
  590   3HE   MET  77          3HE       MET  77  -5.442   9.175   1.304
  591    HA   PRO  78           HA       PRO  78  -2.558  16.426   1.819
  592   1HB   PRO  78          1HB       PRO  78  -0.737  17.782   3.341
  593   2HB   PRO  78          2HB       PRO  78  -2.423  17.612   3.788
  594   1HG   PRO  78          1HG       PRO  78  -0.062  16.226   4.903
  595   2HG   PRO  78          2HG       PRO  78  -1.663  16.397   5.595
  596   1HD   PRO  78          1HD       PRO  78  -0.580  14.061   4.331
  597   2HD   PRO  78          2HD       PRO  78  -2.218  14.271   4.919
  598    H    TYR  79           H        TYR  79  -0.284  14.151   1.588
  599    HA   TYR  79           HA       TYR  79   1.390  15.870  -0.115
  600   1HB   TYR  79          1HB       TYR  79   2.004  14.231   2.072
  601   2HB   TYR  79          2HB       TYR  79   2.212  13.101   0.748
  602    HD1  TYR  79           1HD      TYR  79   3.212  15.208  -1.297
  603    HD2  TYR  79           2HD      TYR  79   4.300  14.336   2.748
  604    HE1  TYR  79           1HE      TYR  79   5.542  16.136  -1.716
  605    HE2  TYR  79           2HE      TYR  79   6.626  15.267   2.315
  606    HH   TYR  79           HH       TYR  79   7.532  16.425  -0.917
  607    H    VAL  80           H        VAL  80  -0.764  13.094   0.076
  608    HA   VAL  80           HA       VAL  80  -0.410  12.739  -2.800
  609    HB   VAL  80           HB       VAL  80  -0.339  10.357  -2.614
  610   1HG1  VAL  80          1HG1      VAL  80   1.706  10.989  -0.551
  611   2HG1  VAL  80          2HG1      VAL  80   1.876  10.198  -2.136
  612   3HG1  VAL  80          3HG1      VAL  80   1.749  11.970  -2.035
  613   1HG2  VAL  80          1HG2      VAL  80  -1.208   9.276  -0.871
  614   2HG2  VAL  80          2HG2      VAL  80   0.107   9.887   0.162
  615   3HG2  VAL  80          3HG2      VAL  80  -1.404  10.814   0.004
  616    H    ASN  81           H        ASN  81  -2.362  14.289  -1.438
  617    HA   ASN  81           HA       ASN  81  -4.633  12.768  -0.868
  618   1HB   ASN  81          1HB       ASN  81  -4.544  15.006   0.016
  619   2HB   ASN  81          2HB       ASN  81  -4.139  15.698  -1.542
  620   1HD2  ASN  81          1HD2      ASN  81  -5.840  17.162  -1.351
  621   2HD2  ASN  81          2HD2      ASN  81  -7.492  16.721  -1.627
  622    H    GLY  82           H        GLY  82  -5.528  11.466  -2.498
  623   1HA   GLY  82          1HA       GLY  82  -6.754  11.064  -4.368
  624   2HA   GLY  82          2HA       GLY  82  -6.576  12.737  -4.858
  625    H    ALA  83           H        ALA  83  -3.465  11.883  -4.116
  626    HA   ALA  83           HA       ALA  83  -2.764  11.618  -6.870
  627   1HB   ALA  83          1HB       ALA  83  -1.543  12.811  -4.870
  628   2HB   ALA  83          2HB       ALA  83  -0.874  11.192  -4.556
  629   3HB   ALA  83          3HB       ALA  83  -0.582  11.987  -6.122
  630    H    GLU  84           H        GLU  84  -1.071   9.829  -7.469
  631    HA   GLU  84           HA       GLU  84  -1.967   7.328  -6.270
  632   1HB   GLU  84          1HB       GLU  84  -1.942   6.276  -8.500
  633   2HB   GLU  84          2HB       GLU  84  -3.063   7.622  -8.465
  634   1HG   GLU  84          1HG       GLU  84  -0.696   8.870  -9.231
  635   2HG   GLU  84          2HG       GLU  84  -0.543   7.305 -10.003
  636    H    LEU  85           H        LEU  85  -0.356   5.745  -5.937
  637    HA   LEU  85           HA       LEU  85   2.362   6.729  -6.406
  638   1HB   LEU  85          1HB       LEU  85   2.304   6.387  -4.180
  639   2HB   LEU  85          2HB       LEU  85   1.027   5.189  -4.269
  640    HG   LEU  85           HG       LEU  85   2.635   3.483  -4.983
  641   1HD1  LEU  85          1HD1      LEU  85   4.213   4.815  -6.222
  642   2HD1  LEU  85          2HD1      LEU  85   4.690   5.697  -4.751
  643   3HD1  LEU  85          3HD1      LEU  85   5.070   3.966  -4.913
  644   1HD2  LEU  85          1HD2      LEU  85   2.545   3.193  -2.760
  645   2HD2  LEU  85          2HD2      LEU  85   4.194   3.863  -2.781
  646   3HD2  LEU  85          3HD2      LEU  85   2.808   4.920  -2.416
  647    H    ASP  86           H        ASP  86   3.175   6.009  -8.307
  648    HA   ASP  86           HA       ASP  86   2.341   3.387  -9.188
  649   1HB   ASP  86          1HB       ASP  86   2.447   5.549 -10.657
  650   2HB   ASP  86          2HB       ASP  86   4.183   5.314 -10.656
  651    H    TYR  87           H        TYR  87   3.636   1.774  -8.249
  652    HA   TYR  87           HA       TYR  87   6.410   2.336  -7.666
  653   1HB   TYR  87          1HB       TYR  87   4.501   0.938  -6.392
  654   2HB   TYR  87          2HB       TYR  87   4.900  -0.327  -7.537
  655    HD1  TYR  87           1HD      TYR  87   6.752  -1.752  -7.175
  656    HD2  TYR  87           2HD      TYR  87   6.370   1.838  -4.879
  657    HE1  TYR  87           1HE      TYR  87   8.661  -2.501  -5.672
  658    HE2  TYR  87           2HE      TYR  87   8.280   1.077  -3.384
  659    HH   TYR  87           HH       TYR  87  10.129  -1.812  -4.152
  660    H    VAL  88           H        VAL  88   8.170   1.667  -8.829
  661    HA   VAL  88           HA       VAL  88   7.618   0.436 -11.387
  662    HB   VAL  88           HB       VAL  88  10.013   1.714 -10.085
  663   1HG1  VAL  88          1HG1      VAL  88  10.986  -0.092 -11.297
  664   2HG1  VAL  88          2HG1      VAL  88   9.902   0.164 -12.686
  665   3HG1  VAL  88          3HG1      VAL  88  11.168   1.359 -12.313
  666   1HG2  VAL  88          1HG2      VAL  88   8.124   3.085 -11.100
  667   2HG2  VAL  88          2HG2      VAL  88   9.758   3.413 -11.724
  668   3HG2  VAL  88          3HG2      VAL  88   8.623   2.430 -12.678
  669    H    VAL  89           H        VAL  89   8.799  -1.482 -12.143
  670    HA   VAL  89           HA       VAL  89   9.655  -3.197  -9.919
  671    HB   VAL  89           HB       VAL  89   7.949  -3.988 -12.289
  672   1HG1  VAL  89          1HG1      VAL  89   7.727  -6.122 -10.823
  673   2HG1  VAL  89          2HG1      VAL  89   9.204  -5.892 -11.790
  674   3HG1  VAL  89          3HG1      VAL  89   9.221  -5.548 -10.043
  675   1HG2  VAL  89          1HG2      VAL  89   6.244  -4.476 -10.458
  676   2HG2  VAL  89          2HG2      VAL  89   7.271  -3.503  -9.378
  677   3HG2  VAL  89          3HG2      VAL  89   6.545  -2.760 -10.823
  678    H    ASP  90           H        ASP  90  11.699  -3.933 -10.182
  679    HA   ASP  90           HA       ASP  90  12.602  -4.703 -12.743
  680   1HB   ASP  90          1HB       ASP  90  13.860  -2.262 -11.403
  681   2HB   ASP  90          2HB       ASP  90  14.591  -3.127 -12.740
  682    H    PHE  91           H        PHE  91  15.350  -4.853 -12.318
  683    HA   PHE  91           HA       PHE  91  16.712  -6.345 -11.341
  684   1HB   PHE  91          1HB       PHE  91  16.673  -3.897 -10.164
  685   2HB   PHE  91          2HB       PHE  91  16.102  -4.810  -8.781
  686    HD1  PHE  91           1HD      PHE  91  17.798  -5.043  -7.244
  687    HD2  PHE  91           2HD      PHE  91  18.721  -5.493 -11.362
  688    HE1  PHE  91           1HE      PHE  91  20.166  -5.624  -6.650
  689    HE2  PHE  91           2HE      PHE  91  21.089  -6.074 -10.768
  690    HZ   PHE  91           HZ       PHE  91  21.783  -6.132  -8.419
  691    H    MET  92           H        MET  92  16.596  -6.593  -8.212
  692    HA   MET  92           HA       MET  92  14.834  -8.885  -8.317
  693   1HB   MET  92          1HB       MET  92  17.323  -8.112  -6.927
  694   2HB   MET  92          2HB       MET  92  16.152  -8.760  -5.797
  695   1HG   MET  92          1HG       MET  92  17.097 -10.763  -6.477
  696   2HG   MET  92          2HG       MET  92  15.870 -10.634  -7.721
  697   1HE   MET  92          1HE       MET  92  18.288 -12.410  -8.027
  698   2HE   MET  92          2HE       MET  92  19.700 -11.778  -8.907
  699   3HE   MET  92          3HE       MET  92  19.481 -11.395  -7.183
  700    H    GLY  93           H        GLY  93  13.788  -6.083  -8.138
  701   1HA   GLY  93          1HA       GLY  93  11.883  -6.512  -6.067
  702   2HA   GLY  93          2HA       GLY  93  13.057  -5.301  -5.593
  703    H    GLY  94           H        GLY  94  12.704  -3.207  -6.220
  704   1HA   GLY  94          1HA       GLY  94  11.754  -2.434  -8.741
  705   2HA   GLY  94          2HA       GLY  94  10.389  -2.494  -7.643
  706    H    GLY  95           H        GLY  95  10.403  -0.076  -8.155
  707   1HA   GLY  95          1HA       GLY  95  12.088   1.290  -6.157
  708   2HA   GLY  95          2HA       GLY  95  11.987   1.893  -7.799
  709    H    PHE  96           H        PHE  96  11.172   3.847  -6.443
  710    HA   PHE  96           HA       PHE  96   8.269   3.553  -6.104
  711   1HB   PHE  96          1HB       PHE  96   8.898   5.724  -4.590
  712   2HB   PHE  96          2HB       PHE  96   9.012   4.104  -3.933
  713    HD1  PHE  96           1HD      PHE  96  11.011   3.400  -2.991
  714    HD2  PHE  96           2HD      PHE  96  11.070   6.639  -5.732
  715    HE1  PHE  96           1HE      PHE  96  13.445   3.769  -2.502
  716    HE2  PHE  96           2HE      PHE  96  13.504   7.009  -5.243
  717    HZ   PHE  96           HZ       PHE  96  14.662   5.569  -3.633
  718    H    THR  97           H        THR  97   6.935   5.105  -7.060
  719    HA   THR  97           HA       THR  97   8.059   7.519  -8.132
  720    HB   THR  97           HB       THR  97   7.328   5.143  -9.896
  721    HG1  THR  97           1HG      THR  97   9.417   7.196  -9.686
  722   1HG2  THR  97          1HG2      THR  97   6.211   7.495 -10.537
  723   2HG2  THR  97          2HG2      THR  97   7.879   7.906 -11.005
  724   3HG2  THR  97          3HG2      THR  97   7.050   6.533 -11.778
  725    H    ILE  98           H        ILE  98   6.505   9.084  -8.563
  726    HA   ILE  98           HA       ILE  98   3.729   8.219  -8.295
  727    HB   ILE  98           HB       ILE  98   4.364   8.790  -6.061
  728   1HG1  ILE  98          1HG1      ILE  98   2.972  11.304  -6.560
  729   2HG1  ILE  98          2HG1      ILE  98   2.278   9.986  -7.483
  730   1HG2  ILE  98          1HG2      ILE  98   5.682  10.504  -5.413
  731   2HG2  ILE  98          2HG2      ILE  98   6.256  10.408  -7.096
  732   3HG2  ILE  98          3HG2      ILE  98   5.033  11.619  -6.640
  733   1HD1  ILE  98          1HD1      ILE  98   1.376  10.343  -5.084
  734   2HD1  ILE  98          2HD1      ILE  98   1.838   8.683  -5.528
  735   3HD1  ILE  98          3HD1      ILE  98   2.928   9.672  -4.528
  736    H    ARG  99           H        ARG  99   2.233   9.546  -9.407
  737    HA   ARG  99           HA       ARG  99   3.551  11.534 -11.078
  738   1HB   ARG  99          1HB       ARG  99   2.223   9.209 -11.905
  739   2HB   ARG  99          2HB       ARG  99   0.990  10.438 -12.100
  740   1HG   ARG  99          1HG       ARG  99   2.938  11.821 -13.262
  741   2HG   ARG  99          2HG       ARG  99   3.703  10.254 -13.436
  742   1HD   ARG  99          1HD       ARG  99   2.285   9.634 -15.114
  743   2HD   ARG  99          2HD       ARG  99   0.869  10.140 -14.213
  744    HE   ARG  99           HE       ARG  99   2.383  11.754 -16.157
  745   1HH1  ARG  99          2HH2      ARG  99   0.010  11.774 -13.559
  746   2HH1  ARG  99          1HH2      ARG  99  -0.676  13.295 -14.025
  747   1HH2  ARG  99          2HH1      ARG  99   1.479  13.760 -16.773
  748   2HH2  ARG  99          1HH1      ARG  99   0.165  14.432 -15.865
  749    H    ASN 100           H        ASN 100   3.010  13.478 -10.067
  750    HA   ASN 100           HA       ASN 100   0.555  13.795  -8.742
  751   1HB   ASN 100          1HB       ASN 100   2.849  15.617  -9.538
  752   2HB   ASN 100          2HB       ASN 100   1.364  16.343  -8.954
  753   1HD2  ASN 100          1HD2      ASN 100   0.577  15.802  -6.868
  754   2HD2  ASN 100          2HD2      ASN 100   1.640  15.271  -5.608
  755    HA   PRO 101           HA       PRO 101  -1.691  15.017 -12.331
  756   1HB   PRO 101          1HB       PRO 101  -4.039  15.739 -11.133
  757   2HB   PRO 101          2HB       PRO 101  -3.636  14.080 -11.531
  758   1HG   PRO 101          1HG       PRO 101  -3.634  15.405  -8.888
  759   2HG   PRO 101          2HG       PRO 101  -3.654  13.692  -9.257
  760   1HD   PRO 101          1HD       PRO 101  -1.401  15.229  -8.370
  761   2HD   PRO 101          2HD       PRO 101  -1.396  13.544  -8.851
  Start of MODEL    6
    1    H    MET   1           H        MET   1 -12.199   1.049  19.673
    2    HA   MET   1           HA       MET   1 -10.368  -0.129  20.810
    3   1HB   MET   1          1HB       MET   1 -12.771  -0.889  22.416
    4   2HB   MET   1          2HB       MET   1 -11.728  -2.243  22.032
    5   1HG   MET   1          1HG       MET   1 -10.384  -1.603  23.750
    6   2HG   MET   1          2HG       MET   1  -9.939  -0.194  22.807
    7   1HE   MET   1          1HE       MET   1 -10.441   1.308  26.230
    8   2HE   MET   1          2HE       MET   1 -10.673  -0.442  26.458
    9   3HE   MET   1          3HE       MET   1  -9.434   0.152  25.327
   10    H    GLN   2           H        GLN   2 -10.794  -0.188  18.302
   11    HA   GLN   2           HA       GLN   2 -10.602  -2.778  17.491
   12   1HB   GLN   2          1HB       GLN   2 -13.262  -2.337  18.089
   13   2HB   GLN   2          2HB       GLN   2 -13.235  -1.959  16.378
   14   1HG   GLN   2          1HG       GLN   2 -12.509  -4.133  15.769
   15   2HG   GLN   2          2HG       GLN   2 -11.862  -4.475  17.361
   16   1HE2  GLN   2          1HE2      GLN   2 -13.791  -5.911  15.648
   17   2HE2  GLN   2          2HE2      GLN   2 -15.217  -6.159  16.600
   18    H    GLU   3           H        GLU   3 -11.403  -2.777  14.856
   19    HA   GLU   3           HA       GLU   3  -9.685  -0.812  13.796
   20   1HB   GLU   3          1HB       GLU   3 -11.461  -2.952  12.576
   21   2HB   GLU   3          2HB       GLU   3 -10.574  -1.828  11.565
   22   1HG   GLU   3          1HG       GLU   3  -8.443  -2.578  12.418
   23   2HG   GLU   3          2HG       GLU   3  -9.191  -3.435  13.751
   24    H    GLN   4           H        GLN   4 -10.158   1.074  12.618
   25    HA   GLN   4           HA       GLN   4 -12.946   1.876  12.810
   26   1HB   GLN   4          1HB       GLN   4 -11.412   3.361  13.987
   27   2HB   GLN   4          2HB       GLN   4 -10.379   3.500  12.578
   28   1HG   GLN   4          1HG       GLN   4 -11.591   5.302  11.931
   29   2HG   GLN   4          2HG       GLN   4 -12.952   4.235  11.648
   30   1HE2  GLN   4          1HE2      GLN   4 -14.331   5.950  12.221
   31   2HE2  GLN   4          2HE2      GLN   4 -14.641   6.370  13.873
   32    H    ALA   5           H        ALA   5 -14.151   2.302  10.975
   33    HA   ALA   5           HA       ALA   5 -13.031   1.516   8.475
   34   1HB   ALA   5          1HB       ALA   5 -15.229   0.965   8.407
   35   2HB   ALA   5          2HB       ALA   5 -15.666   2.176   9.635
   36   3HB   ALA   5          3HB       ALA   5 -15.481   2.662   7.933
   37    H    GLN   6           H        GLN   6 -12.133   2.768   6.894
   38    HA   GLN   6           HA       GLN   6 -12.834   5.456   6.573
   39   1HB   GLN   6          1HB       GLN   6 -10.694   6.525   7.178
   40   2HB   GLN   6          2HB       GLN   6 -11.432   5.778   8.581
   41   1HG   GLN   6          1HG       GLN   6  -9.887   3.696   7.556
   42   2HG   GLN   6          2HG       GLN   6  -8.898   5.098   7.198
   43   1HE2  GLN   6          1HE2      GLN   6  -9.124   2.768   9.296
   44   2HE2  GLN   6          2HE2      GLN   6  -8.710   3.530  10.795
   45    H    GLN   7           H        GLN   7 -12.574   5.851   4.411
   46    HA   GLN   7           HA       GLN   7 -10.501   4.287   3.080
   47   1HB   GLN   7          1HB       GLN   7 -13.198   3.959   2.690
   48   2HB   GLN   7          2HB       GLN   7 -12.851   5.162   1.464
   49   1HG   GLN   7          1HG       GLN   7 -11.889   3.598   0.135
   50   2HG   GLN   7          2HG       GLN   7 -10.747   3.177   1.396
   51   1HE2  GLN   7          1HE2      GLN   7 -13.010   1.971  -0.582
   52   2HE2  GLN   7          2HE2      GLN   7 -13.580   0.602   0.313
   53    H    PHE   8           H        PHE   8  -8.868   5.796   2.830
   54    HA   PHE   8           HA       PHE   8  -9.543   8.512   2.169
   55   1HB   PHE   8          1HB       PHE   8  -7.302   6.877   3.166
   56   2HB   PHE   8          2HB       PHE   8  -6.741   7.913   1.869
   57    HD1  PHE   8           1HD      PHE   8  -6.177   7.906   4.972
   58    HD2  PHE   8           2HD      PHE   8  -8.628  10.250   2.422
   59    HE1  PHE   8           1HE      PHE   8  -6.012   9.827   6.579
   60    HE2  PHE   8           2HE      PHE   8  -8.463  12.171   4.029
   61    HZ   PHE   8           HZ       PHE   8  -7.157  11.937   6.088
   62    H    ILE   9           H        ILE   9  -8.510   9.642   0.289
   63    HA   ILE   9           HA       ILE   9  -9.027   8.176  -2.085
   64    HB   ILE   9           HB       ILE   9  -7.804  10.908  -1.687
   65   1HG1  ILE   9          1HG1      ILE   9 -10.121  10.417  -0.661
   66   2HG1  ILE   9          2HG1      ILE   9  -9.929  11.838  -1.669
   67   1HG2  ILE   9          1HG2      ILE   9  -9.126   9.692  -4.128
   68   2HG2  ILE   9          2HG2      ILE   9  -8.500  11.351  -3.975
   69   3HG2  ILE   9          3HG2      ILE   9  -7.381   9.969  -3.917
   70   1HD1  ILE   9          1HD1      ILE   9 -11.977  10.241  -2.085
   71   2HD1  ILE   9          2HD1      ILE   9 -11.088  10.883  -3.487
   72   3HD1  ILE   9          3HD1      ILE   9 -10.788   9.220  -2.928
   73    H    PHE  10           H        PHE  10  -7.692   6.633  -2.858
   74    HA   PHE  10           HA       PHE  10  -4.949   7.316  -3.310
   75   1HB   PHE  10          1HB       PHE  10  -5.664   6.093  -0.872
   76   2HB   PHE  10          2HB       PHE  10  -5.276   4.709  -1.875
   77    HD1  PHE  10           1HD      PHE  10  -3.006   4.316  -2.632
   78    HD2  PHE  10           2HD      PHE  10  -3.940   7.709  -0.261
   79    HE1  PHE  10           1HE      PHE  10  -0.563   4.673  -2.181
   80    HE2  PHE  10           2HE      PHE  10  -1.497   8.067   0.190
   81    HZ   PHE  10           HZ       PHE  10   0.163   6.545  -0.776
   82    H    LYS  11           H        LYS  11  -3.991   5.997  -4.926
   83    HA   LYS  11           HA       LYS  11  -5.535   3.712  -5.839
   84   1HB   LYS  11          1HB       LYS  11  -5.155   6.255  -7.399
   85   2HB   LYS  11          2HB       LYS  11  -5.223   4.719  -8.240
   86   1HG   LYS  11          1HG       LYS  11  -7.481   4.730  -8.073
   87   2HG   LYS  11          2HG       LYS  11  -7.351   4.676  -6.327
   88   1HD   LYS  11          1HD       LYS  11  -8.676   6.647  -7.110
   89   2HD   LYS  11          2HD       LYS  11  -7.260   7.126  -6.194
   90   1HE   LYS  11          1HE       LYS  11  -6.099   7.879  -8.115
   91   2HE   LYS  11          2HE       LYS  11  -7.041   6.881  -9.204
   92   1HZ   LYS  11          1HZ       LYS  11  -8.277   8.660  -9.522
   93   2HZ   LYS  11          2HZ       LYS  11  -8.847   8.523  -7.997
   94   3HZ   LYS  11          3HZ       LYS  11  -7.570   9.493  -8.308
   95    H    VAL  12           H        VAL  12  -4.201   2.056  -6.393
   96    HA   VAL  12           HA       VAL  12  -1.446   2.757  -7.098
   97    HB   VAL  12           HB       VAL  12  -2.133   1.853  -4.622
   98   1HG1  VAL  12          1HG1      VAL  12  -2.911  -0.306  -5.386
   99   2HG1  VAL  12          2HG1      VAL  12  -1.401  -0.577  -6.287
  100   3HG1  VAL  12          3HG1      VAL  12  -1.378  -0.522  -4.508
  101   1HG2  VAL  12          1HG2      VAL  12   0.151   2.564  -5.934
  102   2HG2  VAL  12          2HG2      VAL  12   0.091   1.984  -4.252
  103   3HG2  VAL  12          3HG2      VAL  12   0.483   0.854  -5.570
  104    H    THR  13           H        THR  13  -0.753   1.728  -8.916
  105    HA   THR  13           HA       THR  13  -2.554   0.160 -10.398
  106    HB   THR  13           HB       THR  13  -0.676   0.045 -11.970
  107    HG1  THR  13           1HG      THR  13   0.888   1.073  -9.720
  108   1HG2  THR  13          1HG2      THR  13  -1.330   2.546 -10.601
  109   2HG2  THR  13          2HG2      THR  13   0.386   2.534 -11.074
  110   3HG2  THR  13          3HG2      THR  13  -0.879   2.297 -12.304
  111    H    ASP  14           H        ASP  14  -1.991  -2.065 -11.296
  112    HA   ASP  14           HA       ASP  14  -2.016  -3.818  -9.151
  113   1HB   ASP  14          1HB       ASP  14  -1.721  -4.091 -12.150
  114   2HB   ASP  14          2HB       ASP  14  -1.475  -5.509 -11.150
  115    H    LYS  15           H        LYS  15   0.537  -2.507 -11.269
  116    HA   LYS  15           HA       LYS  15   2.508  -4.417 -10.872
  117   1HB   LYS  15          1HB       LYS  15   2.248  -2.049 -12.265
  118   2HB   LYS  15          2HB       LYS  15   3.449  -1.636 -11.059
  119   1HG   LYS  15          1HG       LYS  15   4.678  -2.528 -12.919
  120   2HG   LYS  15          2HG       LYS  15   4.695  -3.783 -11.696
  121   1HD   LYS  15          1HD       LYS  15   2.548  -4.697 -12.894
  122   2HD   LYS  15          2HD       LYS  15   3.011  -3.654 -14.224
  123   1HE   LYS  15          1HE       LYS  15   5.064  -4.825 -14.592
  124   2HE   LYS  15          2HE       LYS  15   5.030  -5.572 -13.007
  125   1HZ   LYS  15          1HZ       LYS  15   3.334  -6.194 -15.310
  126   2HZ   LYS  15          2HZ       LYS  15   4.337  -7.193 -14.496
  127   3HZ   LYS  15          3HZ       LYS  15   2.946  -6.691 -13.803
  128    H    ALA  16           H        ALA  16   1.573  -1.525  -8.926
  129    HA   ALA  16           HA       ALA  16   3.680  -1.851  -7.066
  130   1HB   ALA  16          1HB       ALA  16   2.684   0.305  -7.313
  131   2HB   ALA  16          2HB       ALA  16   1.044  -0.343  -7.073
  132   3HB   ALA  16          3HB       ALA  16   2.185  -0.279  -5.708
  133    H    VAL  17           H        VAL  17   0.148  -2.696  -7.036
  134    HA   VAL  17           HA       VAL  17   0.115  -3.835  -4.517
  135    HB   VAL  17           HB       VAL  17  -1.499  -4.096  -7.020
  136   1HG1  VAL  17          1HG1      VAL  17  -3.020  -5.478  -5.200
  137   2HG1  VAL  17          2HG1      VAL  17  -2.056  -6.215  -6.501
  138   3HG1  VAL  17          3HG1      VAL  17  -1.386  -6.094  -4.857
  139   1HG2  VAL  17          1HG2      VAL  17  -1.550  -2.488  -4.684
  140   2HG2  VAL  17          2HG2      VAL  17  -2.708  -2.504  -6.036
  141   3HG2  VAL  17          3HG2      VAL  17  -2.980  -3.545  -4.618
  142    H    GLU  18           H        GLU  18   0.796  -5.325  -7.748
  143    HA   GLU  18           HA       GLU  18   1.085  -7.896  -6.805
  144   1HB   GLU  18          1HB       GLU  18   0.966  -6.954  -9.242
  145   2HB   GLU  18          2HB       GLU  18   2.705  -6.782  -9.118
  146   1HG   GLU  18          1HG       GLU  18   1.771  -9.423  -8.181
  147   2HG   GLU  18          2HG       GLU  18   1.323  -9.113  -9.846
  148    H    GLU  19           H        GLU  19   3.485  -5.221  -7.179
  149    HA   GLU  19           HA       GLU  19   5.770  -6.537  -6.699
  150   1HB   GLU  19          1HB       GLU  19   5.727  -4.156  -7.190
  151   2HB   GLU  19          2HB       GLU  19   4.885  -3.801  -5.696
  152   1HG   GLU  19          1HG       GLU  19   7.433  -5.294  -5.325
  153   2HG   GLU  19          2HG       GLU  19   7.634  -3.700  -6.026
  154    H    ILE  20           H        ILE  20   3.193  -5.716  -4.368
  155    HA   ILE  20           HA       ILE  20   4.786  -6.476  -2.105
  156    HB   ILE  20           HB       ILE  20   1.820  -6.198  -2.001
  157   1HG1  ILE  20          1HG1      ILE  20   2.187  -4.392  -3.442
  158   2HG1  ILE  20          2HG1      ILE  20   2.192  -3.677  -1.842
  159   1HG2  ILE  20          1HG2      ILE  20   2.155  -5.616   0.170
  160   2HG2  ILE  20          2HG2      ILE  20   3.621  -6.594  -0.076
  161   3HG2  ILE  20          3HG2      ILE  20   3.711  -4.818  -0.160
  162   1HD1  ILE  20          1HD1      ILE  20   4.271  -2.865  -2.201
  163   2HD1  ILE  20          2HD1      ILE  20   4.885  -4.521  -2.423
  164   3HD1  ILE  20          3HD1      ILE  20   4.272  -3.604  -3.820
  165    H    LYS  21           H        LYS  21   2.363  -7.935  -4.290
  166    HA   LYS  21           HA       LYS  21   1.745 -10.164  -2.768
  167   1HB   LYS  21          1HB       LYS  21   1.893  -9.868  -5.784
  168   2HB   LYS  21          2HB       LYS  21   1.092 -11.174  -4.932
  169   1HG   LYS  21          1HG       LYS  21   0.397  -8.244  -4.449
  170   2HG   LYS  21          2HG       LYS  21  -0.398  -9.205  -5.680
  171   1HD   LYS  21          1HD       LYS  21  -0.386 -10.732  -3.224
  172   2HD   LYS  21          2HD       LYS  21  -0.957  -9.116  -2.855
  173   1HE   LYS  21          1HE       LYS  21  -2.985  -9.864  -3.596
  174   2HE   LYS  21          2HE       LYS  21  -2.326  -9.630  -5.203
  175   1HZ   LYS  21          1HZ       LYS  21  -3.204 -11.846  -4.879
  176   2HZ   LYS  21          2HZ       LYS  21  -1.603 -11.904  -5.197
  177   3HZ   LYS  21          3HZ       LYS  21  -2.141 -12.132  -3.672
  178    H    LYS  22           H        LYS  22   4.594  -9.375  -4.764
  179    HA   LYS  22           HA       LYS  22   5.605 -12.043  -4.699
  180   1HB   LYS  22          1HB       LYS  22   6.364 -10.921  -6.550
  181   2HB   LYS  22          2HB       LYS  22   6.510  -9.387  -5.717
  182   1HG   LYS  22          1HG       LYS  22   8.632  -9.855  -4.916
  183   2HG   LYS  22          2HG       LYS  22   8.300 -11.563  -4.713
  184   1HD   LYS  22          1HD       LYS  22   8.529 -11.965  -7.119
  185   2HD   LYS  22          2HD       LYS  22   8.632 -10.246  -7.447
  186   1HE   LYS  22          1HE       LYS  22  10.725 -10.229  -5.912
  187   2HE   LYS  22          2HE       LYS  22  10.673 -11.979  -5.991
  188   1HZ   LYS  22          1HZ       LYS  22  10.537 -11.513  -8.516
  189   2HZ   LYS  22          2HZ       LYS  22  11.213 -10.080  -8.119
  190   3HZ   LYS  22          3HZ       LYS  22  11.982 -11.474  -7.755
  191    H    VAL  23           H        VAL  23   6.105  -8.999  -2.840
  192    HA   VAL  23           HA       VAL  23   8.236  -9.990  -1.300
  193    HB   VAL  23           HB       VAL  23   6.418  -7.670  -1.339
  194   1HG1  VAL  23          1HG1      VAL  23   7.811  -8.469   1.240
  195   2HG1  VAL  23          2HG1      VAL  23   6.992  -6.920   0.926
  196   3HG1  VAL  23          3HG1      VAL  23   6.052  -8.431   0.968
  197   1HG2  VAL  23          1HG2      VAL  23   9.353  -8.240  -1.191
  198   2HG2  VAL  23          2HG2      VAL  23   8.448  -7.162  -2.281
  199   3HG2  VAL  23          3HG2      VAL  23   8.765  -6.667  -0.601
  200    H    ALA  24           H        ALA  24   4.658 -10.049  -0.941
  201    HA   ALA  24           HA       ALA  24   4.787 -11.191   1.673
  202   1HB   ALA  24          1HB       ALA  24   2.272 -11.651   0.353
  203   2HB   ALA  24          2HB       ALA  24   2.656 -10.486   1.644
  204   3HB   ALA  24          3HB       ALA  24   2.844 -10.017  -0.063
  205    H    GLN  25           H        GLN  25   4.370 -12.370  -1.705
  206    HA   GLN  25           HA       GLN  25   3.667 -14.944  -1.119
  207   1HB   GLN  25          1HB       GLN  25   4.997 -13.555  -3.415
  208   2HB   GLN  25          2HB       GLN  25   5.129 -15.302  -3.386
  209   1HG   GLN  25          1HG       GLN  25   2.399 -14.500  -2.727
  210   2HG   GLN  25          2HG       GLN  25   2.893 -13.751  -4.232
  211   1HE2  GLN  25          1HE2      GLN  25   0.896 -15.632  -4.117
  212   2HE2  GLN  25          2HE2      GLN  25   1.379 -17.088  -4.922
  213    H    GLU  26           H        GLU  26   6.948 -13.450  -1.382
  214    HA   GLU  26           HA       GLU  26   8.313 -15.857  -1.026
  215   1HB   GLU  26          1HB       GLU  26   9.145 -13.543  -1.911
  216   2HB   GLU  26          2HB       GLU  26   9.398 -13.138  -0.225
  217   1HG   GLU  26          1HG       GLU  26  10.617 -15.572  -0.257
  218   2HG   GLU  26          2HG       GLU  26  10.842 -15.137  -1.940
  219    H    ASN  27           H        ASN  27   6.538 -13.805   1.148
  220    HA   ASN  27           HA       ASN  27   7.952 -14.940   3.416
  221   1HB   ASN  27          1HB       ASN  27   6.176 -12.519   3.003
  222   2HB   ASN  27          2HB       ASN  27   6.251 -13.223   4.606
  223   1HD2  ASN  27          1HD2      ASN  27   7.652 -11.105   2.443
  224   2HD2  ASN  27          2HD2      ASN  27   9.178 -10.827   3.214
  225    H    ASN  28           H        ASN  28   5.526 -15.786   1.370
  226    HA   ASN  28           HA       ASN  28   3.796 -17.089   1.454
  227   1HB   ASN  28          1HB       ASN  28   5.354 -18.326   3.164
  228   2HB   ASN  28          2HB       ASN  28   4.318 -17.654   4.408
  229   1HD2  ASN  28          1HD2      ASN  28   3.698 -19.738   5.013
  230   2HD2  ASN  28          2HD2      ASN  28   2.539 -20.664   4.119
  231    H    ILE  29           H        ILE  29   3.561 -14.230   2.192
  232    HA   ILE  29           HA       ILE  29   1.509 -14.237   4.261
  233    HB   ILE  29           HB       ILE  29   3.119 -12.092   2.900
  234   1HG1  ILE  29          1HG1      ILE  29   2.818 -12.761   5.839
  235   2HG1  ILE  29          2HG1      ILE  29   4.067 -13.444   4.817
  236   1HG2  ILE  29          1HG2      ILE  29   0.767 -11.691   4.769
  237   2HG2  ILE  29          2HG2      ILE  29   1.882 -10.425   4.202
  238   3HG2  ILE  29          3HG2      ILE  29   0.826 -11.267   3.042
  239   1HD1  ILE  29          1HD1      ILE  29   3.817 -10.490   4.603
  240   2HD1  ILE  29          2HD1      ILE  29   4.315 -11.079   6.207
  241   3HD1  ILE  29          3HD1      ILE  29   5.274 -11.500   4.768
  242    H    GLU  30           H        GLU  30  -0.653 -13.832   3.868
  243    HA   GLU  30           HA       GLU  30  -1.312 -13.591   1.036
  244   1HB   GLU  30          1HB       GLU  30  -2.111 -15.537   2.964
  245   2HB   GLU  30          2HB       GLU  30  -3.530 -14.560   2.642
  246   1HG   GLU  30          1HG       GLU  30  -3.474 -15.038   0.293
  247   2HG   GLU  30          2HG       GLU  30  -1.820 -15.612   0.359
  248    H    ASN  31           H        ASN  31  -0.958 -11.727   3.674
  249    HA   ASN  31           HA       ASN  31  -3.045  -9.963   2.792
  250   1HB   ASN  31          1HB       ASN  31  -3.055 -11.374   5.417
  251   2HB   ASN  31          2HB       ASN  31  -3.237  -9.637   5.559
  252   1HD2  ASN  31          1HD2      ASN  31  -4.700 -12.596   4.770
  253   2HD2  ASN  31          2HD2      ASN  31  -6.247 -12.025   4.241
  254    HA   PRO  32           HA       PRO  32   0.963  -8.081   3.971
  255   1HB   PRO  32          1HB       PRO  32   1.519  -6.847   1.597
  256   2HB   PRO  32          2HB       PRO  32   2.131  -8.434   2.018
  257   1HG   PRO  32          1HG       PRO  32  -0.043  -7.723   0.146
  258   2HG   PRO  32          2HG       PRO  32   0.857  -9.222   0.264
  259   1HD   PRO  32          1HD       PRO  32  -1.811  -8.745   1.201
  260   2HD   PRO  32          2HD       PRO  32  -0.869 -10.205   1.422
  261    H    ILE  33           H        ILE  33   0.876  -6.378   5.280
  262    HA   ILE  33           HA       ILE  33  -1.052  -4.333   4.454
  263    HB   ILE  33           HB       ILE  33   0.117  -4.970   7.166
  264   1HG1  ILE  33          1HG1      ILE  33  -2.779  -5.275   6.441
  265   2HG1  ILE  33          2HG1      ILE  33  -1.648  -6.527   5.966
  266   1HG2  ILE  33          1HG2      ILE  33  -2.242  -3.301   7.184
  267   2HG2  ILE  33          2HG2      ILE  33  -0.646  -3.029   7.924
  268   3HG2  ILE  33          3HG2      ILE  33  -0.940  -2.543   6.237
  269   1HD1  ILE  33          1HD1      ILE  33  -1.745  -7.367   8.063
  270   2HD1  ILE  33          2HD1      ILE  33  -1.006  -5.866   8.671
  271   3HD1  ILE  33          3HD1      ILE  33  -2.778  -6.013   8.581
  272    H    LEU  34           H        LEU  34   0.104  -3.020   3.058
  273    HA   LEU  34           HA       LEU  34   2.748  -2.163   3.908
  274   1HB   LEU  34          1HB       LEU  34   1.348  -1.343   1.382
  275   2HB   LEU  34          2HB       LEU  34   3.066  -1.408   1.720
  276    HG   LEU  34           HG       LEU  34   2.684  -3.202   0.277
  277   1HD1  LEU  34          1HD1      LEU  34   3.045  -3.926   3.124
  278   2HD1  LEU  34          2HD1      LEU  34   2.637  -5.264   2.023
  279   3HD1  LEU  34          3HD1      LEU  34   4.070  -4.257   1.707
  280   1HD2  LEU  34          1HD2      LEU  34   0.056  -3.075   1.122
  281   2HD2  LEU  34          2HD2      LEU  34   0.738  -4.246  -0.032
  282   3HD2  LEU  34          3HD2      LEU  34   0.593  -4.675   1.689
  283    H    ARG  35           H        ARG  35   3.256  -0.091   4.582
  284    HA   ARG  35           HA       ARG  35   0.920   1.583   5.011
  285   1HB   ARG  35          1HB       ARG  35   1.953   1.055   7.121
  286   2HB   ARG  35          2HB       ARG  35   3.568   1.304   6.488
  287   1HG   ARG  35          1HG       ARG  35   3.258   3.703   6.365
  288   2HG   ARG  35          2HG       ARG  35   1.531   3.565   6.630
  289   1HD   ARG  35          1HD       ARG  35   2.299   4.181   8.770
  290   2HD   ARG  35          2HD       ARG  35   2.195   2.438   8.917
  291    HE   ARG  35           HE       ARG  35   4.808   3.331   7.956
  292   1HH1  ARG  35          2HH2      ARG  35   2.850   2.767  10.825
  293   2HH1  ARG  35          1HH2      ARG  35   4.215   2.559  11.872
  294   1HH2  ARG  35          2HH1      ARG  35   6.609   3.057   9.337
  295   2HH2  ARG  35          1HH1      ARG  35   6.367   2.726  11.019
  296    H    ILE  36           H        ILE  36   1.179   3.954   4.695
  297    HA   ILE  36           HA       ILE  36   2.976   4.480   2.481
  298    HB   ILE  36           HB       ILE  36   0.831   6.215   3.708
  299   1HG1  ILE  36          1HG1      ILE  36  -0.407   4.407   2.976
  300   2HG1  ILE  36          2HG1      ILE  36  -0.411   5.444   1.563
  301   1HG2  ILE  36          1HG2      ILE  36   2.222   6.382   1.021
  302   2HG2  ILE  36          2HG2      ILE  36   0.925   7.448   1.611
  303   3HG2  ILE  36          3HG2      ILE  36   2.513   7.450   2.415
  304   1HD1  ILE  36          1HD1      ILE  36   1.428   3.056   2.044
  305   2HD1  ILE  36          2HD1      ILE  36   0.097   3.156   0.866
  306   3HD1  ILE  36          3HD1      ILE  36   1.555   4.155   0.649
  307    H    ARG  37           H        ARG  37   4.853   5.612   2.630
  308    HA   ARG  37           HA       ARG  37   5.184   7.385   4.853
  309   1HB   ARG  37          1HB       ARG  37   6.095   4.789   5.186
  310   2HB   ARG  37          2HB       ARG  37   7.521   5.556   4.516
  311   1HG   ARG  37          1HG       ARG  37   7.974   6.436   6.553
  312   2HG   ARG  37          2HG       ARG  37   6.510   7.393   6.444
  313   1HD   ARG  37          1HD       ARG  37   5.188   5.655   7.522
  314   2HD   ARG  37          2HD       ARG  37   6.495   4.494   7.399
  315    HE   ARG  37           HE       ARG  37   7.483   5.434   9.302
  316   1HH1  ARG  37          2HH2      ARG  37   5.111   7.686   8.003
  317   2HH1  ARG  37          1HH2      ARG  37   5.225   8.778   9.343
  318   1HH2  ARG  37          2HH1      ARG  37   7.633   6.874  11.070
  319   2HH2  ARG  37          1HH1      ARG  37   6.669   8.313  11.099
  320    H    VAL  38           H        VAL  38   6.129   9.220   4.013
  321    HA   VAL  38           HA       VAL  38   7.239   9.123   1.379
  322    HB   VAL  38           HB       VAL  38   6.922  11.327   3.424
  323   1HG1  VAL  38          1HG1      VAL  38   8.690  11.352   1.300
  324   2HG1  VAL  38          2HG1      VAL  38   7.239  12.123   0.616
  325   3HG1  VAL  38          3HG1      VAL  38   7.988  12.785   2.088
  326   1HG2  VAL  38          1HG2      VAL  38   5.166  10.128   1.389
  327   2HG2  VAL  38          2HG2      VAL  38   4.768  11.121   2.811
  328   3HG2  VAL  38          3HG2      VAL  38   5.278  11.902   1.295
  329    H    VAL  39           H        VAL  39   9.340   8.835   0.822
  330    HA   VAL  39           HA       VAL  39  11.273   8.823   3.017
  331    HB   VAL  39           HB       VAL  39  11.047   7.462   0.358
  332   1HG1  VAL  39          1HG1      VAL  39  13.377   6.755   0.456
  333   2HG1  VAL  39          2HG1      VAL  39  13.280   8.531   0.372
  334   3HG1  VAL  39          3HG1      VAL  39  13.637   7.731   1.921
  335   1HG2  VAL  39          1HG2      VAL  39  10.909   6.733   3.161
  336   2HG2  VAL  39          2HG2      VAL  39  10.478   5.785   1.717
  337   3HG2  VAL  39          3HG2      VAL  39  12.154   5.779   2.318
  338    HA   PRO  40           HA       PRO  40  12.956  12.485   1.417
  339   1HB   PRO  40          1HB       PRO  40  15.244  12.593   2.907
  340   2HB   PRO  40          2HB       PRO  40  13.687  13.134   3.502
  341   1HG   PRO  40          1HG       PRO  40  15.169  10.664   4.167
  342   2HG   PRO  40          2HG       PRO  40  13.853  11.423   5.040
  343   1HD   PRO  40          1HD       PRO  40  13.688   9.098   3.368
  344   2HD   PRO  40          2HD       PRO  40  12.354   9.925   4.148
  345    H    GLY  41           H        GLY  41  13.096  11.507  -0.725
  346   1HA   GLY  41          1HA       GLY  41  15.943  11.277  -1.415
  347   2HA   GLY  41          2HA       GLY  41  14.855   9.975  -1.855
  348    H    GLY  42           H        GLY  42  12.570  11.041  -2.774
  349   1HA   GLY  42          1HA       GLY  42  13.077  11.894  -5.325
  350   2HA   GLY  42          2HA       GLY  42  11.580  12.163  -4.456
  351    H    CYS  43           H        CYS  43  14.461  13.615  -5.753
  352    HA   CYS  43           HA       CYS  43  14.399  15.969  -4.180
  353   1HB   CYS  43          1HB       CYS  43  16.078  16.808  -5.665
  354   2HB   CYS  43          2HB       CYS  43  16.424  15.115  -5.378
  355    HG   CYS  43           HG       CYS  43  14.641  14.581  -7.575
  356    H    SER  44           H        SER  44  12.674  14.690  -6.972
  357    HA   SER  44           HA       SER  44  11.561  17.343  -7.438
  358   1HB   SER  44          1HB       SER  44  12.742  15.925  -9.325
  359   2HB   SER  44          2HB       SER  44  11.246  15.012  -9.347
  360    HG   SER  44           HG       SER  44  11.701  17.242 -10.662
  361    H    GLY  45           H        GLY  45  10.934  13.930  -6.647
  362   1HA   GLY  45          1HA       GLY  45   8.273  14.628  -5.724
  363   2HA   GLY  45          2HA       GLY  45   8.326  13.501  -7.064
  364    H    PHE  46           H        PHE  46   8.575  13.875  -3.646
  365    HA   PHE  46           HA       PHE  46  10.212  11.660  -3.066
  366   1HB   PHE  46          1HB       PHE  46   7.887  12.911  -1.488
  367   2HB   PHE  46          2HB       PHE  46   9.224  12.016  -0.793
  368    HD1  PHE  46           1HD      PHE  46  11.445  13.030  -0.620
  369    HD2  PHE  46           2HD      PHE  46   8.158  15.213  -2.181
  370    HE1  PHE  46           1HE      PHE  46  12.726  15.168  -0.327
  371    HE2  PHE  46           2HE      PHE  46   9.439  17.351  -1.889
  372    HZ   PHE  46           HZ       PHE  46  11.708  17.303  -0.965
  373    H    GLN  47           H        GLN  47   9.693   9.671  -3.926
  374    HA   GLN  47           HA       GLN  47   6.923   8.900  -3.949
  375   1HB   GLN  47          1HB       GLN  47   7.923   6.794  -5.064
  376   2HB   GLN  47          2HB       GLN  47   8.051   8.303  -5.946
  377   1HG   GLN  47          1HG       GLN  47  10.309   7.671  -4.075
  378   2HG   GLN  47          2HG       GLN  47  10.174   6.651  -5.494
  379   1HE2  GLN  47          1HE2      GLN  47   9.663   7.918  -7.569
  380   2HE2  GLN  47          2HE2      GLN  47  10.627   9.326  -7.872
  381    H    TYR  48           H        TYR  48   6.003   7.909  -2.212
  382    HA   TYR  48           HA       TYR  48   7.689   6.847  -0.140
  383   1HB   TYR  48          1HB       TYR  48   5.398   6.523   0.907
  384   2HB   TYR  48          2HB       TYR  48   5.587   8.148   0.280
  385    HD1  TYR  48           1HD      TYR  48   3.891   4.919  -0.174
  386    HD2  TYR  48           2HD      TYR  48   4.337   8.895  -1.688
  387    HE1  TYR  48           1HE      TYR  48   1.787   4.630  -1.572
  388    HE2  TYR  48           2HE      TYR  48   2.232   8.593  -3.081
  389    HH   TYR  48           HH       TYR  48   0.812   7.087  -3.889
  390    H    ALA  49           H        ALA  49   8.501   4.815  -0.176
  391    HA   ALA  49           HA       ALA  49   7.339   2.862  -1.937
  392   1HB   ALA  49          1HB       ALA  49   9.561   2.434  -1.965
  393   2HB   ALA  49          2HB       ALA  49   9.833   3.286  -0.425
  394   3HB   ALA  49          3HB       ALA  49   9.280   1.594  -0.421
  395    H    MET  50           H        MET  50   6.736   0.654  -1.150
  396    HA   MET  50           HA       MET  50   5.151   0.971   1.243
  397   1HB   MET  50          1HB       MET  50   5.196  -0.867  -1.163
  398   2HB   MET  50          2HB       MET  50   4.472  -1.492   0.305
  399   1HG   MET  50          1HG       MET  50   2.595  -0.242   0.004
  400   2HG   MET  50          2HG       MET  50   3.529   1.230  -0.173
  401   1HE   MET  50          1HE       MET  50   1.299  -1.212  -1.651
  402   2HE   MET  50          2HE       MET  50   0.778   0.471  -1.903
  403   3HE   MET  50          3HE       MET  50   1.104  -0.578  -3.303
  404    H    GLY  51           H        GLY  51   4.900  -1.315   2.504
  405   1HA   GLY  51          1HA       GLY  51   7.093  -3.046   2.669
  406   2HA   GLY  51          2HA       GLY  51   7.353  -1.744   3.814
  407    H    PHE  52           H        PHE  52   6.255  -4.818   3.674
  408    HA   PHE  52           HA       PHE  52   3.762  -4.660   4.978
  409   1HB   PHE  52          1HB       PHE  52   4.034  -7.044   5.028
  410   2HB   PHE  52          2HB       PHE  52   5.030  -6.583   3.662
  411    HD1  PHE  52           1HD      PHE  52   4.955  -8.278   6.778
  412    HD2  PHE  52           2HD      PHE  52   7.547  -6.214   4.126
  413    HE1  PHE  52           1HE      PHE  52   6.935  -9.395   7.843
  414    HE2  PHE  52           2HE      PHE  52   9.526  -7.331   5.191
  415    HZ   PHE  52           HZ       PHE  52   9.197  -8.908   7.037
  416    H    ASP  53           H        ASP  53   3.298  -4.156   7.065
  417    HA   ASP  53           HA       ASP  53   5.542  -4.073   8.892
  418   1HB   ASP  53          1HB       ASP  53   3.615  -2.223   8.412
  419   2HB   ASP  53          2HB       ASP  53   2.790  -3.131   9.664
  420    H    ASP  54           H        ASP  54   4.654  -4.562  11.346
  421    HA   ASP  54           HA       ASP  54   4.031  -7.264  11.359
  422   1HB   ASP  54          1HB       ASP  54   4.712  -5.190  13.250
  423   2HB   ASP  54          2HB       ASP  54   3.314  -6.040  13.877
  424    H    THR  55           H        THR  55   2.136  -4.245  12.017
  425    HA   THR  55           HA       THR  55  -0.294  -5.455  11.187
  426    HB   THR  55           HB       THR  55   0.171  -6.377  13.594
  427    HG1  THR  55           1HG      THR  55  -2.009  -6.555  13.269
  428   1HG2  THR  55          1HG2      THR  55  -0.882  -3.585  14.277
  429   2HG2  THR  55          2HG2      THR  55  -0.516  -4.902  15.417
  430   3HG2  THR  55          3HG2      THR  55   0.805  -4.084  14.549
  431    H    VAL  56           H        VAL  56  -2.204  -3.828  11.982
  432    HA   VAL  56           HA       VAL  56  -1.335  -1.315  10.887
  433    HB   VAL  56           HB       VAL  56  -3.522  -2.714  10.500
  434   1HG1  VAL  56          1HG1      VAL  56  -4.315  -2.804  12.774
  435   2HG1  VAL  56          2HG1      VAL  56  -4.239  -1.032  12.923
  436   3HG1  VAL  56          3HG1      VAL  56  -5.427  -1.784  11.831
  437   1HG2  VAL  56          1HG2      VAL  56  -3.890  -0.960   9.177
  438   2HG2  VAL  56          2HG2      VAL  56  -4.508  -0.037  10.568
  439   3HG2  VAL  56          3HG2      VAL  56  -2.777   0.026  10.156
  440    H    GLU  57           H        GLU  57  -1.772   0.778  11.944
  441    HA   GLU  57           HA       GLU  57  -0.957   0.630  14.665
  442   1HB   GLU  57          1HB       GLU  57  -1.760   3.155  13.179
  443   2HB   GLU  57          2HB       GLU  57  -0.627   2.999  14.507
  444   1HG   GLU  57          1HG       GLU  57   0.856   1.588  13.003
  445   2HG   GLU  57          2HG       GLU  57  -0.247   1.907  11.679
  446    H    GLU  58           H        GLU  58  -2.116   2.289  16.267
  447    HA   GLU  58           HA       GLU  58  -4.835   1.387  16.348
  448   1HB   GLU  58          1HB       GLU  58  -3.052   1.613  18.310
  449   2HB   GLU  58          2HB       GLU  58  -3.627   3.267  18.381
  450   1HG   GLU  58          1HG       GLU  58  -5.702   2.664  19.193
  451   2HG   GLU  58          2HG       GLU  58  -5.779   1.205  18.225
  452    H    GLY  59           H        GLY  59  -3.881   3.396  14.280
  453   1HA   GLY  59          1HA       GLY  59  -6.118   5.049  14.217
  454   2HA   GLY  59          2HA       GLY  59  -4.829   5.970  14.968
  455    H    ASP  60           H        ASP  60  -5.008   3.545  12.253
  456    HA   ASP  60           HA       ASP  60  -3.607   5.538  10.649
  457   1HB   ASP  60          1HB       ASP  60  -2.643   3.047  11.397
  458   2HB   ASP  60          2HB       ASP  60  -3.375   2.678   9.848
  459    H    HIS  61           H        HIS  61  -4.519   5.908   8.566
  460    HA   HIS  61           HA       HIS  61  -7.157   5.059   8.160
  461   1HB   HIS  61          1HB       HIS  61  -5.230   6.846   6.918
  462   2HB   HIS  61          2HB       HIS  61  -6.156   5.982   5.706
  463    HD1  HIS  61           1HD      HIS  61  -6.690   8.243   8.734
  464    HD2  HIS  61           2HD      HIS  61  -8.734   6.904   5.324
  465    HE1  HIS  61           1HE      HIS  61  -8.849   9.599   8.616
  466    H    VAL  62           H        VAL  62  -7.476   2.849   8.007
  467    HA   VAL  62           HA       VAL  62  -5.704   1.239   6.444
  468    HB   VAL  62           HB       VAL  62  -7.448   0.845   8.536
  469   1HG1  VAL  62          1HG1      VAL  62  -9.409   0.790   7.124
  470   2HG1  VAL  62          2HG1      VAL  62  -8.646  -0.394   6.037
  471   3HG1  VAL  62          3HG1      VAL  62  -9.070  -0.859   7.702
  472   1HG2  VAL  62          1HG2      VAL  62  -5.649  -0.753   6.862
  473   2HG2  VAL  62          2HG2      VAL  62  -5.862  -0.740   8.629
  474   3HG2  VAL  62          3HG2      VAL  62  -6.947  -1.715   7.608
  475    H    PHE  63           H        PHE  63  -5.717   1.178   4.262
  476    HA   PHE  63           HA       PHE  63  -8.303   1.661   2.956
  477   1HB   PHE  63          1HB       PHE  63  -6.202   3.274   2.747
  478   2HB   PHE  63          2HB       PHE  63  -5.488   1.993   1.787
  479    HD1  PHE  63           1HD      PHE  63  -8.881   3.568   1.921
  480    HD2  PHE  63           2HD      PHE  63  -5.538   2.479  -0.456
  481    HE1  PHE  63           1HE      PHE  63 -10.046   4.448  -0.121
  482    HE2  PHE  63           2HE      PHE  63  -6.703   3.360  -2.498
  483    HZ   PHE  63           HZ       PHE  63  -8.942   4.334  -2.306
  484    H    GLU  64           H        GLU  64  -9.154  -0.083   1.933
  485    HA   GLU  64           HA       GLU  64  -7.605  -2.429   1.695
  486   1HB   GLU  64          1HB       GLU  64 -10.377  -1.763   0.610
  487   2HB   GLU  64          2HB       GLU  64  -9.680  -3.370   0.657
  488   1HG   GLU  64          1HG       GLU  64  -9.509  -3.249   3.135
  489   2HG   GLU  64          2HG       GLU  64 -10.139  -1.614   3.115
  490    H    TYR  65           H        TYR  65  -6.394  -3.149  -0.019
  491    HA   TYR  65           HA       TYR  65  -6.486  -1.512  -2.445
  492   1HB   TYR  65          1HB       TYR  65  -4.545  -3.302  -0.929
  493   2HB   TYR  65          2HB       TYR  65  -4.311  -3.168  -2.660
  494    HD1  TYR  65           1HD      TYR  65  -5.257  -0.640  -0.045
  495    HD2  TYR  65           2HD      TYR  65  -2.477  -1.809  -3.080
  496    HE1  TYR  65           1HE      TYR  65  -3.967   1.525   0.291
  497    HE2  TYR  65           2HE      TYR  65  -1.197   0.360  -2.733
  498    HH   TYR  65           HH       TYR  65  -2.487   2.942  -0.919
  499    H    ASP  66           H        ASP  66  -5.340  -3.275  -4.274
  500    HA   ASP  66           HA       ASP  66  -7.595  -4.701  -5.055
  501   1HB   ASP  66          1HB       ASP  66  -5.445  -3.776  -6.362
  502   2HB   ASP  66          2HB       ASP  66  -4.833  -5.393  -6.073
  503    H    GLY  67           H        GLY  67  -7.789  -5.942  -2.878
  504   1HA   GLY  67          1HA       GLY  67  -7.838  -8.024  -1.971
  505   2HA   GLY  67          2HA       GLY  67  -6.746  -8.602  -3.213
  506    H    VAL  68           H        VAL  68  -6.119  -5.743  -1.132
  507    HA   VAL  68           HA       VAL  68  -4.392  -7.263   0.601
  508    HB   VAL  68           HB       VAL  68  -3.268  -5.174  -1.276
  509   1HG1  VAL  68          1HG1      VAL  68  -1.070  -5.983  -0.243
  510   2HG1  VAL  68          2HG1      VAL  68  -2.105  -4.946   0.767
  511   3HG1  VAL  68          3HG1      VAL  68  -2.069  -6.704   1.042
  512   1HG2  VAL  68          1HG2      VAL  68  -3.619  -7.226  -2.488
  513   2HG2  VAL  68          2HG2      VAL  68  -1.882  -7.077  -2.130
  514   3HG2  VAL  68          3HG2      VAL  68  -2.895  -8.184  -1.173
  515    H    LYS  69           H        LYS  69  -3.525  -5.858   2.375
  516    HA   LYS  69           HA       LYS  69  -5.433  -3.694   2.857
  517   1HB   LYS  69          1HB       LYS  69  -4.349  -5.836   4.466
  518   2HB   LYS  69          2HB       LYS  69  -3.979  -4.292   5.206
  519   1HG   LYS  69          1HG       LYS  69  -6.630  -3.955   4.370
  520   2HG   LYS  69          2HG       LYS  69  -6.593  -5.634   4.871
  521   1HD   LYS  69          1HD       LYS  69  -5.408  -4.801   7.029
  522   2HD   LYS  69          2HD       LYS  69  -5.871  -3.185   6.532
  523   1HE   LYS  69          1HE       LYS  69  -7.903  -3.530   7.481
  524   2HE   LYS  69          2HE       LYS  69  -8.234  -4.731   6.248
  525   1HZ   LYS  69          1HZ       LYS  69  -7.622  -6.413   7.629
  526   2HZ   LYS  69          2HZ       LYS  69  -6.626  -5.499   8.545
  527   3HZ   LYS  69          3HZ       LYS  69  -8.245  -5.374   8.725
  528    H    VAL  70           H        VAL  70  -4.645  -1.679   3.838
  529    HA   VAL  70           HA       VAL  70  -1.809  -1.199   3.698
  530    HB   VAL  70           HB       VAL  70  -3.768  -0.042   1.730
  531   1HG1  VAL  70          1HG1      VAL  70  -1.110   1.155   2.577
  532   2HG1  VAL  70          2HG1      VAL  70  -2.025   1.633   1.127
  533   3HG1  VAL  70          3HG1      VAL  70  -2.722   1.891   2.744
  534   1HG2  VAL  70          1HG2      VAL  70  -1.490  -0.452   0.357
  535   2HG2  VAL  70          2HG2      VAL  70  -1.280  -1.674   1.634
  536   3HG2  VAL  70          3HG2      VAL  70  -2.723  -1.714   0.592
  537    H    VAL  71           H        VAL  71  -1.298   1.041   4.529
  538    HA   VAL  71           HA       VAL  71  -3.494   2.299   5.945
  539    HB   VAL  71           HB       VAL  71  -2.701   1.992   8.076
  540   1HG1  VAL  71          1HG1      VAL  71  -2.122  -0.451   8.339
  541   2HG1  VAL  71          2HG1      VAL  71  -3.579  -0.118   7.373
  542   3HG1  VAL  71          3HG1      VAL  71  -2.056  -0.555   6.563
  543   1HG2  VAL  71          1HG2      VAL  71  -0.421   2.720   7.775
  544   2HG2  VAL  71          2HG2      VAL  71  -0.407   1.155   8.622
  545   3HG2  VAL  71          3HG2      VAL  71  -0.014   1.232   6.888
  546    H    ILE  72           H        ILE  72  -3.332   4.412   5.427
  547    HA   ILE  72           HA       ILE  72  -0.702   5.414   4.676
  548    HB   ILE  72           HB       ILE  72  -3.311   6.883   4.435
  549   1HG1  ILE  72          1HG1      ILE  72  -2.218   4.969   2.358
  550   2HG1  ILE  72          2HG1      ILE  72  -3.503   4.552   3.474
  551   1HG2  ILE  72          1HG2      ILE  72  -2.198   8.013   2.604
  552   2HG2  ILE  72          2HG2      ILE  72  -1.207   8.121   4.079
  553   3HG2  ILE  72          3HG2      ILE  72  -0.766   6.972   2.792
  554   1HD1  ILE  72          1HD1      ILE  72  -4.950   6.294   2.603
  555   2HD1  ILE  72          2HD1      ILE  72  -3.621   6.990   1.645
  556   3HD1  ILE  72          3HD1      ILE  72  -4.293   5.401   1.210
  557    H    ASP  73           H        ASP  73   0.367   7.058   5.772
  558    HA   ASP  73           HA       ASP  73  -0.379   7.326   8.481
  559   1HB   ASP  73          1HB       ASP  73   1.861   8.198   6.704
  560   2HB   ASP  73          2HB       ASP  73   1.573   9.231   8.089
  561    HA   PRO  74           HA       PRO  74  -2.470  11.166   8.142
  562   1HB   PRO  74          1HB       PRO  74  -1.889  12.410  10.504
  563   2HB   PRO  74          2HB       PRO  74  -3.095  11.147  10.358
  564   1HG   PRO  74          1HG       PRO  74  -0.378  10.991  11.514
  565   2HG   PRO  74          2HG       PRO  74  -1.729   9.897  11.733
  566   1HD   PRO  74          1HD       PRO  74   0.569   9.475  10.070
  567   2HD   PRO  74          2HD       PRO  74  -0.835   8.435  10.200
  568    H    PHE  75           H        PHE  75   0.925  11.241   8.645
  569    HA   PHE  75           HA       PHE  75   1.037  14.041   7.917
  570   1HB   PHE  75          1HB       PHE  75   2.837  11.826   8.924
  571   2HB   PHE  75          2HB       PHE  75   3.627  13.083   7.991
  572    HD1  PHE  75           1HD      PHE  75   3.416  15.483   8.778
  573    HD2  PHE  75           2HD      PHE  75   2.253  12.182  11.178
  574    HE1  PHE  75           1HE      PHE  75   3.525  16.932  10.824
  575    HE2  PHE  75           2HE      PHE  75   2.362  13.632  13.224
  576    HZ   PHE  75           HZ       PHE  75   2.997  15.989  13.023
  577    H    SER  76           H        SER  76   1.463  10.811   6.500
  578    HA   SER  76           HA       SER  76   2.761  11.924   4.193
  579   1HB   SER  76          1HB       SER  76   3.418   9.694   5.121
  580   2HB   SER  76          2HB       SER  76   1.817   9.079   4.762
  581    HG   SER  76           HG       SER  76   2.270   9.691   2.463
  582    H    MET  77           H        MET  77  -0.443  11.255   5.370
  583    HA   MET  77           HA       MET  77  -1.745  10.562   3.055
  584   1HB   MET  77          1HB       MET  77  -2.373  11.362   5.743
  585   2HB   MET  77          2HB       MET  77  -3.331  12.397   4.702
  586   1HG   MET  77          1HG       MET  77  -3.243   9.417   4.149
  587   2HG   MET  77          2HG       MET  77  -4.264  10.018   5.440
  588   1HE   MET  77          1HE       MET  77  -5.070  10.014   1.051
  589   2HE   MET  77          2HE       MET  77  -3.472  10.664   1.489
  590   3HE   MET  77          3HE       MET  77  -3.961   9.049   2.054
  591    HA   PRO  78           HA       PRO  78  -2.269  15.211   2.261
  592   1HB   PRO  78          1HB       PRO  78  -0.853  17.021   3.740
  593   2HB   PRO  78          2HB       PRO  78  -2.505  16.567   4.107
  594   1HG   PRO  78          1HG       PRO  78  -0.014  15.768   5.484
  595   2HG   PRO  78          2HG       PRO  78  -1.665  15.684   6.065
  596   1HD   PRO  78          1HD       PRO  78  -0.072  13.502   5.102
  597   2HD   PRO  78          2HD       PRO  78  -1.758  13.440   5.574
  598    H    TYR  79           H        TYR  79   0.398  13.406   2.377
  599    HA   TYR  79           HA       TYR  79   2.006  15.304   0.844
  600   1HB   TYR  79          1HB       TYR  79   2.482  13.373   2.835
  601   2HB   TYR  79          2HB       TYR  79   2.866  12.474   1.381
  602    HD1  TYR  79           1HD      TYR  79   4.342  14.036  -0.368
  603    HD2  TYR  79           2HD      TYR  79   4.300  14.324   3.900
  604    HE1  TYR  79           1HE      TYR  79   6.650  15.101  -0.410
  605    HE2  TYR  79           2HE      TYR  79   6.608  15.389   3.844
  606    HH   TYR  79           HH       TYR  79   8.642  15.155   1.519
  607    H    VAL  80           H        VAL  80   0.055  12.350   0.556
  608    HA   VAL  80           HA       VAL  80   0.549  12.444  -2.325
  609    HB   VAL  80           HB       VAL  80   0.722  10.043  -2.434
  610   1HG1  VAL  80          1HG1      VAL  80   2.667  11.765  -1.319
  611   2HG1  VAL  80          2HG1      VAL  80   2.765  10.240  -0.405
  612   3HG1  VAL  80          3HG1      VAL  80   2.930  10.228  -2.177
  613   1HG2  VAL  80          1HG2      VAL  80  -0.572  10.007  -0.001
  614   2HG2  VAL  80          2HG2      VAL  80   0.201   8.608  -0.784
  615   3HG2  VAL  80          3HG2      VAL  80   1.090   9.545   0.440
  616    H    ASN  81           H        ASN  81  -1.572  13.642  -0.800
  617    HA   ASN  81           HA       ASN  81  -3.757  11.859  -0.753
  618   1HB   ASN  81          1HB       ASN  81  -3.581  13.919   0.690
  619   2HB   ASN  81          2HB       ASN  81  -3.694  14.924  -0.742
  620   1HD2  ASN  81          1HD2      ASN  81  -5.595  15.779  -1.015
  621   2HD2  ASN  81          2HD2      ASN  81  -7.135  15.068  -0.664
  622    H    GLY  82           H        GLY  82  -5.619  11.898  -2.244
  623   1HA   GLY  82          1HA       GLY  82  -6.474  11.826  -4.331
  624   2HA   GLY  82          2HA       GLY  82  -6.096  13.537  -4.356
  625    H    ALA  83           H        ALA  83  -3.988  10.573  -4.362
  626    HA   ALA  83           HA       ALA  83  -3.192  11.099  -7.075
  627   1HB   ALA  83          1HB       ALA  83  -1.768  12.344  -4.963
  628   2HB   ALA  83          2HB       ALA  83  -0.766  10.973  -5.497
  629   3HB   ALA  83          3HB       ALA  83  -1.281  12.209  -6.670
  630    H    GLU  84           H        GLU  84  -2.015   9.290  -7.983
  631    HA   GLU  84           HA       GLU  84  -2.379   6.920  -6.341
  632   1HB   GLU  84          1HB       GLU  84  -2.347   5.674  -8.492
  633   2HB   GLU  84          2HB       GLU  84  -3.595   6.904  -8.471
  634   1HG   GLU  84          1HG       GLU  84  -2.472   8.282  -9.999
  635   2HG   GLU  84          2HG       GLU  84  -0.888   7.685  -9.544
  636    H    LEU  85           H        LEU  85  -0.699   5.102  -6.776
  637    HA   LEU  85           HA       LEU  85   1.950   6.334  -7.089
  638   1HB   LEU  85          1HB       LEU  85   2.090   5.922  -4.890
  639   2HB   LEU  85          2HB       LEU  85   0.806   4.730  -4.906
  640    HG   LEU  85           HG       LEU  85   2.463   3.112  -5.948
  641   1HD1  LEU  85          1HD1      LEU  85   4.028   5.288  -6.360
  642   2HD1  LEU  85          2HD1      LEU  85   4.735   4.652  -4.855
  643   3HD1  LEU  85          3HD1      LEU  85   4.628   3.613  -6.296
  644   1HD2  LEU  85          1HD2      LEU  85   3.657   3.728  -3.339
  645   2HD2  LEU  85          2HD2      LEU  85   1.877   3.685  -3.330
  646   3HD2  LEU  85          3HD2      LEU  85   2.799   2.274  -3.902
  647    H    ASP  86           H        ASP  86   2.656   5.711  -9.069
  648    HA   ASP  86           HA       ASP  86   1.941   3.045  -9.934
  649   1HB   ASP  86          1HB       ASP  86   2.506   3.768 -12.146
  650   2HB   ASP  86          2HB       ASP  86   1.655   5.114 -11.416
  651    H    TYR  87           H        TYR  87   3.525   1.408 -10.070
  652    HA   TYR  87           HA       TYR  87   6.140   2.048  -9.019
  653   1HB   TYR  87          1HB       TYR  87   4.397  -0.024  -8.722
  654   2HB   TYR  87          2HB       TYR  87   5.197  -0.619 -10.164
  655    HD1  TYR  87           1HD      TYR  87   6.236   0.908  -6.884
  656    HD2  TYR  87           2HD      TYR  87   6.878  -2.163  -9.794
  657    HE1  TYR  87           1HE      TYR  87   8.099  -0.068  -5.455
  658    HE2  TYR  87           2HE      TYR  87   8.738  -3.127  -8.355
  659    HH   TYR  87           HH       TYR  87   9.209  -2.147  -5.124
  660    H    VAL  88           H        VAL  88   8.007   2.249 -10.179
  661    HA   VAL  88           HA       VAL  88   7.765   1.838 -13.065
  662    HB   VAL  88           HB       VAL  88   9.606   3.486 -11.333
  663   1HG1  VAL  88          1HG1      VAL  88  10.756   4.212 -13.357
  664   2HG1  VAL  88          2HG1      VAL  88  10.905   2.449 -13.165
  665   3HG1  VAL  88          3HG1      VAL  88   9.755   3.122 -14.345
  666   1HG2  VAL  88          1HG2      VAL  88   8.534   5.361 -12.189
  667   2HG2  VAL  88          2HG2      VAL  88   7.932   4.495 -13.622
  668   3HG2  VAL  88          3HG2      VAL  88   7.191   4.204 -12.030
  669    H    VAL  89           H        VAL  89   9.330   0.605 -14.222
  670    HA   VAL  89           HA       VAL  89  11.063  -1.031 -12.509
  671    HB   VAL  89           HB       VAL  89   9.527  -2.050 -14.899
  672   1HG1  VAL  89          1HG1      VAL  89  11.702  -3.085 -13.396
  673   2HG1  VAL  89          2HG1      VAL  89  10.267  -4.048 -12.971
  674   3HG1  VAL  89          3HG1      VAL  89  10.761  -3.892 -14.674
  675   1HG2  VAL  89          1HG2      VAL  89   8.818  -2.287 -11.956
  676   2HG2  VAL  89          2HG2      VAL  89   7.904  -1.406 -13.203
  677   3HG2  VAL  89          3HG2      VAL  89   8.031  -3.180 -13.279
  678    H    ASP  90           H        ASP  90  13.122  -0.490 -13.009
  679    HA   ASP  90           HA       ASP  90  13.953  -0.702 -15.696
  680   1HB   ASP  90          1HB       ASP  90  12.996   1.781 -15.160
  681   2HB   ASP  90          2HB       ASP  90  14.616   1.989 -14.524
  682    H    PHE  91           H        PHE  91  16.305   1.190 -15.083
  683    HA   PHE  91           HA       PHE  91  18.031  -0.639 -13.954
  684   1HB   PHE  91          1HB       PHE  91  18.185   1.759 -15.257
  685   2HB   PHE  91          2HB       PHE  91  18.412   2.358 -13.626
  686    HD1  PHE  91           1HD      PHE  91  19.850   0.260 -16.273
  687    HD2  PHE  91           2HD      PHE  91  20.446   1.923 -12.415
  688    HE1  PHE  91           1HE      PHE  91  22.287  -0.328 -16.396
  689    HE2  PHE  91           2HE      PHE  91  22.884   1.335 -12.538
  690    HZ   PHE  91           HZ       PHE  91  23.775   0.217 -14.527
  691    H    MET  92           H        MET  92  15.623   1.308 -12.416
  692    HA   MET  92           HA       MET  92  17.060   1.440  -9.933
  693   1HB   MET  92          1HB       MET  92  14.722   2.697 -11.185
  694   2HB   MET  92          2HB       MET  92  14.292   2.114  -9.590
  695   1HG   MET  92          1HG       MET  92  15.698   3.605  -8.505
  696   2HG   MET  92          2HG       MET  92  16.917   3.542  -9.763
  697   1HE   MET  92          1HE       MET  92  16.103   6.339  -8.429
  698   2HE   MET  92          2HE       MET  92  17.340   6.002  -9.663
  699   3HE   MET  92          3HE       MET  92  16.145   7.293  -9.931
  700    H    GLY  93           H        GLY  93  16.066  -1.167 -11.365
  701   1HA   GLY  93          1HA       GLY  93  14.993  -3.091 -10.836
  702   2HA   GLY  93          2HA       GLY  93  15.760  -2.833  -9.281
  703    H    GLY  94           H        GLY  94  12.771  -2.319 -11.192
  704   1HA   GLY  94          1HA       GLY  94  10.686  -1.673 -10.545
  705   2HA   GLY  94          2HA       GLY  94  10.912  -2.992  -9.414
  706    H    GLY  95           H        GLY  95  11.053   0.545  -9.861
  707   1HA   GLY  95          1HA       GLY  95  11.342   0.878  -6.941
  708   2HA   GLY  95          2HA       GLY  95  11.765   2.067  -8.157
  709    H    PHE  96           H        PHE  96  10.295   3.368  -6.578
  710    HA   PHE  96           HA       PHE  96   7.496   2.990  -7.376
  711   1HB   PHE  96          1HB       PHE  96   8.741   4.511  -5.010
  712   2HB   PHE  96          2HB       PHE  96   7.033   4.182  -5.224
  713    HD1  PHE  96           1HD      PHE  96  10.302   2.487  -4.723
  714    HD2  PHE  96           2HD      PHE  96   6.084   2.243  -4.329
  715    HE1  PHE  96           1HE      PHE  96  10.548   0.358  -3.417
  716    HE2  PHE  96           2HE      PHE  96   6.330   0.114  -3.022
  717    HZ   PHE  96           HZ       PHE  96   8.558  -0.803  -2.582
  718    H    THR  97           H        THR  97   6.275   4.810  -8.072
  719    HA   THR  97           HA       THR  97   7.670   7.353  -8.288
  720    HB   THR  97           HB       THR  97   6.823   5.587 -10.627
  721    HG1  THR  97           1HG      THR  97   9.116   7.299  -9.976
  722   1HG2  THR  97          1HG2      THR  97   6.533   7.400 -12.005
  723   2HG2  THR  97          2HG2      THR  97   6.268   8.337 -10.515
  724   3HG2  THR  97          3HG2      THR  97   7.888   8.276 -11.251
  725    H    ILE  98           H        ILE  98   6.310   9.139  -8.384
  726    HA   ILE  98           HA       ILE  98   3.523   8.463  -7.815
  727    HB   ILE  98           HB       ILE  98   5.159  10.934  -7.240
  728   1HG1  ILE  98          1HG1      ILE  98   5.772   9.059  -5.825
  729   2HG1  ILE  98          2HG1      ILE  98   4.910  10.268  -4.895
  730   1HG2  ILE  98          1HG2      ILE  98   2.236  10.431  -7.162
  731   2HG2  ILE  98          2HG2      ILE  98   2.941  11.261  -5.754
  732   3HG2  ILE  98          3HG2      ILE  98   3.143  11.946  -7.384
  733   1HD1  ILE  98          1HD1      ILE  98   2.779   8.924  -5.243
  734   2HD1  ILE  98          2HD1      ILE  98   3.779   7.654  -5.987
  735   3HD1  ILE  98          3HD1      ILE  98   4.024   8.094  -4.280
  736    H    ARG  99           H        ARG  99   1.832   9.215  -9.074
  737    HA   ARG  99           HA       ARG  99   2.686  10.720 -11.416
  738   1HB   ARG  99          1HB       ARG  99   1.944   8.251 -11.751
  739   2HB   ARG  99          2HB       ARG  99   0.327   8.785 -11.341
  740   1HG   ARG  99          1HG       ARG  99   1.148  10.675 -13.242
  741   2HG   ARG  99          2HG       ARG  99   1.859   9.188 -13.836
  742   1HD   ARG  99          1HD       ARG  99  -0.981   8.980 -12.901
  743   2HD   ARG  99          2HD       ARG  99  -0.727   9.938 -14.346
  744    HE   ARG  99           HE       ARG  99   0.682   7.370 -14.411
  745   1HH1  ARG  99          2HH2      ARG  99  -2.365   8.999 -15.076
  746   2HH1  ARG  99          1HH2      ARG  99  -2.891   7.819 -16.230
  747   1HH2  ARG  99          2HH1      ARG  99  -0.010   5.813 -15.933
  748   2HH2  ARG  99          1HH1      ARG  99  -1.542   5.995 -16.721
  749    H    ASN 100           H        ASN 100   1.988  12.815 -10.997
  750    HA   ASN 100           HA       ASN 100  -0.339  13.257  -9.453
  751   1HB   ASN 100          1HB       ASN 100   1.904  14.740  -9.995
  752   2HB   ASN 100          2HB       ASN 100   0.804  15.463 -11.151
  753   1HD2  ASN 100          1HD2      ASN 100   1.654  15.054  -7.844
  754   2HD2  ASN 100          2HD2      ASN 100   0.497  16.127  -7.130
  755    HA   PRO 101           HA       PRO 101  -3.006  13.242 -12.965
  756   1HB   PRO 101          1HB       PRO 101  -5.328  13.967 -11.720
  757   2HB   PRO 101          2HB       PRO 101  -4.732  12.319 -11.753
  758   1HG   PRO 101          1HG       PRO 101  -4.703  14.256  -9.520
  759   2HG   PRO 101          2HG       PRO 101  -4.516  12.515  -9.465
  760   1HD   PRO 101          1HD       PRO 101  -2.434  14.474  -9.227
  761   2HD   PRO 101          2HD       PRO 101  -2.234  12.734  -9.289
  Start of MODEL    7
    1    H    MET   1           H        MET   1 -19.399   0.468  14.054
    2    HA   MET   1           HA       MET   1 -20.303   1.034  16.767
    3   1HB   MET   1          1HB       MET   1 -20.480  -1.458  15.145
    4   2HB   MET   1          2HB       MET   1 -19.732  -1.721  16.708
    5   1HG   MET   1          1HG       MET   1 -21.670  -0.781  17.875
    6   2HG   MET   1          2HG       MET   1 -22.386  -0.248  16.367
    7   1HE   MET   1          1HE       MET   1 -24.764  -1.792  17.057
    8   2HE   MET   1          2HE       MET   1 -24.441  -3.308  17.933
    9   3HE   MET   1          3HE       MET   1 -23.754  -1.775  18.523
   10    H    GLN   2           H        GLN   2 -18.264   2.292  16.891
   11    HA   GLN   2           HA       GLN   2 -16.260   2.466  17.744
   12   1HB   GLN   2          1HB       GLN   2 -16.878  -0.223  18.413
   13   2HB   GLN   2          2HB       GLN   2 -15.262  -0.276  17.736
   14   1HG   GLN   2          1HG       GLN   2 -14.416   1.304  19.343
   15   2HG   GLN   2          2HG       GLN   2 -16.026   1.799  19.827
   16   1HE2  GLN   2          1HE2      GLN   2 -17.392   0.260  20.916
   17   2HE2  GLN   2          2HE2      GLN   2 -16.705  -0.962  21.933
   18    H    GLU   3           H        GLU   3 -16.217   3.290  15.358
   19    HA   GLU   3           HA       GLU   3 -13.987   1.925  14.096
   20   1HB   GLU   3          1HB       GLU   3 -16.663   2.569  12.880
   21   2HB   GLU   3          2HB       GLU   3 -15.245   2.749  11.865
   22   1HG   GLU   3          1HG       GLU   3 -14.587   0.354  12.696
   23   2HG   GLU   3          2HG       GLU   3 -16.245   0.235  13.253
   24    H    GLN   4           H        GLN   4 -12.549   3.335  12.910
   25    HA   GLN   4           HA       GLN   4 -13.121   6.156  13.388
   26   1HB   GLN   4          1HB       GLN   4 -11.184   4.839  14.714
   27   2HB   GLN   4          2HB       GLN   4 -10.276   5.186  13.256
   28   1HG   GLN   4          1HG       GLN   4 -11.854   7.419  14.549
   29   2HG   GLN   4          2HG       GLN   4 -10.338   6.930  15.278
   30   1HE2  GLN   4          1HE2      GLN   4 -11.103   9.413  13.946
   31   2HE2  GLN   4          2HE2      GLN   4  -9.982   9.673  12.652
   32    H    ALA   5           H        ALA   5 -12.419   7.655  11.741
   33    HA   ALA   5           HA       ALA   5 -12.717   6.758   9.146
   34   1HB   ALA   5          1HB       ALA   5 -13.105   9.061   9.770
   35   2HB   ALA   5          2HB       ALA   5 -11.415   9.256  10.294
   36   3HB   ALA   5          3HB       ALA   5 -11.791   9.033   8.569
   37    H    GLN   6           H        GLN   6 -11.433   5.105   8.381
   38    HA   GLN   6           HA       GLN   6  -8.584   5.714   8.362
   39   1HB   GLN   6          1HB       GLN   6  -7.993   3.485   8.895
   40   2HB   GLN   6          2HB       GLN   6  -9.306   3.845   9.999
   41   1HG   GLN   6          1HG       GLN   6 -10.692   2.881   7.799
   42   2HG   GLN   6          2HG       GLN   6  -9.220   1.934   7.720
   43   1HE2  GLN   6          1HE2      GLN   6 -11.259   0.455   8.126
   44   2HE2  GLN   6          2HE2      GLN   6 -11.476  -0.054   9.767
   45    H    GLN   7           H        GLN   7 -10.389   6.500   6.332
   46    HA   GLN   7           HA       GLN   7  -9.657   4.595   4.247
   47   1HB   GLN   7          1HB       GLN   7 -12.058   4.473   4.511
   48   2HB   GLN   7          2HB       GLN   7 -12.212   6.217   4.562
   49   1HG   GLN   7          1HG       GLN   7 -11.259   6.272   2.180
   50   2HG   GLN   7          2HG       GLN   7 -11.387   4.525   2.160
   51   1HE2  GLN   7          1HE2      GLN   7 -13.014   4.015   0.905
   52   2HE2  GLN   7          2HE2      GLN   7 -14.620   4.661   0.961
   53    H    PHE   8           H        PHE   8  -7.947   5.511   3.178
   54    HA   PHE   8           HA       PHE   8  -7.986   8.409   2.825
   55   1HB   PHE   8          1HB       PHE   8  -5.567   8.040   2.353
   56   2HB   PHE   8          2HB       PHE   8  -5.989   7.216   3.841
   57    HD1  PHE   8           1HD      PHE   8  -5.748   6.557   0.175
   58    HD2  PHE   8           2HD      PHE   8  -5.346   5.011   4.106
   59    HE1  PHE   8           1HE      PHE   8  -4.851   4.408  -0.762
   60    HE2  PHE   8           2HE      PHE   8  -4.449   2.862   3.170
   61    HZ   PHE   8           HZ       PHE   8  -4.212   2.586   0.747
   62    H    ILE   9           H        ILE   9  -7.989   9.384   0.792
   63    HA   ILE   9           HA       ILE   9  -8.783   7.637  -1.374
   64    HB   ILE   9           HB       ILE   9  -8.791  10.606  -0.917
   65   1HG1  ILE   9          1HG1      ILE   9 -10.584   8.898  -0.070
   66   2HG1  ILE   9          2HG1      ILE   9 -11.074  10.428  -0.770
   67   1HG2  ILE   9          1HG2      ILE   9  -8.202  10.671  -3.140
   68   2HG2  ILE   9          2HG2      ILE   9  -8.989   9.119  -3.512
   69   3HG2  ILE   9          3HG2      ILE   9  -9.976  10.576  -3.252
   70   1HD1  ILE   9          1HD1      ILE   9 -11.609   9.410  -2.890
   71   2HD1  ILE   9          2HD1      ILE   9 -10.798   7.892  -2.436
   72   3HD1  ILE   9          3HD1      ILE   9 -12.317   8.363  -1.636
   73    H    PHE  10           H        PHE  10  -7.213   6.646  -2.524
   74    HA   PHE  10           HA       PHE  10  -5.192   8.267  -3.729
   75   1HB   PHE  10          1HB       PHE  10  -4.014   7.858  -1.651
   76   2HB   PHE  10          2HB       PHE  10  -4.689   6.249  -1.492
   77    HD1  PHE  10           1HD      PHE  10  -3.436   4.401  -2.145
   78    HD2  PHE  10           2HD      PHE  10  -2.376   8.231  -3.633
   79    HE1  PHE  10           1HE      PHE  10  -1.361   3.429  -3.169
   80    HE2  PHE  10           2HE      PHE  10  -0.301   7.258  -4.657
   81    HZ   PHE  10           HZ       PHE  10   0.182   4.869  -4.413
   82    H    LYS  11           H        LYS  11  -4.506   7.364  -5.668
   83    HA   LYS  11           HA       LYS  11  -5.628   4.716  -6.240
   84   1HB   LYS  11          1HB       LYS  11  -4.928   7.016  -8.089
   85   2HB   LYS  11          2HB       LYS  11  -5.473   5.440  -8.624
   86   1HG   LYS  11          1HG       LYS  11  -7.101   7.003  -6.593
   87   2HG   LYS  11          2HG       LYS  11  -7.238   7.372  -8.301
   88   1HD   LYS  11          1HD       LYS  11  -7.880   5.035  -8.797
   89   2HD   LYS  11          2HD       LYS  11  -7.629   4.580  -7.123
   90   1HE   LYS  11          1HE       LYS  11  -9.621   5.505  -6.426
   91   2HE   LYS  11          2HE       LYS  11  -9.477   6.887  -7.495
   92   1HZ   LYS  11          1HZ       LYS  11 -10.924   5.865  -8.778
   93   2HZ   LYS  11          2HZ       LYS  11  -9.805   4.730  -9.132
   94   3HZ   LYS  11          3HZ       LYS  11 -10.863   4.481  -7.913
   95    H    VAL  12           H        VAL  12  -4.293   3.021  -6.675
   96    HA   VAL  12           HA       VAL  12  -1.466   3.684  -7.124
   97    HB   VAL  12           HB       VAL  12  -2.314   2.738  -4.800
   98   1HG1  VAL  12          1HG1      VAL  12  -1.906   0.206  -6.428
   99   2HG1  VAL  12          2HG1      VAL  12  -2.158   0.303  -4.669
  100   3HG1  VAL  12          3HG1      VAL  12  -3.460   0.785  -5.783
  101   1HG2  VAL  12          1HG2      VAL  12   0.006   1.234  -5.119
  102   2HG2  VAL  12          2HG2      VAL  12   0.162   2.523  -6.337
  103   3HG2  VAL  12          3HG2      VAL  12  -0.090   2.942  -4.625
  104    H    THR  13           H        THR  13  -0.444   2.554  -8.767
  105    HA   THR  13           HA       THR  13  -2.038   1.416 -10.753
  106    HB   THR  13           HB       THR  13   0.325   0.657 -11.566
  107    HG1  THR  13           1HG      THR  13   1.791   0.815  -9.919
  108   1HG2  THR  13          1HG2      THR  13   0.931   2.851 -12.224
  109   2HG2  THR  13          2HG2      THR  13  -0.813   3.037 -11.917
  110   3HG2  THR  13          3HG2      THR  13   0.367   3.564 -10.694
  111    H    ASP  14           H        ASP  14  -1.558  -0.863 -11.698
  112    HA   ASP  14           HA       ASP  14  -2.481  -2.650  -9.732
  113   1HB   ASP  14          1HB       ASP  14  -1.634  -2.909 -12.639
  114   2HB   ASP  14          2HB       ASP  14  -2.044  -4.335 -11.707
  115    H    LYS  15           H        LYS  15   0.635  -1.807 -11.235
  116    HA   LYS  15           HA       LYS  15   2.022  -4.164 -10.582
  117   1HB   LYS  15          1HB       LYS  15   2.523  -1.913 -12.077
  118   2HB   LYS  15          2HB       LYS  15   3.580  -1.665 -10.702
  119   1HG   LYS  15          1HG       LYS  15   4.431  -4.051 -11.025
  120   2HG   LYS  15          2HG       LYS  15   3.491  -4.130 -12.502
  121   1HD   LYS  15          1HD       LYS  15   4.747  -1.946 -13.199
  122   2HD   LYS  15          2HD       LYS  15   5.847  -2.306 -11.883
  123   1HE   LYS  15          1HE       LYS  15   6.972  -3.658 -13.322
  124   2HE   LYS  15          2HE       LYS  15   5.618  -4.767 -13.223
  125   1HZ   LYS  15          1HZ       LYS  15   5.596  -2.510 -15.086
  126   2HZ   LYS  15          2HZ       LYS  15   6.272  -3.942 -15.487
  127   3HZ   LYS  15          3HZ       LYS  15   4.681  -3.863 -15.125
  128    H    ALA  16           H        ALA  16   1.280  -1.137  -8.823
  129    HA   ALA  16           HA       ALA  16   3.080  -1.544  -6.715
  130   1HB   ALA  16          1HB       ALA  16   0.399  -0.158  -6.469
  131   2HB   ALA  16          2HB       ALA  16   1.947   0.255  -5.693
  132   3HB   ALA  16          3HB       ALA  16   1.718   0.547  -7.434
  133    H    VAL  17           H        VAL  17  -0.474  -2.264  -7.007
  134    HA   VAL  17           HA       VAL  17  -0.705  -3.500  -4.535
  135    HB   VAL  17           HB       VAL  17  -2.230  -3.264  -7.032
  136   1HG1  VAL  17          1HG1      VAL  17  -2.203  -5.702  -6.899
  137   2HG1  VAL  17          2HG1      VAL  17  -2.724  -5.635  -5.198
  138   3HG1  VAL  17          3HG1      VAL  17  -3.817  -5.076  -6.488
  139   1HG2  VAL  17          1HG2      VAL  17  -2.404  -2.130  -4.611
  140   2HG2  VAL  17          2HG2      VAL  17  -3.818  -2.355  -5.668
  141   3HG2  VAL  17          3HG2      VAL  17  -3.504  -3.503  -4.345
  142    H    GLU  18           H        GLU  18   0.105  -4.837  -7.795
  143    HA   GLU  18           HA       GLU  18   0.185  -7.479  -6.942
  144   1HB   GLU  18          1HB       GLU  18   0.165  -6.415  -9.350
  145   2HB   GLU  18          2HB       GLU  18   1.910  -6.416  -9.194
  146   1HG   GLU  18          1HG       GLU  18   2.055  -8.685  -9.448
  147   2HG   GLU  18          2HG       GLU  18   0.705  -8.986  -8.371
  148    H    GLU  19           H        GLU  19   2.514  -4.804  -6.771
  149    HA   GLU  19           HA       GLU  19   4.787  -6.362  -6.387
  150   1HB   GLU  19          1HB       GLU  19   5.019  -4.038  -6.990
  151   2HB   GLU  19          2HB       GLU  19   4.078  -3.508  -5.610
  152   1HG   GLU  19          1HG       GLU  19   6.351  -3.115  -4.988
  153   2HG   GLU  19          2HG       GLU  19   5.892  -4.563  -4.115
  154    H    ILE  20           H        ILE  20   2.097  -5.465  -4.294
  155    HA   ILE  20           HA       ILE  20   3.490  -5.931  -1.851
  156    HB   ILE  20           HB       ILE  20   0.510  -5.986  -2.217
  157   1HG1  ILE  20          1HG1      ILE  20   0.972  -4.081  -3.475
  158   2HG1  ILE  20          2HG1      ILE  20   0.678  -3.447  -1.868
  159   1HG2  ILE  20          1HG2      ILE  20   2.382  -5.798   0.008
  160   2HG2  ILE  20          2HG2      ILE  20   1.192  -4.475   0.006
  161   3HG2  ILE  20          3HG2      ILE  20   0.641  -6.168  -0.002
  162   1HD1  ILE  20          1HD1      ILE  20   2.663  -2.353  -2.220
  163   2HD1  ILE  20          2HD1      ILE  20   3.378  -3.901  -1.709
  164   3HD1  ILE  20          3HD1      ILE  20   3.207  -3.529  -3.441
  165    H    LYS  21           H        LYS  21   1.617  -7.857  -4.192
  166    HA   LYS  21           HA       LYS  21   1.342 -10.089  -2.446
  167   1HB   LYS  21          1HB       LYS  21   0.977  -9.749  -5.435
  168   2HB   LYS  21          2HB       LYS  21   0.650 -11.242  -4.579
  169   1HG   LYS  21          1HG       LYS  21  -1.179 -10.339  -3.403
  170   2HG   LYS  21          2HG       LYS  21  -0.586  -8.694  -3.527
  171   1HD   LYS  21          1HD       LYS  21  -1.552  -8.355  -5.586
  172   2HD   LYS  21          2HD       LYS  21  -1.156  -9.965  -6.155
  173   1HE   LYS  21          1HE       LYS  21  -3.148 -10.046  -3.988
  174   2HE   LYS  21          2HE       LYS  21  -3.696  -9.056  -5.325
  175   1HZ   LYS  21          1HZ       LYS  21  -3.596 -11.806  -5.202
  176   2HZ   LYS  21          2HZ       LYS  21  -4.065 -10.883  -6.465
  177   3HZ   LYS  21          3HZ       LYS  21  -2.509 -11.362  -6.338
  178    H    LYS  22           H        LYS  22   3.783  -8.873  -4.718
  179    HA   LYS  22           HA       LYS  22   5.165 -11.331  -4.966
  180   1HB   LYS  22          1HB       LYS  22   5.215  -8.895  -6.242
  181   2HB   LYS  22          2HB       LYS  22   6.708  -8.847  -5.327
  182   1HG   LYS  22          1HG       LYS  22   6.870 -11.398  -6.273
  183   2HG   LYS  22          2HG       LYS  22   5.897 -10.695  -7.549
  184   1HD   LYS  22          1HD       LYS  22   7.755  -9.762  -8.447
  185   2HD   LYS  22          2HD       LYS  22   7.974  -8.805  -6.996
  186   1HE   LYS  22          1HE       LYS  22   9.654 -10.153  -6.206
  187   2HE   LYS  22          2HE       LYS  22   8.820 -11.626  -6.659
  188   1HZ   LYS  22          1HZ       LYS  22   9.517 -11.296  -8.908
  189   2HZ   LYS  22          2HZ       LYS  22  10.213  -9.863  -8.553
  190   3HZ   LYS  22          3HZ       LYS  22  10.831 -11.244  -7.939
  191    H    VAL  23           H        VAL  23   5.650  -8.366  -2.936
  192    HA   VAL  23           HA       VAL  23   7.896  -9.339  -1.599
  193    HB   VAL  23           HB       VAL  23   5.942  -7.151  -1.334
  194   1HG1  VAL  23          1HG1      VAL  23   7.481  -8.160   1.079
  195   2HG1  VAL  23          2HG1      VAL  23   6.758  -6.539   0.954
  196   3HG1  VAL  23          3HG1      VAL  23   5.718  -7.983   0.915
  197   1HG2  VAL  23          1HG2      VAL  23   8.582  -6.455  -0.506
  198   2HG2  VAL  23          2HG2      VAL  23   8.717  -7.531  -1.918
  199   3HG2  VAL  23          3HG2      VAL  23   7.747  -6.042  -2.023
  200    H    ALA  24           H        ALA  24   4.371  -9.706  -1.026
  201    HA   ALA  24           HA       ALA  24   4.750 -10.996   1.492
  202   1HB   ALA  24          1HB       ALA  24   2.721  -9.655   0.687
  203   2HB   ALA  24          2HB       ALA  24   2.299 -11.076  -0.299
  204   3HB   ALA  24          3HB       ALA  24   2.374 -11.213   1.474
  205    H    GLN  25           H        GLN  25   4.590 -11.939  -1.931
  206    HA   GLN  25           HA       GLN  25   3.927 -14.574  -1.637
  207   1HB   GLN  25          1HB       GLN  25   5.006 -12.857  -3.689
  208   2HB   GLN  25          2HB       GLN  25   5.915 -14.355  -3.704
  209   1HG   GLN  25          1HG       GLN  25   2.990 -14.756  -3.399
  210   2HG   GLN  25          2HG       GLN  25   3.430 -13.965  -4.900
  211   1HE2  GLN  25          1HE2      GLN  25   4.475 -15.046  -6.480
  212   2HE2  GLN  25          2HE2      GLN  25   4.847 -16.738  -6.448
  213    H    GLU  26           H        GLU  26   7.062 -12.900  -1.168
  214    HA   GLU  26           HA       GLU  26   8.458 -15.363  -0.865
  215   1HB   GLU  26          1HB       GLU  26   9.295 -12.949  -1.643
  216   2HB   GLU  26          2HB       GLU  26   9.564 -12.716   0.073
  217   1HG   GLU  26          1HG       GLU  26  10.701 -15.174  -0.194
  218   2HG   GLU  26          2HG       GLU  26  10.936 -14.592  -1.830
  219    H    ASN  27           H        ASN  27   6.343 -13.528   1.080
  220    HA   ASN  27           HA       ASN  27   7.612 -14.567   3.489
  221   1HB   ASN  27          1HB       ASN  27   5.868 -12.140   2.942
  222   2HB   ASN  27          2HB       ASN  27   5.872 -12.835   4.551
  223   1HD2  ASN  27          1HD2      ASN  27   7.234 -10.571   2.628
  224   2HD2  ASN  27          2HD2      ASN  27   8.763 -10.330   3.405
  225    H    ASN  28           H        ASN  28   5.449 -15.490   1.252
  226    HA   ASN  28           HA       ASN  28   3.547 -16.552   1.154
  227   1HB   ASN  28          1HB       ASN  28   5.214 -17.930   2.861
  228   2HB   ASN  28          2HB       ASN  28   3.820 -17.727   3.903
  229   1HD2  ASN  28          1HD2      ASN  28   3.717 -20.054   3.772
  230   2HD2  ASN  28          2HD2      ASN  28   2.890 -20.823   2.459
  231    H    ILE  29           H        ILE  29   3.221 -13.893   2.171
  232    HA   ILE  29           HA       ILE  29   1.330 -14.193   4.380
  233    HB   ILE  29           HB       ILE  29   2.995 -11.958   3.307
  234   1HG1  ILE  29          1HG1      ILE  29   2.482 -13.217   6.002
  235   2HG1  ILE  29          2HG1      ILE  29   3.983 -13.135   5.102
  236   1HG2  ILE  29          1HG2      ILE  29   0.665 -11.110   3.311
  237   2HG2  ILE  29          2HG2      ILE  29   0.546 -11.523   5.038
  238   3HG2  ILE  29          3HG2      ILE  29   1.714 -10.294   4.496
  239   1HD1  ILE  29          1HD1      ILE  29   3.641 -10.510   5.297
  240   2HD1  ILE  29          2HD1      ILE  29   2.581 -10.957   6.656
  241   3HD1  ILE  29          3HD1      ILE  29   4.297 -11.428   6.674
  242    H    GLU  30           H        GLU  30  -0.834 -14.095   4.047
  243    HA   GLU  30           HA       GLU  30  -1.647 -13.469   1.334
  244   1HB   GLU  30          1HB       GLU  30  -2.427 -15.457   3.258
  245   2HB   GLU  30          2HB       GLU  30  -3.826 -14.445   2.958
  246   1HG   GLU  30          1HG       GLU  30  -3.802 -14.899   0.605
  247   2HG   GLU  30          2HG       GLU  30  -2.156 -15.499   0.647
  248    H    ASN  31           H        ASN  31  -1.060 -11.706   3.969
  249    HA   ASN  31           HA       ASN  31  -3.184  -9.883   3.328
  250   1HB   ASN  31          1HB       ASN  31  -3.734 -11.457   5.432
  251   2HB   ASN  31          2HB       ASN  31  -2.642 -10.374   6.273
  252   1HD2  ASN  31          1HD2      ASN  31  -5.602 -10.868   6.361
  253   2HD2  ASN  31          2HD2      ASN  31  -6.347  -9.311   6.219
  254    HA   PRO  32           HA       PRO  32   0.987  -8.165   4.250
  255   1HB   PRO  32          1HB       PRO  32   1.537  -7.081   1.803
  256   2HB   PRO  32          2HB       PRO  32   2.094  -8.668   2.295
  257   1HG   PRO  32          1HG       PRO  32  -0.093  -7.966   0.433
  258   2HG   PRO  32          2HG       PRO  32   0.749  -9.493   0.612
  259   1HD   PRO  32          1HD       PRO  32  -1.876  -8.856   1.579
  260   2HD   PRO  32          2HD       PRO  32  -0.988 -10.341   1.857
  261    H    ILE  33           H        ILE  33   0.936  -6.424   5.508
  262    HA   ILE  33           HA       ILE  33  -0.909  -4.339   4.607
  263    HB   ILE  33           HB       ILE  33   0.235  -5.066   7.296
  264   1HG1  ILE  33          1HG1      ILE  33  -2.671  -4.680   6.830
  265   2HG1  ILE  33          2HG1      ILE  33  -1.947  -6.061   6.032
  266   1HG2  ILE  33          1HG2      ILE  33   0.189  -2.906   7.840
  267   2HG2  ILE  33          2HG2      ILE  33  -0.643  -2.456   6.333
  268   3HG2  ILE  33          3HG2      ILE  33  -1.583  -3.025   7.733
  269   1HD1  ILE  33          1HD1      ILE  33  -0.809  -6.448   8.421
  270   2HD1  ILE  33          2HD1      ILE  33  -2.196  -5.481   8.979
  271   3HD1  ILE  33          3HD1      ILE  33  -2.469  -7.004   8.098
  272    H    LEU  34           H        LEU  34   0.255  -3.148   3.111
  273    HA   LEU  34           HA       LEU  34   2.932  -2.303   3.897
  274   1HB   LEU  34          1HB       LEU  34   1.401  -2.299   1.308
  275   2HB   LEU  34          2HB       LEU  34   2.863  -1.355   1.510
  276    HG   LEU  34           HG       LEU  34   3.108  -3.628   0.416
  277   1HD1  LEU  34          1HD1      LEU  34   5.150  -4.195   1.986
  278   2HD1  LEU  34          2HD1      LEU  34   5.138  -2.729   0.976
  279   3HD1  LEU  34          3HD1      LEU  34   4.743  -2.619   2.708
  280   1HD2  LEU  34          1HD2      LEU  34   3.187  -5.602   1.809
  281   2HD2  LEU  34          2HD2      LEU  34   2.767  -4.645   3.250
  282   3HD2  LEU  34          3HD2      LEU  34   1.582  -4.843   1.936
  283    H    ARG  35           H        ARG  35   3.488  -0.159   4.300
  284    HA   ARG  35           HA       ARG  35   1.199   1.640   4.369
  285   1HB   ARG  35          1HB       ARG  35   2.012   0.964   6.652
  286   2HB   ARG  35          2HB       ARG  35   3.605   1.581   6.261
  287   1HG   ARG  35          1HG       ARG  35   1.418   3.534   5.777
  288   2HG   ARG  35          2HG       ARG  35   1.570   3.050   7.454
  289   1HD   ARG  35          1HD       ARG  35   3.971   3.947   5.798
  290   2HD   ARG  35          2HD       ARG  35   2.990   5.077   6.709
  291    HE   ARG  35           HE       ARG  35   3.723   4.049   8.767
  292   1HH1  ARG  35          2HH2      ARG  35   5.201   2.625   5.908
  293   2HH1  ARG  35          1HH2      ARG  35   6.478   1.860   6.793
  294   1HH2  ARG  35          2HH1      ARG  35   5.408   3.041   9.935
  295   2HH2  ARG  35          1HH1      ARG  35   6.597   2.098   9.099
  296    H    ILE  36           H        ILE  36   1.571   3.831   3.677
  297    HA   ILE  36           HA       ILE  36   3.943   4.107   2.031
  298    HB   ILE  36           HB       ILE  36   1.337   5.589   2.262
  299   1HG1  ILE  36          1HG1      ILE  36   1.171   3.580   0.985
  300   2HG1  ILE  36          2HG1      ILE  36   1.167   4.925  -0.138
  301   1HG2  ILE  36          1HG2      ILE  36   3.636   6.380   0.458
  302   2HG2  ILE  36          2HG2      ILE  36   2.060   7.188   0.641
  303   3HG2  ILE  36          3HG2      ILE  36   3.230   7.205   1.983
  304   1HD1  ILE  36          1HD1      ILE  36   3.167   2.766   0.212
  305   2HD1  ILE  36          2HD1      ILE  36   2.802   3.757  -1.221
  306   3HD1  ILE  36          3HD1      ILE  36   3.876   4.391   0.049
  307    H    ARG  37           H        ARG  37   5.593   5.579   2.379
  308    HA   ARG  37           HA       ARG  37   5.250   7.366   4.621
  309   1HB   ARG  37          1HB       ARG  37   7.450   6.717   5.583
  310   2HB   ARG  37          2HB       ARG  37   6.359   5.346   5.556
  311   1HG   ARG  37          1HG       ARG  37   7.424   4.468   3.518
  312   2HG   ARG  37          2HG       ARG  37   8.422   5.901   3.374
  313   1HD   ARG  37          1HD       ARG  37   9.793   5.305   5.199
  314   2HD   ARG  37          2HD       ARG  37   8.554   4.316   5.946
  315    HE   ARG  37           HE       ARG  37   9.100   3.054   3.503
  316   1HH1  ARG  37          2HH2      ARG  37  10.952   3.948   6.358
  317   2HH1  ARG  37          1HH2      ARG  37  12.084   2.647   6.188
  318   1HH2  ARG  37          2HH1      ARG  37  10.592   1.338   3.278
  319   2HH2  ARG  37          1HH1      ARG  37  11.877   1.153   4.424
  320    H    VAL  38           H        VAL  38   7.213   8.973   4.708
  321    HA   VAL  38           HA       VAL  38   8.047   9.502   1.940
  322    HB   VAL  38           HB       VAL  38   7.875  11.554   4.128
  323   1HG1  VAL  38          1HG1      VAL  38   9.005  12.429   2.279
  324   2HG1  VAL  38          2HG1      VAL  38   7.965  11.575   1.113
  325   3HG1  VAL  38          3HG1      VAL  38   7.327  12.967   2.022
  326   1HG2  VAL  38          1HG2      VAL  38   5.667  11.058   4.281
  327   2HG2  VAL  38          2HG2      VAL  38   5.574  12.000   2.773
  328   3HG2  VAL  38          3HG2      VAL  38   5.633  10.222   2.710
  329    H    VAL  39           H        VAL  39  10.115   8.846   1.640
  330    HA   VAL  39           HA       VAL  39  11.936   9.090   3.920
  331    HB   VAL  39           HB       VAL  39  13.341   7.524   2.678
  332   1HG1  VAL  39          1HG1      VAL  39  10.455   6.646   3.019
  333   2HG1  VAL  39          2HG1      VAL  39  11.834   5.540   2.810
  334   3HG1  VAL  39          3HG1      VAL  39  11.747   6.595   4.242
  335   1HG2  VAL  39          1HG2      VAL  39  11.101   7.419   0.631
  336   2HG2  VAL  39          2HG2      VAL  39  12.665   8.235   0.394
  337   3HG2  VAL  39          3HG2      VAL  39  12.607   6.470   0.620
  338    HA   PRO  40           HA       PRO  40  13.775  12.451   1.882
  339   1HB   PRO  40          1HB       PRO  40  15.941  12.792   3.513
  340   2HB   PRO  40          2HB       PRO  40  14.352  13.432   3.883
  341   1HG   PRO  40          1HG       PRO  40  15.732  11.098   5.062
  342   2HG   PRO  40          2HG       PRO  40  14.365  11.998   5.690
  343   1HD   PRO  40          1HD       PRO  40  14.289   9.430   4.416
  344   2HD   PRO  40          2HD       PRO  40  12.914  10.381   4.939
  345    H    GLY  41           H        GLY  41  14.089  11.237  -0.082
  346   1HA   GLY  41          1HA       GLY  41  16.392  11.419  -1.298
  347   2HA   GLY  41          2HA       GLY  41  16.762  10.046  -0.273
  348    H    GLY  42           H        GLY  42  16.821   9.761  -3.057
  349   1HA   GLY  42          1HA       GLY  42  15.284   7.507  -3.502
  350   2HA   GLY  42          2HA       GLY  42  14.350   8.849  -4.132
  351    H    CYS  43           H        CYS  43  15.718   6.596  -5.575
  352    HA   CYS  43           HA       CYS  43  18.003   7.698  -6.835
  353   1HB   CYS  43          1HB       CYS  43  16.271   5.282  -7.372
  354   2HB   CYS  43          2HB       CYS  43  17.546   5.751  -8.479
  355    HG   CYS  43           HG       CYS  43  17.672   4.054  -5.921
  356    H    SER  44           H        SER  44  14.483   7.360  -7.578
  357    HA   SER  44           HA       SER  44  14.729   8.465 -10.149
  358   1HB   SER  44          1HB       SER  44  12.544   7.590  -8.333
  359   2HB   SER  44          2HB       SER  44  12.087   8.872  -9.437
  360    HG   SER  44           HG       SER  44  11.843   7.299 -10.867
  361    H    GLY  45           H        GLY  45  13.783   9.735  -6.896
  362   1HA   GLY  45          1HA       GLY  45  14.845  12.157  -6.902
  363   2HA   GLY  45          2HA       GLY  45  13.483  12.431  -7.969
  364    H    PHE  46           H        PHE  46  14.098  10.638  -4.857
  365    HA   PHE  46           HA       PHE  46  13.001  10.598  -2.947
  366   1HB   PHE  46          1HB       PHE  46  11.733  13.246  -3.846
  367   2HB   PHE  46          2HB       PHE  46  12.038  12.744  -2.195
  368    HD1  PHE  46           1HD      PHE  46  13.496  14.173  -5.211
  369    HD2  PHE  46           2HD      PHE  46  14.310  12.819  -1.272
  370    HE1  PHE  46           1HE      PHE  46  15.707  15.360  -5.260
  371    HE2  PHE  46           2HE      PHE  46  16.521  14.006  -1.321
  372    HZ   PHE  46           HZ       PHE  46  17.193  15.262  -3.314
  373    H    GLN  47           H        GLN  47  11.560   8.894  -3.136
  374    HA   GLN  47           HA       GLN  47   8.866   9.696  -3.862
  375   1HB   GLN  47          1HB       GLN  47  10.444   7.372  -5.002
  376   2HB   GLN  47          2HB       GLN  47   8.695   7.292  -4.913
  377   1HG   GLN  47          1HG       GLN  47   8.920   8.255  -7.015
  378   2HG   GLN  47          2HG       GLN  47   8.837   9.711  -6.045
  379   1HE2  GLN  47          1HE2      GLN  47   9.924  10.327  -8.188
  380   2HE2  GLN  47          2HE2      GLN  47  11.656  10.368  -8.195
  381    H    TYR  48           H        TYR  48   7.196   8.066  -3.031
  382    HA   TYR  48           HA       TYR  48   7.930   7.357  -0.341
  383   1HB   TYR  48          1HB       TYR  48   5.387   6.850  -2.003
  384   2HB   TYR  48          2HB       TYR  48   5.473   6.895  -0.253
  385    HD1  TYR  48           1HD      TYR  48   5.372   8.907  -3.320
  386    HD2  TYR  48           2HD      TYR  48   5.644   9.032   0.948
  387    HE1  TYR  48           1HE      TYR  48   4.807  11.386  -3.349
  388    HE2  TYR  48           2HE      TYR  48   5.078  11.510   0.905
  389    HH   TYR  48           HH       TYR  48   3.724  13.016  -0.824
  390    H    ALA  49           H        ALA  49   8.545   5.376   0.383
  391    HA   ALA  49           HA       ALA  49   8.296   3.161  -1.523
  392   1HB   ALA  49          1HB       ALA  49  10.555   4.051  -0.501
  393   2HB   ALA  49          2HB       ALA  49  10.042   3.136   0.936
  394   3HB   ALA  49          3HB       ALA  49  10.266   2.298  -0.618
  395    H    MET  50           H        MET  50   7.789   0.993  -0.578
  396    HA   MET  50           HA       MET  50   5.798   1.362   1.503
  397   1HB   MET  50          1HB       MET  50   4.785  -0.672   0.615
  398   2HB   MET  50          2HB       MET  50   5.230   0.303  -0.771
  399   1HG   MET  50          1HG       MET  50   7.373  -1.010  -0.980
  400   2HG   MET  50          2HG       MET  50   6.873  -2.010   0.370
  401   1HE   MET  50          1HE       MET  50   5.691  -0.332  -2.680
  402   2HE   MET  50          2HE       MET  50   5.153  -1.627  -3.777
  403   3HE   MET  50          3HE       MET  50   4.017  -0.930  -2.598
  404    H    GLY  51           H        GLY  51   5.491  -0.841   2.863
  405   1HA   GLY  51          1HA       GLY  51   7.750  -2.435   3.391
  406   2HA   GLY  51          2HA       GLY  51   7.737  -1.087   4.511
  407    H    PHE  52           H        PHE  52   6.608  -4.238   3.958
  408    HA   PHE  52           HA       PHE  52   4.059  -4.078   5.149
  409   1HB   PHE  52          1HB       PHE  52   4.373  -6.566   5.228
  410   2HB   PHE  52          2HB       PHE  52   4.926  -5.940   3.687
  411    HD1  PHE  52           1HD      PHE  52   7.290  -5.921   3.126
  412    HD2  PHE  52           2HD      PHE  52   5.961  -7.415   6.869
  413    HE1  PHE  52           1HE      PHE  52   9.528  -6.998   3.491
  414    HE2  PHE  52           2HE      PHE  52   8.199  -8.492   7.234
  415    HZ   PHE  52           HZ       PHE  52   9.955  -8.271   5.540
  416    H    ASP  53           H        ASP  53   3.525  -3.749   7.252
  417    HA   ASP  53           HA       ASP  53   5.650  -3.896   9.180
  418   1HB   ASP  53          1HB       ASP  53   3.456  -2.221   8.835
  419   2HB   ASP  53          2HB       ASP  53   2.893  -3.283  10.110
  420    H    ASP  54           H        ASP  54   4.706  -4.766  11.508
  421    HA   ASP  54           HA       ASP  54   4.043  -7.480  10.994
  422   1HB   ASP  54          1HB       ASP  54   5.084  -5.861  13.203
  423   2HB   ASP  54          2HB       ASP  54   3.839  -6.949  13.781
  424    H    THR  55           H        THR  55   2.379  -4.492  11.657
  425    HA   THR  55           HA       THR  55  -0.167  -5.679  11.521
  426    HB   THR  55           HB       THR  55   0.935  -6.034  14.026
  427    HG1  THR  55           1HG      THR  55  -1.067  -6.960  13.614
  428   1HG2  THR  55          1HG2      THR  55   0.663  -3.348  14.143
  429   2HG2  THR  55          2HG2      THR  55  -1.035  -3.786  14.453
  430   3HG2  THR  55          3HG2      THR  55   0.249  -4.377  15.535
  431    H    VAL  56           H        VAL  56  -1.893  -3.899  12.292
  432    HA   VAL  56           HA       VAL  56  -0.963  -1.478  10.961
  433    HB   VAL  56           HB       VAL  56  -3.060  -2.915  10.377
  434   1HG1  VAL  56          1HG1      VAL  56  -5.123  -1.978  11.493
  435   2HG1  VAL  56          2HG1      VAL  56  -4.121  -3.034  12.517
  436   3HG1  VAL  56          3HG1      VAL  56  -4.050  -1.267  12.722
  437   1HG2  VAL  56          1HG2      VAL  56  -4.135  -0.275  10.303
  438   2HG2  VAL  56          2HG2      VAL  56  -2.373  -0.151  10.086
  439   3HG2  VAL  56          3HG2      VAL  56  -3.333  -1.184   9.000
  440    H    GLU  57           H        GLU  57  -1.509   0.651  11.868
  441    HA   GLU  57           HA       GLU  57  -0.946   0.672  14.638
  442   1HB   GLU  57          1HB       GLU  57  -1.790   3.057  12.950
  443   2HB   GLU  57          2HB       GLU  57  -0.800   3.066  14.395
  444   1HG   GLU  57          1HG       GLU  57   0.585   1.314  12.702
  445   2HG   GLU  57          2HG       GLU  57  -0.024   2.528  11.594
  446    H    GLU  58           H        GLU  58  -2.315   2.299  16.092
  447    HA   GLU  58           HA       GLU  58  -4.969   1.227  16.030
  448   1HB   GLU  58          1HB       GLU  58  -3.476   1.500  18.119
  449   2HB   GLU  58          2HB       GLU  58  -3.833   3.213  18.035
  450   1HG   GLU  58          1HG       GLU  58  -6.288   2.696  18.141
  451   2HG   GLU  58          2HG       GLU  58  -5.916   0.987  18.254
  452    H    GLY  59           H        GLY  59  -3.993   3.222  13.950
  453   1HA   GLY  59          1HA       GLY  59  -6.326   4.712  13.659
  454   2HA   GLY  59          2HA       GLY  59  -5.159   5.746  14.460
  455    H    ASP  60           H        ASP  60  -5.171   3.299  11.759
  456    HA   ASP  60           HA       ASP  60  -3.695   5.286  10.220
  457   1HB   ASP  60          1HB       ASP  60  -2.734   2.796  11.068
  458   2HB   ASP  60          2HB       ASP  60  -3.282   2.459   9.438
  459    H    HIS  61           H        HIS  61  -4.530   5.611   8.106
  460    HA   HIS  61           HA       HIS  61  -7.091   4.625   7.559
  461   1HB   HIS  61          1HB       HIS  61  -5.068   6.031   5.794
  462   2HB   HIS  61          2HB       HIS  61  -6.731   5.720   5.334
  463    HD1  HIS  61           1HD      HIS  61  -8.619   6.939   6.854
  464    HD2  HIS  61           2HD      HIS  61  -4.679   8.299   7.329
  465    HE1  HIS  61           1HE      HIS  61  -8.780   9.206   8.015
  466    H    VAL  62           H        VAL  62  -7.185   2.364   7.525
  467    HA   VAL  62           HA       VAL  62  -5.310   0.912   5.895
  468    HB   VAL  62           HB       VAL  62  -6.655   0.349   8.163
  469   1HG1  VAL  62          1HG1      VAL  62  -8.796   0.277   6.723
  470   2HG1  VAL  62          2HG1      VAL  62  -8.170  -1.275   6.116
  471   3HG1  VAL  62          3HG1      VAL  62  -8.501  -1.066   7.853
  472   1HG2  VAL  62          1HG2      VAL  62  -4.941  -1.096   7.832
  473   2HG2  VAL  62          2HG2      VAL  62  -6.239  -2.175   7.267
  474   3HG2  VAL  62          3HG2      VAL  62  -5.268  -1.257   6.090
  475    H    PHE  63           H        PHE  63  -5.633   0.130   3.839
  476    HA   PHE  63           HA       PHE  63  -8.246   0.770   2.662
  477   1HB   PHE  63          1HB       PHE  63  -5.555   1.545   2.031
  478   2HB   PHE  63          2HB       PHE  63  -5.967   0.339   0.827
  479    HD1  PHE  63           1HD      PHE  63  -8.323   2.744   2.375
  480    HD2  PHE  63           2HD      PHE  63  -6.105   1.701  -1.089
  481    HE1  PHE  63           1HE      PHE  63  -9.564   4.483   1.057
  482    HE2  PHE  63           2HE      PHE  63  -7.345   3.440  -2.407
  483    HZ   PHE  63           HZ       PHE  63  -9.060   4.810  -1.318
  484    H    GLU  64           H        GLU  64  -9.362  -0.855   1.626
  485    HA   GLU  64           HA       GLU  64  -8.172  -3.469   1.835
  486   1HB   GLU  64          1HB       GLU  64 -10.988  -2.658   0.986
  487   2HB   GLU  64          2HB       GLU  64 -10.454  -4.291   1.330
  488   1HG   GLU  64          1HG       GLU  64  -9.984  -3.700   3.675
  489   2HG   GLU  64          2HG       GLU  64 -10.339  -2.013   3.361
  490    H    TYR  65           H        TYR  65  -7.223  -4.507   0.132
  491    HA   TYR  65           HA       TYR  65  -7.833  -3.457  -2.549
  492   1HB   TYR  65          1HB       TYR  65  -5.384  -4.324  -1.001
  493   2HB   TYR  65          2HB       TYR  65  -5.412  -4.822  -2.681
  494    HD1  TYR  65           1HD      TYR  65  -4.599  -2.194  -0.430
  495    HD2  TYR  65           2HD      TYR  65  -5.866  -2.941  -4.447
  496    HE1  TYR  65           1HE      TYR  65  -3.751   0.098  -1.131
  497    HE2  TYR  65           2HE      TYR  65  -5.013  -0.646  -5.135
  498    HH   TYR  65           HH       TYR  65  -3.141   1.314  -2.936
  499    H    ASP  66           H        ASP  66  -6.575  -5.471  -4.048
  500    HA   ASP  66           HA       ASP  66  -8.598  -7.369  -4.082
  501   1HB   ASP  66          1HB       ASP  66  -6.973  -6.607  -5.962
  502   2HB   ASP  66          2HB       ASP  66  -5.814  -7.723  -5.269
  503    H    GLY  67           H        GLY  67  -8.393  -7.996  -1.674
  504   1HA   GLY  67          1HA       GLY  67  -7.945  -9.641  -0.193
  505   2HA   GLY  67          2HA       GLY  67  -7.015 -10.478  -1.420
  506    H    VAL  68           H        VAL  68  -6.220  -7.103  -0.765
  507    HA   VAL  68           HA       VAL  68  -3.993  -7.969   0.934
  508    HB   VAL  68           HB       VAL  68  -3.881  -6.212  -1.522
  509   1HG1  VAL  68          1HG1      VAL  68  -1.865  -6.627   0.696
  510   2HG1  VAL  68          2HG1      VAL  68  -1.392  -6.098  -0.936
  511   3HG1  VAL  68          3HG1      VAL  68  -2.498  -5.099   0.038
  512   1HG2  VAL  68          1HG2      VAL  68  -1.859  -8.198  -1.505
  513   2HG2  VAL  68          2HG2      VAL  68  -3.378  -9.007  -1.053
  514   3HG2  VAL  68          3HG2      VAL  68  -3.279  -8.084  -2.572
  515    H    LYS  69           H        LYS  69  -3.127  -6.224   2.304
  516    HA   LYS  69           HA       LYS  69  -5.159  -4.146   2.732
  517   1HB   LYS  69          1HB       LYS  69  -4.504  -6.141   4.472
  518   2HB   LYS  69          2HB       LYS  69  -3.387  -4.891   4.983
  519   1HG   LYS  69          1HG       LYS  69  -5.272  -3.270   5.185
  520   2HG   LYS  69          2HG       LYS  69  -6.398  -4.496   4.637
  521   1HD   LYS  69          1HD       LYS  69  -5.025  -5.759   6.745
  522   2HD   LYS  69          2HD       LYS  69  -5.211  -4.110   7.308
  523   1HE   LYS  69          1HE       LYS  69  -7.703  -4.316   6.580
  524   2HE   LYS  69          2HE       LYS  69  -7.406  -6.038   6.443
  525   1HZ   LYS  69          1HZ       LYS  69  -8.214  -5.112   8.648
  526   2HZ   LYS  69          2HZ       LYS  69  -7.000  -6.203   8.686
  527   3HZ   LYS  69          3HZ       LYS  69  -6.677  -4.615   8.886
  528    H    VAL  70           H        VAL  70  -4.455  -2.008   3.113
  529    HA   VAL  70           HA       VAL  70  -1.593  -1.531   3.022
  530    HB   VAL  70           HB       VAL  70  -3.560  -0.643   0.918
  531   1HG1  VAL  70          1HG1      VAL  70  -1.850   0.890   0.057
  532   2HG1  VAL  70          2HG1      VAL  70  -2.349   1.348   1.704
  533   3HG1  VAL  70          3HG1      VAL  70  -0.800   0.511   1.443
  534   1HG2  VAL  70          1HG2      VAL  70  -2.351  -2.787   0.581
  535   2HG2  VAL  70          2HG2      VAL  70  -1.938  -1.558  -0.638
  536   3HG2  VAL  70          3HG2      VAL  70  -0.808  -1.907   0.692
  537    H    VAL  71           H        VAL  71  -1.053   0.702   3.666
  538    HA   VAL  71           HA       VAL  71  -3.271   2.213   4.782
  539    HB   VAL  71           HB       VAL  71  -2.575   2.169   6.968
  540   1HG1  VAL  71          1HG1      VAL  71  -3.453  -0.042   6.280
  541   2HG1  VAL  71          2HG1      VAL  71  -1.787  -0.598   5.992
  542   3HG1  VAL  71          3HG1      VAL  71  -2.307  -0.158   7.637
  543   1HG2  VAL  71          1HG2      VAL  71   0.131   1.194   5.999
  544   2HG2  VAL  71          2HG2      VAL  71  -0.265   2.785   6.692
  545   3HG2  VAL  71          3HG2      VAL  71  -0.331   1.328   7.712
  546    H    ILE  72           H        ILE  72  -2.449   4.415   5.575
  547    HA   ILE  72           HA       ILE  72   0.076   5.185   4.379
  548    HB   ILE  72           HB       ILE  72  -2.559   6.387   3.523
  549   1HG1  ILE  72          1HG1      ILE  72  -0.483   4.829   1.953
  550   2HG1  ILE  72          2HG1      ILE  72  -2.056   4.233   2.445
  551   1HG2  ILE  72          1HG2      ILE  72  -1.135   7.799   2.036
  552   2HG2  ILE  72          2HG2      ILE  72  -0.967   8.159   3.771
  553   3HG2  ILE  72          3HG2      ILE  72   0.291   7.220   2.931
  554   1HD1  ILE  72          1HD1      ILE  72  -1.476   6.532   0.529
  555   2HD1  ILE  72          2HD1      ILE  72  -2.269   4.982   0.158
  556   3HD1  ILE  72          3HD1      ILE  72  -3.101   6.187   1.171
  557    H    ASP  73           H        ASP  73   1.120   6.286   5.941
  558    HA   ASP  73           HA       ASP  73   0.233   6.920   8.324
  559   1HB   ASP  73          1HB       ASP  73   2.285   8.098   6.512
  560   2HB   ASP  73          2HB       ASP  73   1.817   9.143   7.839
  561    HA   PRO  74           HA       PRO  74  -2.540  10.294   7.926
  562   1HB   PRO  74          1HB       PRO  74  -2.303  11.543  10.345
  563   2HB   PRO  74          2HB       PRO  74  -3.255  10.091  10.105
  564   1HG   PRO  74          1HG       PRO  74  -0.612  10.383  11.397
  565   2HG   PRO  74          2HG       PRO  74  -1.753   9.058  11.519
  566   1HD   PRO  74          1HD       PRO  74   0.659   9.108   9.968
  567   2HD   PRO  74          2HD       PRO  74  -0.540   7.831  10.000
  568    H    PHE  75           H        PHE  75   0.766  10.924   8.529
  569    HA   PHE  75           HA       PHE  75   0.431  13.739   7.967
  570   1HB   PHE  75          1HB       PHE  75   2.339  11.899   9.192
  571   2HB   PHE  75          2HB       PHE  75   3.172  12.754   7.910
  572    HD1  PHE  75           1HD      PHE  75   0.965  13.410  10.844
  573    HD2  PHE  75           2HD      PHE  75   4.097  14.830   8.358
  574    HE1  PHE  75           1HE      PHE  75   1.274  15.385  12.362
  575    HE2  PHE  75           2HE      PHE  75   4.406  16.805   9.876
  576    HZ   PHE  75           HZ       PHE  75   2.991  17.058  11.860
  577    H    SER  76           H        SER  76   1.285  10.720   6.322
  578    HA   SER  76           HA       SER  76   2.411  12.162   4.107
  579   1HB   SER  76          1HB       SER  76   1.905   9.190   4.572
  580   2HB   SER  76          2HB       SER  76   2.668   9.835   3.132
  581    HG   SER  76           HG       SER  76   4.372   9.317   4.464
  582    H    MET  77           H        MET  77  -0.667  11.001   5.226
  583    HA   MET  77           HA       MET  77  -1.885  10.294   2.873
  584   1HB   MET  77          1HB       MET  77  -2.591  10.684   5.575
  585   2HB   MET  77          2HB       MET  77  -3.583  11.864   4.742
  586   1HG   MET  77          1HG       MET  77  -3.448   9.038   3.658
  587   2HG   MET  77          2HG       MET  77  -4.446   9.362   5.061
  588   1HE   MET  77          1HE       MET  77  -3.920   9.216   1.627
  589   2HE   MET  77          2HE       MET  77  -5.403   9.813   0.844
  590   3HE   MET  77          3HE       MET  77  -4.039  10.921   1.128
  591    HA   PRO  78           HA       PRO  78  -2.987  14.884   2.368
  592   1HB   PRO  78          1HB       PRO  78  -1.763  16.761   3.933
  593   2HB   PRO  78          2HB       PRO  78  -3.342  16.093   4.295
  594   1HG   PRO  78          1HG       PRO  78  -0.745  15.517   5.586
  595   2HG   PRO  78          2HG       PRO  78  -2.362  15.204   6.185
  596   1HD   PRO  78          1HD       PRO  78  -0.544  13.287   5.069
  597   2HD   PRO  78          2HD       PRO  78  -2.201  12.997   5.561
  598    H    TYR  79           H        TYR  79  -0.111  13.414   2.357
  599    HA   TYR  79           HA       TYR  79   1.214  15.572   0.897
  600   1HB   TYR  79          1HB       TYR  79   1.947  13.571   2.771
  601   2HB   TYR  79          2HB       TYR  79   2.484  12.887   1.250
  602    HD1  TYR  79           1HD      TYR  79   3.276  15.449  -0.167
  603    HD2  TYR  79           2HD      TYR  79   4.006  14.070   3.817
  604    HE1  TYR  79           1HE      TYR  79   5.383  16.866  -0.054
  605    HE2  TYR  79           2HE      TYR  79   6.111  15.492   3.916
  606    HH   TYR  79           HH       TYR  79   7.676  16.490   2.462
  607    H    VAL  80           H        VAL  80  -0.434  12.474   0.477
  608    HA   VAL  80           HA       VAL  80   0.009  12.740  -2.394
  609    HB   VAL  80           HB       VAL  80   0.401  10.317  -2.572
  610   1HG1  VAL  80          1HG1      VAL  80   2.500  11.448  -0.720
  611   2HG1  VAL  80          2HG1      VAL  80   2.704  10.414  -2.155
  612   3HG1  VAL  80          3HG1      VAL  80   2.242  12.122  -2.348
  613   1HG2  VAL  80          1HG2      VAL  80  -0.179   9.035  -0.830
  614   2HG2  VAL  80          2HG2      VAL  80   1.346   9.553  -0.072
  615   3HG2  VAL  80          3HG2      VAL  80  -0.168  10.416   0.293
  616    H    ASN  81           H        ASN  81  -2.214  13.585  -0.812
  617    HA   ASN  81           HA       ASN  81  -4.137  11.508  -0.821
  618   1HB   ASN  81          1HB       ASN  81  -5.629  13.152   0.075
  619   2HB   ASN  81          2HB       ASN  81  -4.059  13.632   0.689
  620   1HD2  ASN  81          1HD2      ASN  81  -2.883  15.302  -0.400
  621   2HD2  ASN  81          2HD2      ASN  81  -3.711  16.560  -1.257
  622    H    GLY  82           H        GLY  82  -5.300  10.865  -2.643
  623   1HA   GLY  82          1HA       GLY  82  -6.586  11.150  -4.519
  624   2HA   GLY  82          2HA       GLY  82  -6.110  12.833  -4.615
  625    H    ALA  83           H        ALA  83  -3.181  12.264  -4.354
  626    HA   ALA  83           HA       ALA  83  -2.562  12.064  -7.051
  627   1HB   ALA  83          1HB       ALA  83  -1.259  12.902  -4.872
  628   2HB   ALA  83          2HB       ALA  83  -0.559  11.268  -4.964
  629   3HB   ALA  83          3HB       ALA  83  -0.391  12.388  -6.338
  630    H    GLU  84           H        GLU  84  -0.753  10.292  -7.736
  631    HA   GLU  84           HA       GLU  84  -1.749   7.698  -6.885
  632   1HB   GLU  84          1HB       GLU  84  -2.931   8.035  -8.938
  633   2HB   GLU  84          2HB       GLU  84  -1.536   8.741  -9.729
  634   1HG   GLU  84          1HG       GLU  84  -0.352   6.494  -9.485
  635   2HG   GLU  84          2HG       GLU  84  -1.855   5.825  -8.882
  636    H    LEU  85           H        LEU  85  -0.134   6.179  -6.553
  637    HA   LEU  85           HA       LEU  85   2.565   7.045  -7.320
  638   1HB   LEU  85          1HB       LEU  85   3.073   6.816  -5.194
  639   2HB   LEU  85          2HB       LEU  85   1.449   6.274  -4.822
  640    HG   LEU  85           HG       LEU  85   2.151   3.940  -5.431
  641   1HD1  LEU  85          1HD1      LEU  85   4.770   3.697  -5.220
  642   2HD1  LEU  85          2HD1      LEU  85   3.991   4.013  -6.790
  643   3HD1  LEU  85          3HD1      LEU  85   4.749   5.347  -5.888
  644   1HD2  LEU  85          1HD2      LEU  85   3.972   4.140  -3.320
  645   2HD2  LEU  85          2HD2      LEU  85   2.844   5.497  -3.087
  646   3HD2  LEU  85          3HD2      LEU  85   2.221   3.834  -3.213
  647    H    ASP  86           H        ASP  86   3.345   5.980  -9.053
  648    HA   ASP  86           HA       ASP  86   2.226   3.375  -9.603
  649   1HB   ASP  86          1HB       ASP  86   4.249   4.310 -11.500
  650   2HB   ASP  86          2HB       ASP  86   2.570   3.902 -11.791
  651    H    TYR  87           H        TYR  87   3.364   1.832  -8.356
  652    HA   TYR  87           HA       TYR  87   6.211   2.138  -7.970
  653   1HB   TYR  87          1HB       TYR  87   4.169   1.206  -6.445
  654   2HB   TYR  87          2HB       TYR  87   4.469  -0.286  -7.313
  655    HD1  TYR  87           1HD      TYR  87   6.660  -1.461  -7.067
  656    HD2  TYR  87           2HD      TYR  87   5.666   1.976  -4.721
  657    HE1  TYR  87           1HE      TYR  87   8.519  -2.032  -5.430
  658    HE2  TYR  87           2HE      TYR  87   7.528   1.393  -3.092
  659    HH   TYR  87           HH       TYR  87   9.405  -1.583  -3.488
  660    H    VAL  88           H        VAL  88   7.744   1.299  -9.288
  661    HA   VAL  88           HA       VAL  88   6.864  -0.680 -11.250
  662    HB   VAL  88           HB       VAL  88   9.183   1.238 -11.076
  663   1HG1  VAL  88          1HG1      VAL  88   8.906  -1.255 -12.692
  664   2HG1  VAL  88          2HG1      VAL  88   9.549   0.187 -13.513
  665   3HG1  VAL  88          3HG1      VAL  88  10.363  -0.449 -12.064
  666   1HG2  VAL  88          1HG2      VAL  88   7.304   0.961 -13.403
  667   2HG2  VAL  88          2HG2      VAL  88   6.758   1.803 -11.933
  668   3HG2  VAL  88          3HG2      VAL  88   8.188   2.389 -12.815
  669    H    VAL  89           H        VAL  89   8.008  -2.664 -11.548
  670    HA   VAL  89           HA       VAL  89   9.837  -3.324  -9.350
  671    HB   VAL  89           HB       VAL  89   7.737  -5.181 -10.467
  672   1HG1  VAL  89          1HG1      VAL  89  10.028  -5.646  -8.924
  673   2HG1  VAL  89          2HG1      VAL  89   8.679  -5.690  -7.764
  674   3HG1  VAL  89          3HG1      VAL  89   8.665  -6.760  -9.186
  675   1HG2  VAL  89          1HG2      VAL  89   7.606  -3.353  -8.055
  676   2HG2  VAL  89          2HG2      VAL  89   6.479  -3.448  -9.429
  677   3HG2  VAL  89          3HG2      VAL  89   6.562  -4.781  -8.252
  678    H    ASP  90           H        ASP  90  11.801  -3.651 -10.254
  679    HA   ASP  90           HA       ASP  90  12.031  -5.570 -12.310
  680   1HB   ASP  90          1HB       ASP  90  11.539  -3.074 -13.300
  681   2HB   ASP  90          2HB       ASP  90  13.276  -2.957 -13.108
  682    H    PHE  91           H        PHE  91  14.679  -4.307 -13.196
  683    HA   PHE  91           HA       PHE  91  16.341  -5.438 -11.306
  684   1HB   PHE  91          1HB       PHE  91  16.530  -4.424 -13.845
  685   2HB   PHE  91          2HB       PHE  91  17.203  -3.056 -12.980
  686    HD1  PHE  91           1HD      PHE  91  19.362  -3.206 -11.902
  687    HD2  PHE  91           2HD      PHE  91  17.700  -6.575 -13.877
  688    HE1  PHE  91           1HE      PHE  91  21.597  -4.346 -11.840
  689    HE2  PHE  91           2HE      PHE  91  19.936  -7.714 -13.814
  690    HZ   PHE  91           HZ       PHE  91  21.858  -6.586 -12.796
  691    H    MET  92           H        MET  92  14.598  -2.460 -11.163
  692    HA   MET  92           HA       MET  92  16.523  -1.095  -9.573
  693   1HB   MET  92          1HB       MET  92  13.906  -0.588 -10.836
  694   2HB   MET  92          2HB       MET  92  13.941   0.065  -9.210
  695   1HG   MET  92          1HG       MET  92  16.366   0.594 -10.902
  696   2HG   MET  92          2HG       MET  92  14.895   1.421 -11.375
  697   1HE   MET  92          1HE       MET  92  17.346   3.689  -9.720
  698   2HE   MET  92          2HE       MET  92  16.447   3.193 -11.174
  699   3HE   MET  92          3HE       MET  92  15.723   4.349 -10.030
  700    H    GLY  93           H        GLY  93  14.792  -3.805  -8.922
  701   1HA   GLY  93          1HA       GLY  93  14.137  -4.844  -7.041
  702   2HA   GLY  93          2HA       GLY  93  15.110  -3.688  -6.153
  703    H    GLY  94           H        GLY  94  12.717  -2.205  -8.192
  704   1HA   GLY  94          1HA       GLY  94  10.347  -2.073  -7.448
  705   2HA   GLY  94          2HA       GLY  94  10.974  -1.802  -5.834
  706    H    GLY  95           H        GLY  95  10.896  -0.472  -9.182
  707   1HA   GLY  95          1HA       GLY  95  12.122   2.005  -8.542
  708   2HA   GLY  95          2HA       GLY  95  11.183   1.619  -9.970
  709    H    PHE  96           H        PHE  96  11.282   3.542  -7.204
  710    HA   PHE  96           HA       PHE  96   8.404   3.616  -6.842
  711   1HB   PHE  96          1HB       PHE  96  10.655   5.304  -5.605
  712   2HB   PHE  96          2HB       PHE  96   9.046   5.086  -4.945
  713    HD1  PHE  96           1HD      PHE  96   8.506   3.179  -3.617
  714    HD2  PHE  96           2HD      PHE  96  12.278   3.420  -5.545
  715    HE1  PHE  96           1HE      PHE  96   9.330   1.244  -2.247
  716    HE2  PHE  96           2HE      PHE  96  13.102   1.485  -4.175
  717    HZ   PHE  96           HZ       PHE  96  11.618   0.420  -2.542
  718    H    THR  97           H        THR  97   7.189   4.884  -8.159
  719    HA   THR  97           HA       THR  97   8.145   7.573  -8.722
  720    HB   THR  97           HB       THR  97   9.009   6.174 -10.605
  721    HG1  THR  97           1HG      THR  97   7.666   7.415 -12.226
  722   1HG2  THR  97          1HG2      THR  97   6.041   5.491 -10.941
  723   2HG2  THR  97          2HG2      THR  97   7.277   5.222 -12.193
  724   3HG2  THR  97          3HG2      THR  97   7.363   4.334 -10.652
  725    H    ILE  98           H        ILE  98   6.530   9.081  -8.838
  726    HA   ILE  98           HA       ILE  98   3.811   7.982  -8.662
  727    HB   ILE  98           HB       ILE  98   5.037  10.288  -7.151
  728   1HG1  ILE  98          1HG1      ILE  98   3.875   8.636  -5.315
  729   2HG1  ILE  98          2HG1      ILE  98   4.414   7.469  -6.507
  730   1HG2  ILE  98          1HG2      ILE  98   3.010  11.082  -6.582
  731   2HG2  ILE  98          2HG2      ILE  98   2.498  10.307  -8.101
  732   3HG2  ILE  98          3HG2      ILE  98   2.263   9.466  -6.550
  733   1HD1  ILE  98          1HD1      ILE  98   6.202   7.841  -4.872
  734   2HD1  ILE  98          2HD1      ILE  98   6.709   8.500  -6.446
  735   3HD1  ILE  98          3HD1      ILE  98   6.143   9.596  -5.163
  736    H    ARG  99           H        ARG  99   2.239   8.939  -9.941
  737    HA   ARG  99           HA       ARG  99   3.318  10.874 -11.812
  738   1HB   ARG  99          1HB       ARG  99   1.798   8.517 -12.173
  739   2HB   ARG  99          2HB       ARG  99   0.643   9.806 -12.443
  740   1HG   ARG  99          1HG       ARG  99   3.323  10.159 -13.738
  741   2HG   ARG  99          2HG       ARG  99   2.329   8.866 -14.378
  742   1HD   ARG  99          1HD       ARG  99   0.521  11.010 -14.096
  743   2HD   ARG  99          2HD       ARG  99   1.994  11.782 -14.650
  744    HE   ARG  99           HE       ARG  99   1.447   9.384 -16.187
  745   1HH1  ARG  99          2HH2      ARG  99   0.497  12.753 -15.823
  746   2HH1  ARG  99          1HH2      ARG  99  -0.044  12.911 -17.461
  747   1HH2  ARG  99          2HH1      ARG  99   0.734   9.592 -18.348
  748   2HH2  ARG  99          1HH1      ARG  99   0.092  11.100 -18.907
  749    H    ASN 100           H        ASN 100   2.900  12.955 -11.085
  750    HA   ASN 100           HA       ASN 100   0.997  13.659  -9.297
  751   1HB   ASN 100          1HB       ASN 100   2.152  15.291 -11.619
  752   2HB   ASN 100          2HB       ASN 100   1.244  16.001 -10.299
  753   1HD2  ASN 100          1HD2      ASN 100   3.573  17.040 -10.531
  754   2HD2  ASN 100          2HD2      ASN 100   4.738  16.469  -9.384
  755    HA   PRO 101           HA       PRO 101  -2.715  13.766 -11.631
  756   1HB   PRO 101          1HB       PRO 101  -4.188  15.644 -10.300
  757   2HB   PRO 101          2HB       PRO 101  -4.010  13.993  -9.741
  758   1HG   PRO 101          1HG       PRO 101  -2.734  16.449  -8.702
  759   2HG   PRO 101          2HG       PRO 101  -2.911  14.889  -7.922
  760   1HD   PRO 101          1HD       PRO 101  -0.531  15.947  -9.124
  761   2HD   PRO 101          2HD       PRO 101  -0.740  14.344  -8.448
  Start of MODEL    8
    1    H    MET   1           H        MET   1 -17.650   1.940  19.238
    2    HA   MET   1           HA       MET   1 -16.041   3.630  20.786
    3   1HB   MET   1          1HB       MET   1 -17.589   1.436  22.138
    4   2HB   MET   1          2HB       MET   1 -15.889   1.508  22.556
    5   1HG   MET   1          1HG       MET   1 -16.139   3.924  23.169
    6   2HG   MET   1          2HG       MET   1 -17.838   3.857  22.745
    7   1HE   MET   1          1HE       MET   1 -16.569   4.685  25.674
    8   2HE   MET   1          2HE       MET   1 -18.258   4.831  25.134
    9   3HE   MET   1          3HE       MET   1 -17.880   3.992  26.657
   10    H    GLN   2           H        GLN   2 -15.376   2.797  18.394
   11    HA   GLN   2           HA       GLN   2 -13.749   0.412  18.822
   12   1HB   GLN   2          1HB       GLN   2 -15.298   1.421  16.457
   13   2HB   GLN   2          2HB       GLN   2 -13.777   0.618  16.120
   14   1HG   GLN   2          1HG       GLN   2 -15.716  -0.674  18.051
   15   2HG   GLN   2          2HG       GLN   2 -16.032  -0.786  16.331
   16   1HE2  GLN   2          1HE2      GLN   2 -15.058  -2.630  18.596
   17   2HE2  GLN   2          2HE2      GLN   2 -13.726  -3.499  17.910
   18    H    GLU   3           H        GLU   3 -11.923   0.613  16.754
   19    HA   GLU   3           HA       GLU   3 -10.208   2.582  17.774
   20   1HB   GLU   3          1HB       GLU   3  -9.820   0.232  16.489
   21   2HB   GLU   3          2HB       GLU   3  -9.643   1.306  15.116
   22   1HG   GLU   3          1HG       GLU   3  -7.438   1.044  16.047
   23   2HG   GLU   3          2HG       GLU   3  -7.964   2.657  16.489
   24    H    GLN   4           H        GLN   4  -9.140   4.333  16.479
   25    HA   GLN   4           HA       GLN   4 -11.109   5.897  15.244
   26   1HB   GLN   4          1HB       GLN   4  -8.950   6.586  16.566
   27   2HB   GLN   4          2HB       GLN   4  -8.131   6.423  15.026
   28   1HG   GLN   4          1HG       GLN   4  -9.543   8.109  13.993
   29   2HG   GLN   4          2HG       GLN   4 -10.642   8.120  15.358
   30   1HE2  GLN   4          1HE2      GLN   4 -10.478  10.089  16.163
   31   2HE2  GLN   4          2HE2      GLN   4  -9.026  10.870  16.693
   32    H    ALA   5           H        ALA   5 -11.960   5.078  13.330
   33    HA   ALA   5           HA       ALA   5 -10.267   3.868  11.376
   34   1HB   ALA   5          1HB       ALA   5 -12.241   3.082  10.630
   35   2HB   ALA   5          2HB       ALA   5 -12.997   3.896  12.020
   36   3HB   ALA   5          3HB       ALA   5 -12.901   4.725  10.448
   37    H    GLN   6           H        GLN   6 -10.292   4.697   9.036
   38    HA   GLN   6           HA       GLN   6 -10.814   7.360   8.514
   39   1HB   GLN   6          1HB       GLN   6  -8.740   8.467   8.661
   40   2HB   GLN   6          2HB       GLN   6  -8.791   7.531  10.142
   41   1HG   GLN   6          1HG       GLN   6  -7.561   5.669   8.745
   42   2HG   GLN   6          2HG       GLN   6  -7.212   6.958   7.611
   43   1HE2  GLN   6          1HE2      GLN   6  -5.021   6.846   7.986
   44   2HE2  GLN   6          2HE2      GLN   6  -4.264   7.441   9.427
   45    H    GLN   7           H        GLN   7 -11.257   7.240   6.360
   46    HA   GLN   7           HA       GLN   7  -9.514   5.501   4.794
   47   1HB   GLN   7          1HB       GLN   7 -12.061   4.860   5.235
   48   2HB   GLN   7          2HB       GLN   7 -12.370   6.032   3.970
   49   1HG   GLN   7          1HG       GLN   7 -10.748   4.800   2.477
   50   2HG   GLN   7          2HG       GLN   7 -10.535   3.600   3.736
   51   1HE2  GLN   7          1HE2      GLN   7 -12.433   4.700   1.140
   52   2HE2  GLN   7          2HE2      GLN   7 -13.722   3.546   1.214
   53    H    PHE   8           H        PHE   8  -8.133   6.987   3.844
   54    HA   PHE   8           HA       PHE   8  -9.228   9.477   2.873
   55   1HB   PHE   8          1HB       PHE   8  -6.422   8.264   2.575
   56   2HB   PHE   8          2HB       PHE   8  -6.831   9.967   2.507
   57    HD1  PHE   8           1HD      PHE   8  -4.748   8.593   4.285
   58    HD2  PHE   8           2HD      PHE   8  -8.776   9.741   4.967
   59    HE1  PHE   8           1HE      PHE   8  -4.271   8.807   6.740
   60    HE2  PHE   8           2HE      PHE   8  -8.299   9.954   7.422
   61    HZ   PHE   8           HZ       PHE   8  -6.052   9.485   8.279
   62    H    ILE   9           H        ILE   9  -8.696  10.232   0.618
   63    HA   ILE   9           HA       ILE   9  -9.380   8.124  -1.225
   64    HB   ILE   9           HB       ILE   9  -9.231  11.114  -1.325
   65   1HG1  ILE   9          1HG1      ILE   9 -11.544  11.016  -1.686
   66   2HG1  ILE   9          2HG1      ILE   9 -11.503   9.343  -2.203
   67   1HG2  ILE   9          1HG2      ILE   9  -9.974  10.859  -3.762
   68   2HG2  ILE   9          2HG2      ILE   9  -8.244  10.652  -3.399
   69   3HG2  ILE   9          3HG2      ILE   9  -9.272   9.225  -3.676
   70   1HD1  ILE   9          1HD1      ILE   9 -11.037   8.565   0.051
   71   2HD1  ILE   9          2HD1      ILE   9 -10.774  10.229   0.623
   72   3HD1  ILE   9          3HD1      ILE   9 -12.405   9.700   0.145
   73    H    PHE  10           H        PHE  10  -7.832   6.836  -2.060
   74    HA   PHE  10           HA       PHE  10  -5.527   8.072  -3.240
   75   1HB   PHE  10          1HB       PHE  10  -5.032   7.650  -0.730
   76   2HB   PHE  10          2HB       PHE  10  -5.294   5.943  -1.030
   77    HD1  PHE  10           1HD      PHE  10  -3.361   4.716  -1.166
   78    HD2  PHE  10           2HD      PHE  10  -3.339   8.686  -2.665
   79    HE1  PHE  10           1HE      PHE  10  -0.949   4.459  -1.811
   80    HE2  PHE  10           2HE      PHE  10  -0.927   8.429  -3.309
   81    HZ   PHE  10           HZ       PHE  10   0.239   6.319  -2.874
   82    H    LYS  11           H        LYS  11  -4.448   6.665  -4.750
   83    HA   LYS  11           HA       LYS  11  -5.656   4.024  -5.055
   84   1HB   LYS  11          1HB       LYS  11  -5.616   6.210  -7.142
   85   2HB   LYS  11          2HB       LYS  11  -5.736   4.516  -7.572
   86   1HG   LYS  11          1HG       LYS  11  -7.912   4.370  -6.887
   87   2HG   LYS  11          2HG       LYS  11  -7.602   5.252  -5.405
   88   1HD   LYS  11          1HD       LYS  11  -7.627   6.740  -8.046
   89   2HD   LYS  11          2HD       LYS  11  -9.146   6.314  -7.284
   90   1HE   LYS  11          1HE       LYS  11  -8.266   7.428  -5.141
   91   2HE   LYS  11          2HE       LYS  11  -6.914   8.018  -6.088
   92   1HZ   LYS  11          1HZ       LYS  11  -9.673   8.823  -6.165
   93   2HZ   LYS  11          2HZ       LYS  11  -8.322   9.702  -6.429
   94   3HZ   LYS  11          3HZ       LYS  11  -8.924   8.756  -7.615
   95    H    VAL  12           H        VAL  12  -4.268   2.474  -6.031
   96    HA   VAL  12           HA       VAL  12  -1.546   3.447  -6.532
   97    HB   VAL  12           HB       VAL  12  -2.180   2.237  -4.235
   98   1HG1  VAL  12          1HG1      VAL  12  -1.545  -0.167  -4.373
   99   2HG1  VAL  12          2HG1      VAL  12  -3.067   0.208  -5.215
  100   3HG1  VAL  12          3HG1      VAL  12  -1.572  -0.041  -6.148
  101   1HG2  VAL  12          1HG2      VAL  12   0.319   1.140  -4.720
  102   2HG2  VAL  12          2HG2      VAL  12   0.238   2.500  -5.865
  103   3HG2  VAL  12          3HG2      VAL  12  -0.009   2.785  -4.126
  104    H    THR  13           H        THR  13  -0.580   2.601  -8.350
  105    HA   THR  13           HA       THR  13  -2.157   1.415 -10.296
  106    HB   THR  13           HB       THR  13  -0.016   1.209 -11.491
  107    HG1  THR  13           1HG      THR  13   1.095   1.729  -8.827
  108   1HG2  THR  13          1HG2      THR  13   0.740   3.432 -11.384
  109   2HG2  THR  13          2HG2      THR  13  -0.856   3.610 -10.616
  110   3HG2  THR  13          3HG2      THR  13   0.608   3.493  -9.610
  111    H    ASP  14           H        ASP  14  -2.094  -0.705 -11.284
  112    HA   ASP  14           HA       ASP  14  -2.572  -2.682  -9.466
  113   1HB   ASP  14          1HB       ASP  14  -2.518  -2.373 -12.311
  114   2HB   ASP  14          2HB       ASP  14  -1.566  -3.802 -11.962
  115    H    LYS  15           H        LYS  15   0.406  -1.762 -11.281
  116    HA   LYS  15           HA       LYS  15   1.933  -4.011 -10.636
  117   1HB   LYS  15          1HB       LYS  15   2.233  -1.775 -12.211
  118   2HB   LYS  15          2HB       LYS  15   3.387  -1.466 -10.929
  119   1HG   LYS  15          1HG       LYS  15   4.281  -3.838 -11.276
  120   2HG   LYS  15          2HG       LYS  15   3.239  -3.963 -12.679
  121   1HD   LYS  15          1HD       LYS  15   4.360  -1.862 -13.603
  122   2HD   LYS  15          2HD       LYS  15   5.489  -1.941 -12.265
  123   1HE   LYS  15          1HE       LYS  15   6.477  -3.955 -13.037
  124   2HE   LYS  15          2HE       LYS  15   5.081  -4.392 -14.000
  125   1HZ   LYS  15          1HZ       LYS  15   7.014  -3.510 -15.248
  126   2HZ   LYS  15          2HZ       LYS  15   5.609  -2.737 -15.556
  127   3HZ   LYS  15          3HZ       LYS  15   6.730  -2.041 -14.595
  128    H    ALA  16           H        ALA  16   1.413  -0.858  -8.965
  129    HA   ALA  16           HA       ALA  16   3.311  -1.256  -6.961
  130   1HB   ALA  16          1HB       ALA  16   2.301   0.914  -7.454
  131   2HB   ALA  16          2HB       ALA  16   0.696   0.304  -6.985
  132   3HB   ALA  16          3HB       ALA  16   1.975   0.477  -5.760
  133    H    VAL  17           H        VAL  17  -0.206  -2.091  -7.164
  134    HA   VAL  17           HA       VAL  17  -0.315  -3.160  -4.559
  135    HB   VAL  17           HB       VAL  17  -2.030  -2.787  -6.858
  136   1HG1  VAL  17          1HG1      VAL  17  -2.162  -5.119  -7.183
  137   2HG1  VAL  17          2HG1      VAL  17  -2.163  -5.451  -5.434
  138   3HG1  VAL  17          3HG1      VAL  17  -3.591  -4.715  -6.201
  139   1HG2  VAL  17          1HG2      VAL  17  -3.369  -1.914  -5.283
  140   2HG2  VAL  17          2HG2      VAL  17  -3.298  -3.385  -4.283
  141   3HG2  VAL  17          3HG2      VAL  17  -2.009  -2.164  -4.162
  142    H    GLU  18           H        GLU  18  -0.152  -4.742  -7.830
  143    HA   GLU  18           HA       GLU  18   0.072  -7.298  -6.856
  144   1HB   GLU  18          1HB       GLU  18  -0.113  -6.169  -9.336
  145   2HB   GLU  18          2HB       GLU  18   1.572  -6.649  -9.359
  146   1HG   GLU  18          1HG       GLU  18   0.322  -8.895  -8.263
  147   2HG   GLU  18          2HG       GLU  18  -0.864  -8.332  -9.424
  148    H    GLU  19           H        GLU  19   2.400  -4.673  -6.954
  149    HA   GLU  19           HA       GLU  19   4.709  -6.251  -6.939
  150   1HB   GLU  19          1HB       GLU  19   5.079  -4.013  -7.535
  151   2HB   GLU  19          2HB       GLU  19   4.044  -3.388  -6.266
  152   1HG   GLU  19          1HG       GLU  19   6.439  -2.972  -5.755
  153   2HG   GLU  19          2HG       GLU  19   5.705  -4.004  -4.545
  154    H    ILE  20           H        ILE  20   2.258  -5.623  -4.568
  155    HA   ILE  20           HA       ILE  20   4.016  -6.074  -2.320
  156    HB   ILE  20           HB       ILE  20   1.014  -5.942  -2.267
  157   1HG1  ILE  20          1HG1      ILE  20   1.396  -4.001  -3.469
  158   2HG1  ILE  20          2HG1      ILE  20   1.448  -3.431  -1.813
  159   1HG2  ILE  20          1HG2      ILE  20   3.243  -5.674  -0.299
  160   2HG2  ILE  20          2HG2      ILE  20   1.781  -4.688  -0.060
  161   3HG2  ILE  20          3HG2      ILE  20   1.654  -6.461  -0.140
  162   1HD1  ILE  20          1HD1      ILE  20   4.071  -4.052  -2.101
  163   2HD1  ILE  20          2HD1      ILE  20   3.672  -3.706  -3.801
  164   3HD1  ILE  20          3HD1      ILE  20   3.408  -2.463  -2.555
  165    H    LYS  21           H        LYS  21   1.515  -7.790  -4.249
  166    HA   LYS  21           HA       LYS  21   1.370 -10.043  -2.596
  167   1HB   LYS  21          1HB       LYS  21   0.823  -9.724  -5.562
  168   2HB   LYS  21          2HB       LYS  21   0.376 -11.123  -4.607
  169   1HG   LYS  21          1HG       LYS  21  -0.888  -9.501  -3.048
  170   2HG   LYS  21          2HG       LYS  21  -0.617  -8.261  -4.256
  171   1HD   LYS  21          1HD       LYS  21  -1.874 -10.921  -5.021
  172   2HD   LYS  21          2HD       LYS  21  -2.851  -9.634  -4.343
  173   1HE   LYS  21          1HE       LYS  21  -2.373  -8.150  -6.172
  174   2HE   LYS  21          2HE       LYS  21  -1.015  -9.116  -6.714
  175   1HZ   LYS  21          1HZ       LYS  21  -3.161  -9.363  -7.956
  176   2HZ   LYS  21          2HZ       LYS  21  -2.442 -10.756  -7.496
  177   3HZ   LYS  21          3HZ       LYS  21  -3.737 -10.195  -6.673
  178    H    LYS  22           H        LYS  22   3.504  -9.163  -5.362
  179    HA   LYS  22           HA       LYS  22   4.745 -11.654  -5.581
  180   1HB   LYS  22          1HB       LYS  22   6.214 -10.603  -7.049
  181   2HB   LYS  22          2HB       LYS  22   4.755  -9.644  -7.185
  182   1HG   LYS  22          1HG       LYS  22   5.957  -7.806  -6.629
  183   2HG   LYS  22          2HG       LYS  22   6.197  -8.482  -5.031
  184   1HD   LYS  22          1HD       LYS  22   7.975  -9.088  -7.440
  185   2HD   LYS  22          2HD       LYS  22   8.351  -7.896  -6.213
  186   1HE   LYS  22          1HE       LYS  22   8.221  -9.739  -4.465
  187   2HE   LYS  22          2HE       LYS  22   8.003 -10.898  -5.761
  188   1HZ   LYS  22          1HZ       LYS  22  10.328 -10.519  -4.965
  189   2HZ   LYS  22          2HZ       LYS  22  10.117 -10.433  -6.582
  190   3HZ   LYS  22          3HZ       LYS  22  10.287  -9.065  -5.707
  191    H    VAL  23           H        VAL  23   5.035  -9.041  -3.236
  192    HA   VAL  23           HA       VAL  23   7.549 -10.098  -2.242
  193    HB   VAL  23           HB       VAL  23   5.887  -7.658  -1.837
  194   1HG1  VAL  23          1HG1      VAL  23   7.733  -8.842   0.246
  195   2HG1  VAL  23          2HG1      VAL  23   7.416  -7.093   0.146
  196   3HG1  VAL  23          3HG1      VAL  23   6.075  -8.225   0.444
  197   1HG2  VAL  23          1HG2      VAL  23   7.894  -7.904  -3.414
  198   2HG2  VAL  23          2HG2      VAL  23   7.891  -6.505  -2.313
  199   3HG2  VAL  23          3HG2      VAL  23   8.898  -7.925  -1.944
  200    H    ALA  24           H        ALA  24   4.055 -10.057  -1.543
  201    HA   ALA  24           HA       ALA  24   4.342 -11.089   1.094
  202   1HB   ALA  24          1HB       ALA  24   2.377  -9.793  -0.182
  203   2HB   ALA  24          2HB       ALA  24   1.839 -11.457  -0.514
  204   3HB   ALA  24          3HB       ALA  24   2.045 -10.907   1.166
  205    H    GLN  25           H        GLN  25   3.539 -12.478  -2.155
  206    HA   GLN  25           HA       GLN  25   3.163 -15.057  -1.241
  207   1HB   GLN  25          1HB       GLN  25   3.561 -15.699  -3.644
  208   2HB   GLN  25          2HB       GLN  25   2.402 -14.401  -3.444
  209   1HG   GLN  25          1HG       GLN  25   3.654 -13.166  -4.876
  210   2HG   GLN  25          2HG       GLN  25   4.877 -13.064  -3.625
  211   1HE2  GLN  25          1HE2      GLN  25   6.605 -14.525  -3.590
  212   2HE2  GLN  25          2HE2      GLN  25   7.109 -15.401  -4.997
  213    H    GLU  26           H        GLU  26   6.072 -13.153  -1.735
  214    HA   GLU  26           HA       GLU  26   7.764 -15.433  -1.960
  215   1HB   GLU  26          1HB       GLU  26   8.012 -12.786  -2.665
  216   2HB   GLU  26          2HB       GLU  26   8.951 -12.812  -1.185
  217   1HG   GLU  26          1HG       GLU  26   9.807 -15.138  -2.464
  218   2HG   GLU  26          2HG       GLU  26   9.542 -14.052  -3.813
  219    H    ASN  27           H        ASN  27   6.172 -13.739   0.591
  220    HA   ASN  27           HA       ASN  27   8.116 -14.783   2.493
  221   1HB   ASN  27          1HB       ASN  27   6.115 -12.484   2.641
  222   2HB   ASN  27          2HB       ASN  27   6.804 -13.167   4.100
  223   1HD2  ASN  27          1HD2      ASN  27   7.131 -10.861   1.755
  224   2HD2  ASN  27          2HD2      ASN  27   8.803 -10.444   1.932
  225    H    ASN  28           H        ASN  28   5.367 -15.671   0.943
  226    HA   ASN  28           HA       ASN  28   3.714 -17.020   1.324
  227   1HB   ASN  28          1HB       ASN  28   5.742 -18.070   2.855
  228   2HB   ASN  28          2HB       ASN  28   4.546 -17.795   4.106
  229   1HD2  ASN  28          1HD2      ASN  28   5.717 -20.048   2.140
  230   2HD2  ASN  28          2HD2      ASN  28   4.335 -21.053   1.858
  231    H    ILE  29           H        ILE  29   3.459 -14.233   2.139
  232    HA   ILE  29           HA       ILE  29   1.928 -14.378   4.621
  233    HB   ILE  29           HB       ILE  29   3.071 -12.093   3.023
  234   1HG1  ILE  29          1HG1      ILE  29   3.612 -12.899   5.889
  235   2HG1  ILE  29          2HG1      ILE  29   4.547 -13.509   4.539
  236   1HG2  ILE  29          1HG2      ILE  29   2.194 -10.659   4.914
  237   2HG2  ILE  29          2HG2      ILE  29   0.980 -11.264   3.761
  238   3HG2  ILE  29          3HG2      ILE  29   1.152 -12.032   5.358
  239   1HD1  ILE  29          1HD1      ILE  29   5.615 -11.510   5.572
  240   2HD1  ILE  29          2HD1      ILE  29   5.163 -11.205   3.877
  241   3HD1  ILE  29          3HD1      ILE  29   4.162 -10.552   5.197
  242    H    GLU  30           H        GLU  30  -0.276 -14.222   4.674
  243    HA   GLU  30           HA       GLU  30  -1.526 -13.882   2.063
  244   1HB   GLU  30          1HB       GLU  30  -1.825 -15.894   4.068
  245   2HB   GLU  30          2HB       GLU  30  -3.320 -14.980   4.063
  246   1HG   GLU  30          1HG       GLU  30  -3.589 -15.325   1.640
  247   2HG   GLU  30          2HG       GLU  30  -2.015 -16.088   1.534
  248    H    ASN  31           H        ASN  31  -0.674 -11.989   4.514
  249    HA   ASN  31           HA       ASN  31  -3.023 -10.366   4.201
  250   1HB   ASN  31          1HB       ASN  31  -3.242 -11.838   6.351
  251   2HB   ASN  31          2HB       ASN  31  -1.927 -10.882   7.005
  252   1HD2  ASN  31          1HD2      ASN  31  -2.640  -9.427   8.349
  253   2HD2  ASN  31          2HD2      ASN  31  -4.041  -8.423   8.172
  254    HA   PRO  32           HA       PRO  32   1.079  -8.284   4.359
  255   1HB   PRO  32          1HB       PRO  32   1.100  -7.232   1.836
  256   2HB   PRO  32          2HB       PRO  32   1.867  -8.754   2.247
  257   1HG   PRO  32          1HG       PRO  32  -0.661  -8.287   0.788
  258   2HG   PRO  32          2HG       PRO  32   0.326  -9.734   0.839
  259   1HD   PRO  32          1HD       PRO  32  -2.135  -9.285   2.242
  260   2HD   PRO  32          2HD       PRO  32  -1.090 -10.684   2.382
  261    H    ILE  33           H        ILE  33   1.526  -6.205   4.992
  262    HA   ILE  33           HA       ILE  33  -0.744  -4.392   4.566
  263    HB   ILE  33           HB       ILE  33   0.867  -4.812   7.084
  264   1HG1  ILE  33          1HG1      ILE  33  -2.095  -4.959   7.079
  265   2HG1  ILE  33          2HG1      ILE  33  -1.273  -6.256   6.233
  266   1HG2  ILE  33          1HG2      ILE  33  -1.422  -2.983   7.207
  267   2HG2  ILE  33          2HG2      ILE  33   0.214  -2.832   7.890
  268   3HG2  ILE  33          3HG2      ILE  33  -0.085  -2.393   6.191
  269   1HD1  ILE  33          1HD1      ILE  33  -1.622  -5.983   9.039
  270   2HD1  ILE  33          2HD1      ILE  33  -0.660  -7.216   8.189
  271   3HD1  ILE  33          3HD1      ILE  33   0.110  -5.707   8.734
  272    H    LEU  34           H        LEU  34   0.055  -3.109   2.945
  273    HA   LEU  34           HA       LEU  34   2.817  -2.222   3.164
  274   1HB   LEU  34          1HB       LEU  34   1.361  -3.061   1.049
  275   2HB   LEU  34          2HB       LEU  34   1.088  -1.334   0.932
  276    HG   LEU  34           HG       LEU  34   2.950  -1.993  -0.468
  277   1HD1  LEU  34          1HD1      LEU  34   2.977   0.224   0.666
  278   2HD1  LEU  34          2HD1      LEU  34   4.016  -0.479   1.929
  279   3HD1  LEU  34          3HD1      LEU  34   4.593  -0.394   0.247
  280   1HD2  LEU  34          1HD2      LEU  34   5.010  -2.942   0.427
  281   2HD2  LEU  34          2HD2      LEU  34   4.292  -3.007   2.054
  282   3HD2  LEU  34          3HD2      LEU  34   3.625  -4.014   0.746
  283    H    ARG  35           H        ARG  35   3.424  -0.190   3.783
  284    HA   ARG  35           HA       ARG  35   1.207   1.582   4.416
  285   1HB   ARG  35          1HB       ARG  35   2.698   2.594   6.113
  286   2HB   ARG  35          2HB       ARG  35   2.593   0.864   6.366
  287   1HG   ARG  35          1HG       ARG  35   4.769   0.470   5.478
  288   2HG   ARG  35          2HG       ARG  35   4.813   2.010   4.642
  289   1HD   ARG  35          1HD       ARG  35   5.664   3.083   6.465
  290   2HD   ARG  35          2HD       ARG  35   4.444   2.406   7.526
  291    HE   ARG  35           HE       ARG  35   6.359   0.369   6.819
  292   1HH1  ARG  35          2HH2      ARG  35   5.999   3.233   8.831
  293   2HH1  ARG  35          1HH2      ARG  35   7.175   2.720   9.994
  294   1HH2  ARG  35          2HH1      ARG  35   7.911  -0.309   8.354
  295   2HH2  ARG  35          1HH1      ARG  35   8.270   0.692   9.721
  296    H    ILE  36           H        ILE  36   1.398   3.861   3.860
  297    HA   ILE  36           HA       ILE  36   3.349   4.311   1.722
  298    HB   ILE  36           HB       ILE  36   0.563   5.204   2.245
  299   1HG1  ILE  36          1HG1      ILE  36   0.628   5.010  -0.343
  300   2HG1  ILE  36          2HG1      ILE  36   2.170   4.211  -0.105
  301   1HG2  ILE  36          1HG2      ILE  36   0.860   7.093   0.634
  302   2HG2  ILE  36          2HG2      ILE  36   1.633   7.344   2.218
  303   3HG2  ILE  36          3HG2      ILE  36   2.620   6.896   0.806
  304   1HD1  ILE  36          1HD1      ILE  36  -0.570   3.240   0.483
  305   2HD1  ILE  36          2HD1      ILE  36   0.913   2.319   0.135
  306   3HD1  ILE  36          3HD1      ILE  36   0.607   2.925   1.780
  307    H    ARG  37           H        ARG  37   5.173   5.287   2.423
  308    HA   ARG  37           HA       ARG  37   4.773   7.449   4.331
  309   1HB   ARG  37          1HB       ARG  37   6.092   5.127   4.945
  310   2HB   ARG  37          2HB       ARG  37   7.429   6.048   4.286
  311   1HG   ARG  37          1HG       ARG  37   5.894   7.776   6.037
  312   2HG   ARG  37          2HG       ARG  37   6.235   6.283   6.888
  313   1HD   ARG  37          1HD       ARG  37   8.594   7.219   5.401
  314   2HD   ARG  37          2HD       ARG  37   8.013   8.448   6.506
  315    HE   ARG  37           HE       ARG  37   8.031   5.930   7.873
  316   1HH1  ARG  37          2HH2      ARG  37  10.263   8.326   6.586
  317   2HH1  ARG  37          1HH2      ARG  37  11.521   7.948   7.716
  318   1HH2  ARG  37          2HH1      ARG  37   9.689   5.431   9.364
  319   2HH2  ARG  37          1HH1      ARG  37  11.192   6.290   9.306
  320    H    VAL  38           H        VAL  38   6.487   9.193   4.183
  321    HA   VAL  38           HA       VAL  38   7.259   9.527   1.395
  322    HB   VAL  38           HB       VAL  38   7.615  11.619   3.495
  323   1HG1  VAL  38          1HG1      VAL  38   6.391  12.735   1.290
  324   2HG1  VAL  38          2HG1      VAL  38   8.145  12.683   1.588
  325   3HG1  VAL  38          3HG1      VAL  38   7.377  11.440   0.571
  326   1HG2  VAL  38          1HG2      VAL  38   5.489  11.283   4.203
  327   2HG2  VAL  38          2HG2      VAL  38   5.077  12.159   2.709
  328   3HG2  VAL  38          3HG2      VAL  38   5.027  10.380   2.741
  329    H    VAL  39           H        VAL  39   9.388   9.693   0.703
  330    HA   VAL  39           HA       VAL  39  11.516   9.991   2.567
  331    HB   VAL  39           HB       VAL  39  10.994   7.681   3.037
  332   1HG1  VAL  39          1HG1      VAL  39  10.410   6.122   1.521
  333   2HG1  VAL  39          2HG1      VAL  39  10.160   7.502   0.425
  334   3HG1  VAL  39          3HG1      VAL  39  11.695   6.603   0.387
  335   1HG2  VAL  39          1HG2      VAL  39  13.215   7.583   3.307
  336   2HG2  VAL  39          2HG2      VAL  39  13.273   6.790   1.715
  337   3HG2  VAL  39          3HG2      VAL  39  13.515   8.549   1.842
  338    HA   PRO  40           HA       PRO  40  12.648  11.486  -1.416
  339   1HB   PRO  40          1HB       PRO  40  14.465  13.334  -0.549
  340   2HB   PRO  40          2HB       PRO  40  12.755  13.678  -0.720
  341   1HG   PRO  40          1HG       PRO  40  14.313  13.214   1.748
  342   2HG   PRO  40          2HG       PRO  40  12.740  13.964   1.568
  343   1HD   PRO  40          1HD       PRO  40  13.278  11.307   2.506
  344   2HD   PRO  40          2HD       PRO  40  11.702  12.017   2.215
  345    H    GLY  41           H        GLY  41  14.715  11.765  -2.702
  346   1HA   GLY  41          1HA       GLY  41  16.780   9.968  -1.614
  347   2HA   GLY  41          2HA       GLY  41  16.065   9.631  -3.178
  348    H    GLY  42           H        GLY  42  15.756  12.164  -4.324
  349   1HA   GLY  42          1HA       GLY  42  16.966  14.138  -4.806
  350   2HA   GLY  42          2HA       GLY  42  18.432  13.389  -4.206
  351    H    CYS  43           H        CYS  43  18.890  11.108  -5.436
  352    HA   CYS  43           HA       CYS  43  19.232  11.892  -8.161
  353   1HB   CYS  43          1HB       CYS  43  20.611  10.236  -6.373
  354   2HB   CYS  43          2HB       CYS  43  19.951   9.129  -7.561
  355    HG   CYS  43           HG       CYS  43  22.533  10.397  -7.830
  356    H    SER  44           H        SER  44  17.356   9.477  -6.241
  357    HA   SER  44           HA       SER  44  16.246   8.295  -8.561
  358   1HB   SER  44          1HB       SER  44  15.855   8.035  -5.584
  359   2HB   SER  44          2HB       SER  44  14.605   7.399  -6.635
  360    HG   SER  44           HG       SER  44  16.214   5.786  -6.137
  361    H    GLY  45           H        GLY  45  15.208  10.696  -6.075
  362   1HA   GLY  45          1HA       GLY  45  13.855  12.534  -6.957
  363   2HA   GLY  45          2HA       GLY  45  12.887  11.338  -7.796
  364    H    PHE  46           H        PHE  46  11.332  12.851  -6.328
  365    HA   PHE  46           HA       PHE  46  11.193  11.919  -3.607
  366   1HB   PHE  46          1HB       PHE  46  10.676  14.288  -4.678
  367   2HB   PHE  46          2HB       PHE  46   9.174  13.568  -5.222
  368    HD1  PHE  46           1HD      PHE  46  10.902  15.089  -2.475
  369    HD2  PHE  46           2HD      PHE  46   7.576  12.653  -3.479
  370    HE1  PHE  46           1HE      PHE  46   9.847  15.617  -0.260
  371    HE2  PHE  46           2HE      PHE  46   6.521  13.181  -1.263
  372    HZ   PHE  46           HZ       PHE  46   7.669  14.656   0.320
  373    H    GLN  47           H        GLN  47  10.458   9.843  -3.331
  374    HA   GLN  47           HA       GLN  47   7.821   9.325  -4.373
  375   1HB   GLN  47          1HB       GLN  47   8.648   6.940  -5.012
  376   2HB   GLN  47          2HB       GLN  47   8.977   8.255  -6.123
  377   1HG   GLN  47          1HG       GLN  47  11.147   8.208  -4.250
  378   2HG   GLN  47          2HG       GLN  47  10.863   6.545  -4.725
  379   1HE2  GLN  47          1HE2      GLN  47  10.882   9.790  -6.203
  380   2HE2  GLN  47          2HE2      GLN  47  11.786   9.379  -7.622
  381    H    TYR  48           H        TYR  48   6.844   7.317  -3.300
  382    HA   TYR  48           HA       TYR  48   7.801   7.236  -0.538
  383   1HB   TYR  48          1HB       TYR  48   5.242   6.369  -2.022
  384   2HB   TYR  48          2HB       TYR  48   5.446   6.202  -0.290
  385    HD1  TYR  48           1HD      TYR  48   4.492   7.838   1.044
  386    HD2  TYR  48           2HD      TYR  48   5.763   8.885  -2.905
  387    HE1  TYR  48           1HE      TYR  48   3.590  10.193   1.370
  388    HE2  TYR  48           2HE      TYR  48   4.856  11.236  -2.566
  389    HH   TYR  48           HH       TYR  48   4.389  12.624   0.054
  390    H    ALA  49           H        ALA  49   8.839   5.477   0.260
  391    HA   ALA  49           HA       ALA  49   9.173   3.199  -1.458
  392   1HB   ALA  49          1HB       ALA  49  10.945   2.680  -0.068
  393   2HB   ALA  49          2HB       ALA  49  10.830   4.430   0.231
  394   3HB   ALA  49          3HB       ALA  49  10.119   3.281   1.390
  395    H    MET  50           H        MET  50   8.653   0.980  -0.825
  396    HA   MET  50           HA       MET  50   6.126   0.942   0.560
  397   1HB   MET  50          1HB       MET  50   7.704  -1.108  -1.084
  398   2HB   MET  50          2HB       MET  50   6.187  -1.509  -0.302
  399   1HG   MET  50          1HG       MET  50   4.936  -0.002  -1.670
  400   2HG   MET  50          2HG       MET  50   6.359   0.906  -2.138
  401   1HE   MET  50          1HE       MET  50   3.868  -0.596  -3.416
  402   2HE   MET  50          2HE       MET  50   4.722  -0.028  -4.871
  403   3HE   MET  50          3HE       MET  50   4.313  -1.751  -4.694
  404    H    GLY  51           H        GLY  51   5.783  -1.300   1.865
  405   1HA   GLY  51          1HA       GLY  51   7.940  -2.461   3.217
  406   2HA   GLY  51          2HA       GLY  51   7.377  -1.106   4.176
  407    H    PHE  52           H        PHE  52   7.126  -4.328   4.069
  408    HA   PHE  52           HA       PHE  52   4.241  -4.366   4.581
  409   1HB   PHE  52          1HB       PHE  52   4.822  -6.947   4.388
  410   2HB   PHE  52          2HB       PHE  52   4.809  -5.999   2.914
  411    HD1  PHE  52           1HD      PHE  52   6.917  -7.740   5.341
  412    HD2  PHE  52           2HD      PHE  52   6.881  -5.457   1.764
  413    HE1  PHE  52           1HE      PHE  52   9.284  -8.435   4.874
  414    HE2  PHE  52           2HE      PHE  52   9.248  -6.151   1.297
  415    HZ   PHE  52           HZ       PHE  52  10.421  -7.632   2.858
  416    H    ASP  53           H        ASP  53   3.809  -4.079   6.726
  417    HA   ASP  53           HA       ASP  53   5.676  -5.310   8.585
  418   1HB   ASP  53          1HB       ASP  53   3.688  -3.024   8.799
  419   2HB   ASP  53          2HB       ASP  53   4.266  -3.822  10.248
  420    H    ASP  54           H        ASP  54   4.321  -5.902  10.793
  421    HA   ASP  54           HA       ASP  54   1.881  -7.236   9.922
  422   1HB   ASP  54          1HB       ASP  54   4.052  -8.278  11.801
  423   2HB   ASP  54          2HB       ASP  54   2.499  -9.060  11.587
  424    H    THR  55           H        THR  55   1.363  -4.857  10.923
  425    HA   THR  55           HA       THR  55   0.070  -5.260  13.360
  426    HB   THR  55           HB       THR  55   2.399  -5.281  14.278
  427    HG1  THR  55           1HG      THR  55   1.920  -3.231  15.618
  428   1HG2  THR  55          1HG2      THR  55   3.257  -3.600  12.439
  429   2HG2  THR  55          2HG2      THR  55   2.559  -2.345  13.491
  430   3HG2  THR  55          3HG2      THR  55   3.856  -3.399  14.102
  431    H    VAL  56           H        VAL  56  -1.228  -3.459  13.978
  432    HA   VAL  56           HA       VAL  56  -1.494  -1.573  11.769
  433    HB   VAL  56           HB       VAL  56  -3.269  -2.939  13.629
  434   1HG1  VAL  56          1HG1      VAL  56  -4.872  -1.135  13.963
  435   2HG1  VAL  56          2HG1      VAL  56  -3.310  -0.709  14.704
  436   3HG1  VAL  56          3HG1      VAL  56  -3.785   0.016  13.149
  437   1HG2  VAL  56          1HG2      VAL  56  -4.917  -2.095  11.769
  438   2HG2  VAL  56          2HG2      VAL  56  -3.418  -1.655  10.915
  439   3HG2  VAL  56          3HG2      VAL  56  -3.708  -3.345  11.391
  440    H    GLU  57           H        GLU  57  -1.843   0.739  12.242
  441    HA   GLU  57           HA       GLU  57  -0.142   1.500  14.455
  442   1HB   GLU  57          1HB       GLU  57  -1.236   3.296  12.254
  443   2HB   GLU  57          2HB       GLU  57   0.118   3.623  13.318
  444   1HG   GLU  57          1HG       GLU  57   0.115   1.220  11.449
  445   2HG   GLU  57          2HG       GLU  57   0.646   2.798  10.904
  446    H    GLU  58           H        GLU  58  -0.831   3.752  15.499
  447    HA   GLU  58           HA       GLU  58  -3.433   3.262  16.564
  448   1HB   GLU  58          1HB       GLU  58  -1.037   4.436  17.499
  449   2HB   GLU  58          2HB       GLU  58  -2.180   5.762  17.432
  450   1HG   GLU  58          1HG       GLU  58  -3.796   4.513  18.806
  451   2HG   GLU  58          2HG       GLU  58  -2.787   3.081  18.762
  452    H    GLY  59           H        GLY  59  -3.658   3.827  13.830
  453   1HA   GLY  59          1HA       GLY  59  -5.632   5.298  13.262
  454   2HA   GLY  59          2HA       GLY  59  -4.604   6.626  13.763
  455    H    ASP  60           H        ASP  60  -4.661   3.768  11.530
  456    HA   ASP  60           HA       ASP  60  -3.083   5.403   9.702
  457   1HB   ASP  60          1HB       ASP  60  -2.641   2.738  10.709
  458   2HB   ASP  60          2HB       ASP  60  -3.016   2.594   9.003
  459    H    HIS  61           H        HIS  61  -3.838   5.448   7.489
  460    HA   HIS  61           HA       HIS  61  -6.581   4.984   7.148
  461   1HB   HIS  61          1HB       HIS  61  -5.547   6.756   5.950
  462   2HB   HIS  61          2HB       HIS  61  -4.331   5.697   5.264
  463    HD1  HIS  61           1HD      HIS  61  -7.772   4.305   5.170
  464    HD2  HIS  61           2HD      HIS  61  -5.312   6.638   2.700
  465    HE1  HIS  61           1HE      HIS  61  -8.851   4.281   2.858
  466    H    VAL  62           H        VAL  62  -7.188   2.838   7.495
  467    HA   VAL  62           HA       VAL  62  -5.727   0.713   6.265
  468    HB   VAL  62           HB       VAL  62  -7.494   1.019   8.384
  469   1HG1  VAL  62          1HG1      VAL  62  -9.263  -0.693   7.885
  470   2HG1  VAL  62          2HG1      VAL  62  -9.451   0.841   7.000
  471   3HG1  VAL  62          3HG1      VAL  62  -8.799  -0.592   6.169
  472   1HG2  VAL  62          1HG2      VAL  62  -5.538  -0.675   7.733
  473   2HG2  VAL  62          2HG2      VAL  62  -6.729  -1.048   9.002
  474   3HG2  VAL  62          3HG2      VAL  62  -6.922  -1.734   7.371
  475    H    PHE  63           H        PHE  63  -5.755   0.481   4.082
  476    HA   PHE  63           HA       PHE  63  -8.357   0.863   2.775
  477   1HB   PHE  63          1HB       PHE  63  -5.776   2.029   2.368
  478   2HB   PHE  63          2HB       PHE  63  -5.919   0.840   1.088
  479    HD1  PHE  63           1HD      PHE  63  -9.038   1.171   0.926
  480    HD2  PHE  63           2HD      PHE  63  -5.785   3.895   0.837
  481    HE1  PHE  63           1HE      PHE  63 -10.421   2.779  -0.415
  482    HE2  PHE  63           2HE      PHE  63  -7.169   5.503  -0.504
  483    HZ   PHE  63           HZ       PHE  63  -9.470   4.926  -1.114
  484    H    GLU  64           H        GLU  64  -9.275  -0.971   1.995
  485    HA   GLU  64           HA       GLU  64  -7.748  -3.362   2.009
  486   1HB   GLU  64          1HB       GLU  64 -10.594  -2.821   1.050
  487   2HB   GLU  64          2HB       GLU  64  -9.892  -4.413   1.262
  488   1HG   GLU  64          1HG       GLU  64  -9.471  -3.846   3.699
  489   2HG   GLU  64          2HG       GLU  64 -10.306  -2.325   3.454
  490    H    TYR  65           H        TYR  65  -6.627  -4.268   0.328
  491    HA   TYR  65           HA       TYR  65  -7.003  -3.027  -2.305
  492   1HB   TYR  65          1HB       TYR  65  -4.796  -4.370  -0.692
  493   2HB   TYR  65          2HB       TYR  65  -4.696  -4.498  -2.437
  494    HD1  TYR  65           1HD      TYR  65  -2.541  -3.268  -2.347
  495    HD2  TYR  65           2HD      TYR  65  -6.200  -1.477  -1.041
  496    HE1  TYR  65           1HE      TYR  65  -1.461  -0.968  -2.451
  497    HE2  TYR  65           2HE      TYR  65  -5.108   0.816  -1.149
  498    HH   TYR  65           HH       TYR  65  -1.744   1.196  -1.474
  499    H    ASP  66           H        ASP  66  -5.828  -4.962  -3.923
  500    HA   ASP  66           HA       ASP  66  -7.978  -6.688  -4.267
  501   1HB   ASP  66          1HB       ASP  66  -6.051  -5.817  -5.896
  502   2HB   ASP  66          2HB       ASP  66  -5.227  -7.277  -5.387
  503    H    GLY  67           H        GLY  67  -7.892  -7.553  -1.905
  504   1HA   GLY  67          1HA       GLY  67  -7.662  -9.427  -0.651
  505   2HA   GLY  67          2HA       GLY  67  -6.656 -10.143  -1.895
  506    H    VAL  68           H        VAL  68  -6.071  -6.935  -0.382
  507    HA   VAL  68           HA       VAL  68  -4.035  -8.032   1.342
  508    HB   VAL  68           HB       VAL  68  -3.415  -6.351  -1.082
  509   1HG1  VAL  68          1HG1      VAL  68  -1.833  -6.668   1.475
  510   2HG1  VAL  68          2HG1      VAL  68  -1.056  -6.271  -0.077
  511   3HG1  VAL  68          3HG1      VAL  68  -2.276  -5.174   0.614
  512   1HG2  VAL  68          1HG2      VAL  68  -3.214  -8.625  -1.628
  513   2HG2  VAL  68          2HG2      VAL  68  -1.552  -8.129  -1.229
  514   3HG2  VAL  68          3HG2      VAL  68  -2.517  -9.042  -0.044
  515    H    LYS  69           H        LYS  69  -3.189  -6.365   2.842
  516    HA   LYS  69           HA       LYS  69  -5.186  -4.243   3.158
  517   1HB   LYS  69          1HB       LYS  69  -4.370  -6.193   4.930
  518   2HB   LYS  69          2HB       LYS  69  -3.399  -4.821   5.423
  519   1HG   LYS  69          1HG       LYS  69  -5.633  -3.449   5.276
  520   2HG   LYS  69          2HG       LYS  69  -6.429  -5.011   5.261
  521   1HD   LYS  69          1HD       LYS  69  -4.492  -5.128   7.362
  522   2HD   LYS  69          2HD       LYS  69  -5.280  -3.571   7.515
  523   1HE   LYS  69          1HE       LYS  69  -6.854  -4.782   8.677
  524   2HE   LYS  69          2HE       LYS  69  -7.482  -5.116   7.075
  525   1HZ   LYS  69          1HZ       LYS  69  -7.231  -7.185   7.971
  526   2HZ   LYS  69          2HZ       LYS  69  -5.821  -7.048   7.158
  527   3HZ   LYS  69          3HZ       LYS  69  -5.855  -6.830   8.776
  528    H    VAL  70           H        VAL  70  -4.497  -2.083   3.665
  529    HA   VAL  70           HA       VAL  70  -1.650  -1.578   3.259
  530    HB   VAL  70           HB       VAL  70  -3.921  -0.702   1.538
  531   1HG1  VAL  70          1HG1      VAL  70  -3.129   1.411   2.514
  532   2HG1  VAL  70          2HG1      VAL  70  -1.462   1.011   2.036
  533   3HG1  VAL  70          3HG1      VAL  70  -2.702   1.292   0.790
  534   1HG2  VAL  70          1HG2      VAL  70  -2.691  -2.102   0.260
  535   2HG2  VAL  70          2HG2      VAL  70  -1.658  -0.673   0.017
  536   3HG2  VAL  70          3HG2      VAL  70  -1.225  -1.885   1.246
  537    H    VAL  71           H        VAL  71  -1.061   0.686   3.947
  538    HA   VAL  71           HA       VAL  71  -3.026   1.925   5.690
  539    HB   VAL  71           HB       VAL  71  -1.831   1.733   7.650
  540   1HG1  VAL  71          1HG1      VAL  71  -2.808  -0.411   7.159
  541   2HG1  VAL  71          2HG1      VAL  71  -1.416  -0.873   6.151
  542   3HG1  VAL  71          3HG1      VAL  71  -1.218  -0.685   7.910
  543   1HG2  VAL  71          1HG2      VAL  71   0.502   1.121   7.868
  544   2HG2  VAL  71          2HG2      VAL  71   0.612   0.767   6.127
  545   3HG2  VAL  71          3HG2      VAL  71   0.351   2.438   6.680
  546    H    ILE  72           H        ILE  72  -2.268   4.117   6.415
  547    HA   ILE  72           HA       ILE  72  -0.015   5.168   4.939
  548    HB   ILE  72           HB       ILE  72  -2.665   6.515   4.550
  549   1HG1  ILE  72          1HG1      ILE  72  -1.501   4.407   2.707
  550   2HG1  ILE  72          2HG1      ILE  72  -2.889   4.169   3.750
  551   1HG2  ILE  72          1HG2      ILE  72  -1.192   8.027   3.783
  552   2HG2  ILE  72          2HG2      ILE  72   0.106   6.826   3.587
  553   3HG2  ILE  72          3HG2      ILE  72  -1.154   6.986   2.340
  554   1HD1  ILE  72          1HD1      ILE  72  -2.795   5.394   1.135
  555   2HD1  ILE  72          2HD1      ILE  72  -4.218   5.050   2.147
  556   3HD1  ILE  72          3HD1      ILE  72  -3.362   6.601   2.314
  557    H    ASP  73           H        ASP  73   0.353   7.536   5.582
  558    HA   ASP  73           HA       ASP  73  -0.209   7.675   8.412
  559   1HB   ASP  73          1HB       ASP  73   1.721   9.141   6.565
  560   2HB   ASP  73          2HB       ASP  73   1.483   9.637   8.229
  561    HA   PRO  74           HA       PRO  74  -2.872  11.111   7.833
  562   1HB   PRO  74          1HB       PRO  74  -2.498  12.583  10.105
  563   2HB   PRO  74          2HB       PRO  74  -3.493  11.142  10.050
  564   1HG   PRO  74          1HG       PRO  74  -0.790  11.484  11.195
  565   2HG   PRO  74          2HG       PRO  74  -1.956  10.211  11.494
  566   1HD   PRO  74          1HD       PRO  74   0.386  10.040   9.847
  567   2HD   PRO  74          2HD       PRO  74  -0.841   8.807  10.055
  568    H    PHE  75           H        PHE  75   0.471  11.728   8.280
  569    HA   PHE  75           HA       PHE  75   0.154  14.465   7.386
  570   1HB   PHE  75          1HB       PHE  75   2.000  12.850   8.912
  571   2HB   PHE  75          2HB       PHE  75   2.881  13.364   7.487
  572    HD1  PHE  75           1HD      PHE  75   0.571  14.868  10.017
  573    HD2  PHE  75           2HD      PHE  75   4.079  15.316   7.671
  574    HE1  PHE  75           1HE      PHE  75   1.001  17.098  11.085
  575    HE2  PHE  75           2HE      PHE  75   4.509  17.546   8.740
  576    HZ   PHE  75           HZ       PHE  75   2.965  18.411  10.434
  577    H    SER  76           H        SER  76   0.536  11.317   6.025
  578    HA   SER  76           HA       SER  76   2.000  12.296   3.753
  579   1HB   SER  76          1HB       SER  76   0.867   9.555   4.454
  580   2HB   SER  76          2HB       SER  76   1.725   9.887   2.962
  581    HG   SER  76           HG       SER  76   3.227  10.850   5.015
  582    H    MET  77           H        MET  77  -1.283  11.866   4.842
  583    HA   MET  77           HA       MET  77  -2.558  11.290   2.479
  584   1HB   MET  77          1HB       MET  77  -3.265  11.849   5.117
  585   2HB   MET  77          2HB       MET  77  -3.899  13.259   4.292
  586   1HG   MET  77          1HG       MET  77  -4.466  10.436   3.291
  587   2HG   MET  77          2HG       MET  77  -5.471  11.200   4.507
  588   1HE   MET  77          1HE       MET  77  -6.393  10.770   0.703
  589   2HE   MET  77          2HE       MET  77  -4.973  11.712   0.190
  590   3HE   MET  77          3HE       MET  77  -4.778  10.356   1.327
  591    HA   PRO  78           HA       PRO  78  -2.688  15.984   1.761
  592   1HB   PRO  78          1HB       PRO  78  -1.076  17.623   3.239
  593   2HB   PRO  78          2HB       PRO  78  -2.759  17.329   3.629
  594   1HG   PRO  78          1HG       PRO  78  -0.337  16.267   4.950
  595   2HG   PRO  78          2HG       PRO  78  -1.979  16.338   5.560
  596   1HD   PRO  78          1HD       PRO  78  -0.625  14.024   4.539
  597   2HD   PRO  78          2HD       PRO  78  -2.302  14.121   5.040
  598    H    TYR  79           H        TYR  79  -0.194  13.931   1.828
  599    HA   TYR  79           HA       TYR  79   1.380  15.657   0.039
  600   1HB   TYR  79          1HB       TYR  79   1.998  14.177   2.391
  601   2HB   TYR  79          2HB       TYR  79   2.528  13.115   1.102
  602    HD1  TYR  79           1HD      TYR  79   3.643  15.525   3.296
  603    HD2  TYR  79           2HD      TYR  79   3.855  14.537  -0.862
  604    HE1  TYR  79           1HE      TYR  79   5.802  16.851   3.083
  605    HE2  TYR  79           2HE      TYR  79   6.013  15.866  -1.060
  606    HH   TYR  79           HH       TYR  79   7.763  16.661   0.259
  607    H    VAL  80           H        VAL  80  -0.857  13.125   0.114
  608    HA   VAL  80           HA       VAL  80   0.001  12.292  -2.539
  609    HB   VAL  80           HB       VAL  80  -0.400   9.920  -1.945
  610   1HG1  VAL  80          1HG1      VAL  80   1.890  11.351  -1.752
  611   2HG1  VAL  80          2HG1      VAL  80   1.789  10.702  -0.097
  612   3HG1  VAL  80          3HG1      VAL  80   1.798   9.593  -1.489
  613   1HG2  VAL  80          1HG2      VAL  80  -1.307  11.057   0.515
  614   2HG2  VAL  80          2HG2      VAL  80  -1.307   9.350   0.009
  615   3HG2  VAL  80          3HG2      VAL  80   0.100  10.025   0.866
  616    H    ASN  81           H        ASN  81  -2.043  14.131  -1.591
  617    HA   ASN  81           HA       ASN  81  -4.487  13.017  -1.219
  618   1HB   ASN  81          1HB       ASN  81  -5.389  15.150  -1.884
  619   2HB   ASN  81          2HB       ASN  81  -3.804  15.511  -1.228
  620   1HD2  ASN  81          1HD2      ASN  81  -1.988  15.602  -2.767
  621   2HD2  ASN  81          2HD2      ASN  81  -2.248  16.284  -4.338
  622    H    GLY  82           H        GLY  82  -5.769  11.711  -2.540
  623   1HA   GLY  82          1HA       GLY  82  -6.283  10.449  -4.356
  624   2HA   GLY  82          2HA       GLY  82  -6.520  12.025  -5.086
  625    H    ALA  83           H        ALA  83  -3.305  10.954  -3.978
  626    HA   ALA  83           HA       ALA  83  -2.265  11.334  -6.613
  627   1HB   ALA  83          1HB       ALA  83  -0.224  11.363  -5.554
  628   2HB   ALA  83          2HB       ALA  83  -1.260  11.704  -4.147
  629   3HB   ALA  83          3HB       ALA  83  -0.663  10.052  -4.433
  630    H    GLU  84           H        GLU  84  -0.504   9.475  -7.250
  631    HA   GLU  84           HA       GLU  84  -1.764   6.895  -6.891
  632   1HB   GLU  84          1HB       GLU  84  -1.242   8.220  -9.582
  633   2HB   GLU  84          2HB       GLU  84  -1.467   6.490  -9.415
  634   1HG   GLU  84          1HG       GLU  84  -3.726   6.684  -8.879
  635   2HG   GLU  84          2HG       GLU  84  -3.524   8.240  -8.100
  636    H    LEU  85           H        LEU  85  -0.110   5.776  -5.932
  637    HA   LEU  85           HA       LEU  85   2.606   6.425  -6.477
  638   1HB   LEU  85          1HB       LEU  85   2.443   5.718  -4.352
  639   2HB   LEU  85          2HB       LEU  85   1.088   4.656  -4.678
  640    HG   LEU  85           HG       LEU  85   2.714   3.043  -5.745
  641   1HD1  LEU  85          1HD1      LEU  85   4.549   5.234  -5.149
  642   2HD1  LEU  85          2HD1      LEU  85   5.107   3.670  -4.507
  643   3HD1  LEU  85          3HD1      LEU  85   4.736   3.839  -6.240
  644   1HD2  LEU  85          1HD2      LEU  85   3.826   2.941  -3.142
  645   2HD2  LEU  85          2HD2      LEU  85   2.171   3.577  -2.983
  646   3HD2  LEU  85          3HD2      LEU  85   2.451   2.019  -3.798
  647    H    ASP  86           H        ASP  86   3.489   5.988  -8.433
  648    HA   ASP  86           HA       ASP  86   2.598   3.587  -9.772
  649   1HB   ASP  86          1HB       ASP  86   3.266   6.167 -10.647
  650   2HB   ASP  86          2HB       ASP  86   4.674   5.227 -11.096
  651    H    TYR  87           H        TYR  87   4.065   1.848 -10.232
  652    HA   TYR  87           HA       TYR  87   6.466   1.834  -8.624
  653   1HB   TYR  87          1HB       TYR  87   4.833  -0.088  -8.777
  654   2HB   TYR  87          2HB       TYR  87   5.037  -0.135 -10.516
  655    HD1  TYR  87           1HD      TYR  87   7.555  -0.498 -11.330
  656    HD2  TYR  87           2HD      TYR  87   6.049  -1.583  -7.475
  657    HE1  TYR  87           1HE      TYR  87   9.445  -2.177 -11.056
  658    HE2  TYR  87           2HE      TYR  87   7.944  -3.257  -7.214
  659    HH   TYR  87           HH       TYR  87  10.319  -3.712  -9.820
  660    H    VAL  88           H        VAL  88   8.463   2.340  -9.367
  661    HA   VAL  88           HA       VAL  88   8.897   2.080 -12.261
  662    HB   VAL  88           HB       VAL  88   9.335   4.362 -10.411
  663   1HG1  VAL  88          1HG1      VAL  88  11.641   3.708 -10.998
  664   2HG1  VAL  88          2HG1      VAL  88  11.217   3.787 -12.725
  665   3HG1  VAL  88          3HG1      VAL  88  11.183   5.264 -11.732
  666   1HG2  VAL  88          1HG2      VAL  88   9.185   5.189 -13.095
  667   2HG2  VAL  88          2HG2      VAL  88   8.058   3.818 -12.954
  668   3HG2  VAL  88          3HG2      VAL  88   7.889   5.224 -11.876
  669    H    VAL  89           H        VAL  89  11.261   1.807 -12.818
  670    HA   VAL  89           HA       VAL  89  12.602   0.347 -10.646
  671    HB   VAL  89           HB       VAL  89  12.682  -0.197 -13.621
  672   1HG1  VAL  89          1HG1      VAL  89  13.747  -2.369 -12.803
  673   2HG1  VAL  89          2HG1      VAL  89  14.747  -0.900 -12.700
  674   3HG1  VAL  89          3HG1      VAL  89  13.968  -1.551 -11.238
  675   1HG2  VAL  89          1HG2      VAL  89  11.233  -2.028 -13.290
  676   2HG2  VAL  89          2HG2      VAL  89  11.393  -1.949 -11.519
  677   3HG2  VAL  89          3HG2      VAL  89  10.486  -0.688 -12.388
  678    H    ASP  90           H        ASP  90  14.598   1.073 -10.074
  679    HA   ASP  90           HA       ASP  90  16.258   2.323 -11.987
  680   1HB   ASP  90          1HB       ASP  90  15.205   4.011  -9.668
  681   2HB   ASP  90          2HB       ASP  90  16.456   4.505 -10.791
  682    H    PHE  91           H        PHE  91  17.891   3.774 -10.021
  683    HA   PHE  91           HA       PHE  91  19.695   3.196  -8.826
  684   1HB   PHE  91          1HB       PHE  91  17.457   3.614  -7.341
  685   2HB   PHE  91          2HB       PHE  91  17.700   1.936  -6.899
  686    HD1  PHE  91           1HD      PHE  91  20.082   4.774  -7.399
  687    HD2  PHE  91           2HD      PHE  91  18.544   1.828  -4.760
  688    HE1  PHE  91           1HE      PHE  91  21.740   5.475  -5.650
  689    HE2  PHE  91           2HE      PHE  91  20.203   2.529  -3.011
  690    HZ   PHE  91           HZ       PHE  91  21.781   4.344  -3.477
  691    H    MET  92           H        MET  92  19.362   0.973  -6.635
  692    HA   MET  92           HA       MET  92  20.603  -1.020  -8.225
  693   1HB   MET  92          1HB       MET  92  20.822  -2.191  -6.014
  694   2HB   MET  92          2HB       MET  92  21.324  -0.517  -5.892
  695   1HG   MET  92          1HG       MET  92  19.505   0.086  -4.577
  696   2HG   MET  92          2HG       MET  92  18.422  -1.049  -5.357
  697   1HE   MET  92          1HE       MET  92  19.284  -1.101  -1.495
  698   2HE   MET  92          2HE       MET  92  18.207  -0.443  -2.751
  699   3HE   MET  92          3HE       MET  92  17.890  -2.052  -2.059
  700    H    GLY  93           H        GLY  93  17.359  -0.230  -7.563
  701   1HA   GLY  93          1HA       GLY  93  16.441  -2.734  -8.668
  702   2HA   GLY  93          2HA       GLY  93  15.993  -2.492  -6.991
  703    H    GLY  94           H        GLY  94  14.392  -0.977  -6.425
  704   1HA   GLY  94          1HA       GLY  94  13.270   1.105  -7.085
  705   2HA   GLY  94          2HA       GLY  94  13.153   0.447  -8.705
  706    H    GLY  95           H        GLY  95  10.765   1.093  -7.987
  707   1HA   GLY  95          1HA       GLY  95   8.920  -0.583  -8.191
  708   2HA   GLY  95          2HA       GLY  95   9.529  -1.264  -6.695
  709    H    PHE  96           H        PHE  96  10.173   2.013  -6.459
  710    HA   PHE  96           HA       PHE  96   7.516   2.592  -5.361
  711   1HB   PHE  96          1HB       PHE  96   8.914   3.836  -3.552
  712   2HB   PHE  96          2HB       PHE  96   8.966   2.086  -3.470
  713    HD1  PHE  96           1HD      PHE  96  10.943   0.985  -4.858
  714    HD2  PHE  96           2HD      PHE  96  10.910   4.994  -3.465
  715    HE1  PHE  96           1HE      PHE  96  13.448   1.053  -4.993
  716    HE2  PHE  96           2HE      PHE  96  13.415   5.061  -3.600
  717    HZ   PHE  96           HZ       PHE  96  14.655   3.090  -4.362
  718    H    THR  97           H        THR  97   6.722   4.160  -6.703
  719    HA   THR  97           HA       THR  97   8.277   6.594  -6.947
  720    HB   THR  97           HB       THR  97   7.743   4.652  -9.187
  721    HG1  THR  97           1HG      THR  97   9.906   5.061  -8.585
  722   1HG2  THR  97          1HG2      THR  97   6.497   6.395 -10.207
  723   2HG2  THR  97          2HG2      THR  97   7.391   7.665  -9.339
  724   3HG2  THR  97          3HG2      THR  97   8.161   6.801 -10.691
  725    H    ILE  98           H        ILE  98   7.001   8.443  -7.535
  726    HA   ILE  98           HA       ILE  98   4.119   7.917  -7.426
  727    HB   ILE  98           HB       ILE  98   5.040   8.561  -5.198
  728   1HG1  ILE  98          1HG1      ILE  98   3.349  10.556  -4.978
  729   2HG1  ILE  98          2HG1      ILE  98   2.939  10.159  -6.635
  730   1HG2  ILE  98          1HG2      ILE  98   6.666  10.262  -6.442
  731   2HG2  ILE  98          2HG2      ILE  98   5.323  11.383  -6.111
  732   3HG2  ILE  98          3HG2      ILE  98   6.113  10.520  -4.770
  733   1HD1  ILE  98          1HD1      ILE  98   1.968   8.888  -4.316
  734   2HD1  ILE  98          2HD1      ILE  98   1.771   8.324  -5.993
  735   3HD1  ILE  98          3HD1      ILE  98   3.130   7.731  -5.008
  736    H    ARG  99           H        ARG  99   3.051   8.828  -9.100
  737    HA   ARG  99           HA       ARG  99   4.476  10.967 -10.469
  738   1HB   ARG  99          1HB       ARG  99   3.379   8.483 -11.449
  739   2HB   ARG  99          2HB       ARG  99   2.428   9.781 -12.144
  740   1HG   ARG  99          1HG       ARG  99   5.415  10.134 -12.149
  741   2HG   ARG  99          2HG       ARG  99   4.760   8.928 -13.239
  742   1HD   ARG  99          1HD       ARG  99   4.155  10.566 -14.688
  743   2HD   ARG  99          2HD       ARG  99   3.078  11.240 -13.481
  744    HE   ARG  99           HE       ARG  99   5.914  11.951 -13.116
  745   1HH1  ARG  99          2HH2      ARG  99   2.830  12.865 -14.544
  746   2HH1  ARG  99          1HH2      ARG  99   3.247  14.541 -14.684
  747   1HH2  ARG  99          2HH1      ARG  99   6.464  14.161 -13.301
  748   2HH2  ARG  99          1HH1      ARG  99   5.327  15.283 -13.973
  749    H    ASN 100           H        ASN 100   3.507  12.807  -9.550
  750    HA   ASN 100           HA       ASN 100   0.688  12.805  -9.112
  751   1HB   ASN 100          1HB       ASN 100   2.986  14.708  -8.610
  752   2HB   ASN 100          2HB       ASN 100   1.369  15.382  -8.644
  753   1HD2  ASN 100          1HD2      ASN 100   2.291  15.785  -6.372
  754   2HD2  ASN 100          2HD2      ASN 100   1.844  14.649  -5.143
  755    HA   PRO 101           HA       PRO 101  -0.276  14.846 -12.872
  756   1HB   PRO 101          1HB       PRO 101  -2.531  16.246 -12.226
  757   2HB   PRO 101          2HB       PRO 101  -2.537  14.530 -12.579
  758   1HG   PRO 101          1HG       PRO 101  -2.771  15.884  -9.962
  759   2HG   PRO 101          2HG       PRO 101  -3.193  14.237 -10.387
  760   1HD   PRO 101          1HD       PRO 101  -0.865  15.096  -8.948
  761   2HD   PRO 101          2HD       PRO 101  -1.230  13.464  -9.474
  Start of MODEL    9
    1    H    MET   1           H        MET   1 -14.657   9.246  22.271
    2    HA   MET   1           HA       MET   1 -14.377   6.406  21.742
    3   1HB   MET   1          1HB       MET   1 -16.421   6.217  23.172
    4   2HB   MET   1          2HB       MET   1 -15.176   7.129  24.001
    5   1HG   MET   1          1HG       MET   1 -16.458   9.016  24.064
    6   2HG   MET   1          2HG       MET   1 -16.859   8.896  22.363
    7   1HE   MET   1          1HE       MET   1 -18.939  10.077  23.755
    8   2HE   MET   1          2HE       MET   1 -19.478   9.306  22.244
    9   3HE   MET   1          3HE       MET   1 -20.418   9.089  23.739
   10    H    GLN   2           H        GLN   2 -14.461   7.226  19.330
   11    HA   GLN   2           HA       GLN   2 -17.155   6.748  18.488
   12   1HB   GLN   2          1HB       GLN   2 -16.607   9.361  18.768
   13   2HB   GLN   2          2HB       GLN   2 -15.852   9.140  17.203
   14   1HG   GLN   2          1HG       GLN   2 -17.862   9.021  16.145
   15   2HG   GLN   2          2HG       GLN   2 -18.464   7.819  17.270
   16   1HE2  GLN   2          1HE2      GLN   2 -20.478   8.705  17.434
   17   2HE2  GLN   2          2HE2      GLN   2 -20.824  10.190  18.256
   18    H    GLU   3           H        GLU   3 -17.113   6.823  15.859
   19    HA   GLU   3           HA       GLU   3 -15.128   4.938  15.189
   20   1HB   GLU   3          1HB       GLU   3 -17.638   5.856  14.132
   21   2HB   GLU   3          2HB       GLU   3 -16.455   5.972  12.844
   22   1HG   GLU   3          1HG       GLU   3 -15.763   3.592  13.299
   23   2HG   GLU   3          2HG       GLU   3 -17.000   3.485  14.535
   24    H    GLN   4           H        GLN   4 -13.154   5.228  14.203
   25    HA   GLN   4           HA       GLN   4 -12.407   7.959  13.698
   26   1HB   GLN   4          1HB       GLN   4 -11.077   5.624  14.649
   27   2HB   GLN   4          2HB       GLN   4 -10.312   6.025  13.125
   28   1HG   GLN   4          1HG       GLN   4  -9.109   7.277  14.771
   29   2HG   GLN   4          2HG       GLN   4 -10.141   8.448  13.974
   30   1HE2  GLN   4          1HE2      GLN   4 -10.696   9.879  15.438
   31   2HE2  GLN   4          2HE2      GLN   4 -11.376   9.564  16.999
   32    H    ALA   5           H        ALA   5 -13.528   8.466  11.745
   33    HA   ALA   5           HA       ALA   5 -13.620   6.827   9.510
   34   1HB   ALA   5          1HB       ALA   5 -14.848   8.548   8.726
   35   2HB   ALA   5          2HB       ALA   5 -14.556   9.340  10.293
   36   3HB   ALA   5          3HB       ALA   5 -13.496   9.691   8.907
   37    H    GLN   6           H        GLN   6 -11.554   5.829   9.208
   38    HA   GLN   6           HA       GLN   6  -9.460   7.692   8.429
   39   1HB   GLN   6          1HB       GLN   6  -7.876   5.914   8.872
   40   2HB   GLN   6          2HB       GLN   6  -8.961   6.020  10.244
   41   1HG   GLN   6          1HG       GLN   6 -10.062   4.202   8.240
   42   2HG   GLN   6          2HG       GLN   6  -8.424   3.728   8.642
   43   1HE2  GLN   6          1HE2      GLN   6  -8.150   4.444  11.233
   44   2HE2  GLN   6          2HE2      GLN   6  -9.228   3.555  12.257
   45    H    GLN   7           H        GLN   7 -11.338   7.652   6.514
   46    HA   GLN   7           HA       GLN   7 -10.313   5.720   4.581
   47   1HB   GLN   7          1HB       GLN   7 -12.671   5.284   5.090
   48   2HB   GLN   7          2HB       GLN   7 -13.089   6.961   4.799
   49   1HG   GLN   7          1HG       GLN   7 -12.022   6.532   2.406
   50   2HG   GLN   7          2HG       GLN   7 -12.271   4.841   2.793
   51   1HE2  GLN   7          1HE2      GLN   7 -13.942   4.215   1.640
   52   2HE2  GLN   7          2HE2      GLN   7 -15.505   4.960   1.585
   53    H    PHE   8           H        PHE   8  -8.712   6.904   3.542
   54    HA   PHE   8           HA       PHE   8  -9.470   9.583   2.633
   55   1HB   PHE   8          1HB       PHE   8  -6.726   8.211   2.625
   56   2HB   PHE   8          2HB       PHE   8  -7.036   9.934   2.545
   57    HD1  PHE   8           1HD      PHE   8  -9.255   9.658   4.818
   58    HD2  PHE   8           2HD      PHE   8  -5.170   8.560   4.479
   59    HE1  PHE   8           1HE      PHE   8  -9.004   9.820   7.310
   60    HE2  PHE   8           2HE      PHE   8  -4.919   8.722   6.971
   61    HZ   PHE   8           HZ       PHE   8  -6.840   9.350   8.357
   62    H    ILE   9           H        ILE   9  -8.694  10.233   0.427
   63    HA   ILE   9           HA       ILE   9  -9.326   8.126  -1.426
   64    HB   ILE   9           HB       ILE   9  -8.658  11.043  -1.838
   65   1HG1  ILE   9          1HG1      ILE   9 -10.661  10.816  -0.513
   66   2HG1  ILE   9          2HG1      ILE   9 -11.093  11.315  -2.137
   67   1HG2  ILE   9          1HG2      ILE   9  -9.064  10.834  -4.066
   68   2HG2  ILE   9          2HG2      ILE   9  -8.401   9.212  -3.755
   69   3HG2  ILE   9          3HG2      ILE   9 -10.162   9.449  -3.857
   70   1HD1  ILE   9          1HD1      ILE   9 -11.101   8.497  -2.266
   71   2HD1  ILE   9          2HD1      ILE   9 -11.838   8.881  -0.692
   72   3HD1  ILE   9          3HD1      ILE   9 -12.527   9.559  -2.187
   73    H    PHE  10           H        PHE  10  -7.821   6.696  -2.087
   74    HA   PHE  10           HA       PHE  10  -5.314   7.687  -3.048
   75   1HB   PHE  10          1HB       PHE  10  -5.266   7.244  -0.416
   76   2HB   PHE  10          2HB       PHE  10  -5.334   5.549  -0.855
   77    HD1  PHE  10           1HD      PHE  10  -3.410   8.547  -2.008
   78    HD2  PHE  10           2HD      PHE  10  -3.302   4.486  -0.782
   79    HE1  PHE  10           1HE      PHE  10  -0.918   8.524  -2.303
   80    HE2  PHE  10           2HE      PHE  10  -0.810   4.463  -1.077
   81    HZ   PHE  10           HZ       PHE  10   0.353   6.482  -1.833
   82    H    LYS  11           H        LYS  11  -4.681   6.455  -4.774
   83    HA   LYS  11           HA       LYS  11  -5.645   3.695  -4.864
   84   1HB   LYS  11          1HB       LYS  11  -5.991   5.759  -7.057
   85   2HB   LYS  11          2HB       LYS  11  -6.213   4.036  -7.281
   86   1HG   LYS  11          1HG       LYS  11  -8.247   4.040  -6.237
   87   2HG   LYS  11          2HG       LYS  11  -7.673   5.048  -4.923
   88   1HD   LYS  11          1HD       LYS  11  -8.188   6.219  -7.683
   89   2HD   LYS  11          2HD       LYS  11  -9.492   6.024  -6.529
   90   1HE   LYS  11          1HE       LYS  11  -8.221   7.394  -4.860
   91   2HE   LYS  11          2HE       LYS  11  -6.918   7.590  -6.015
   92   1HZ   LYS  11          1HZ       LYS  11  -8.208   8.916  -7.338
   93   2HZ   LYS  11          2HZ       LYS  11  -9.629   8.342  -6.774
   94   3HZ   LYS  11          3HZ       LYS  11  -8.736   9.358  -5.857
   95    H    VAL  12           H        VAL  12  -4.031   2.291  -5.331
   96    HA   VAL  12           HA       VAL  12  -1.551   3.477  -6.354
   97    HB   VAL  12           HB       VAL  12  -1.717   2.309  -4.073
   98   1HG1  VAL  12          1HG1      VAL  12  -1.183  -0.294  -5.331
   99   2HG1  VAL  12          2HG1      VAL  12  -2.168   0.113  -3.906
  100   3HG1  VAL  12          3HG1      VAL  12  -2.857   0.273  -5.539
  101   1HG2  VAL  12          1HG2      VAL  12   0.336   1.830  -6.211
  102   2HG2  VAL  12          2HG2      VAL  12   0.445   2.794  -4.718
  103   3HG2  VAL  12          3HG2      VAL  12   0.511   1.017  -4.637
  104    H    THR  13           H        THR  13  -0.390   2.392  -8.053
  105    HA   THR  13           HA       THR  13  -2.074   1.360 -10.063
  106    HB   THR  13           HB       THR  13   0.136   1.051 -11.236
  107    HG1  THR  13           1HG      THR  13   1.798   0.704  -9.820
  108   1HG2  THR  13          1HG2      THR  13  -0.015   3.596  -9.534
  109   2HG2  THR  13          2HG2      THR  13   1.025   3.380 -10.962
  110   3HG2  THR  13          3HG2      THR  13  -0.745   3.383 -11.143
  111    H    ASP  14           H        ASP  14  -2.362  -0.701 -10.917
  112    HA   ASP  14           HA       ASP  14  -2.641  -2.712  -9.153
  113   1HB   ASP  14          1HB       ASP  14  -2.421  -2.482 -12.116
  114   2HB   ASP  14          2HB       ASP  14  -2.099  -4.089 -11.496
  115    H    LYS  15           H        LYS  15   0.232  -1.687 -11.022
  116    HA   LYS  15           HA       LYS  15   1.758  -4.016 -10.650
  117   1HB   LYS  15          1HB       LYS  15   1.993  -1.666 -12.083
  118   2HB   LYS  15          2HB       LYS  15   3.247  -1.492 -10.872
  119   1HG   LYS  15          1HG       LYS  15   4.206  -2.643 -12.792
  120   2HG   LYS  15          2HG       LYS  15   4.106  -3.787 -11.468
  121   1HD   LYS  15          1HD       LYS  15   2.422  -5.035 -12.476
  122   2HD   LYS  15          2HD       LYS  15   1.720  -3.647 -13.283
  123   1HE   LYS  15          1HE       LYS  15   3.849  -3.612 -14.763
  124   2HE   LYS  15          2HE       LYS  15   4.225  -5.185 -14.090
  125   1HZ   LYS  15          1HZ       LYS  15   1.813  -5.694 -14.793
  126   2HZ   LYS  15          2HZ       LYS  15   2.007  -4.429 -15.808
  127   3HZ   LYS  15          3HZ       LYS  15   3.002  -5.719 -15.912
  128    H    ALA  16           H        ALA  16   1.387  -0.963  -8.766
  129    HA   ALA  16           HA       ALA  16   3.395  -1.403  -6.926
  130   1HB   ALA  16          1HB       ALA  16   2.187   0.192  -5.550
  131   2HB   ALA  16          2HB       ALA  16   2.032   0.681  -7.255
  132   3HB   ALA  16          3HB       ALA  16   0.675  -0.128  -6.434
  133    H    VAL  17           H        VAL  17  -0.035  -2.546  -6.964
  134    HA   VAL  17           HA       VAL  17   0.236  -3.872  -4.459
  135    HB   VAL  17           HB       VAL  17  -1.807  -3.506  -6.568
  136   1HG1  VAL  17          1HG1      VAL  17  -2.010  -5.847  -6.562
  137   2HG1  VAL  17          2HG1      VAL  17  -1.692  -5.963  -4.814
  138   3HG1  VAL  17          3HG1      VAL  17  -3.238  -5.299  -5.396
  139   1HG2  VAL  17          1HG2      VAL  17  -3.015  -3.602  -4.067
  140   2HG2  VAL  17          2HG2      VAL  17  -1.402  -2.929  -3.731
  141   3HG2  VAL  17          3HG2      VAL  17  -2.465  -2.139  -4.920
  142    H    GLU  18           H        GLU  18   0.194  -4.893  -7.935
  143    HA   GLU  18           HA       GLU  18   0.456  -7.586  -7.426
  144   1HB   GLU  18          1HB       GLU  18  -0.010  -6.236  -9.645
  145   2HB   GLU  18          2HB       GLU  18   1.731  -6.274  -9.840
  146   1HG   GLU  18          1HG       GLU  18   0.242  -8.840  -9.213
  147   2HG   GLU  18          2HG       GLU  18   0.244  -8.222 -10.852
  148    H    GLU  19           H        GLU  19   2.750  -4.959  -7.135
  149    HA   GLU  19           HA       GLU  19   5.073  -6.471  -7.525
  150   1HB   GLU  19          1HB       GLU  19   5.189  -4.070  -7.709
  151   2HB   GLU  19          2HB       GLU  19   4.512  -3.839  -6.109
  152   1HG   GLU  19          1HG       GLU  19   6.854  -3.487  -5.822
  153   2HG   GLU  19          2HG       GLU  19   6.573  -5.098  -5.195
  154    H    ILE  20           H        ILE  20   4.030  -4.943  -4.400
  155    HA   ILE  20           HA       ILE  20   5.534  -6.515  -2.763
  156    HB   ILE  20           HB       ILE  20   2.980  -5.000  -2.429
  157   1HG1  ILE  20          1HG1      ILE  20   4.590  -3.861  -0.712
  158   2HG1  ILE  20          2HG1      ILE  20   5.854  -4.697  -1.593
  159   1HG2  ILE  20          1HG2      ILE  20   4.299  -6.424  -0.114
  160   2HG2  ILE  20          2HG2      ILE  20   2.754  -5.541  -0.145
  161   3HG2  ILE  20          3HG2      ILE  20   2.906  -7.098  -0.994
  162   1HD1  ILE  20          1HD1      ILE  20   5.331  -3.582  -3.645
  163   2HD1  ILE  20          2HD1      ILE  20   3.753  -3.033  -3.032
  164   3HD1  ILE  20          3HD1      ILE  20   5.253  -2.317  -2.396
  165    H    LYS  21           H        LYS  21   2.684  -7.375  -4.611
  166    HA   LYS  21           HA       LYS  21   1.665  -9.439  -3.102
  167   1HB   LYS  21          1HB       LYS  21   1.572  -8.546  -5.895
  168   2HB   LYS  21          2HB       LYS  21   1.386 -10.280  -5.728
  169   1HG   LYS  21          1HG       LYS  21  -0.369  -9.832  -3.921
  170   2HG   LYS  21          2HG       LYS  21  -0.265  -8.130  -4.325
  171   1HD   LYS  21          1HD       LYS  21  -1.139  -8.466  -6.521
  172   2HD   LYS  21          2HD       LYS  21  -0.792 -10.184  -6.498
  173   1HE   LYS  21          1HE       LYS  21  -2.483 -10.252  -4.466
  174   2HE   LYS  21          2HE       LYS  21  -3.012  -8.691  -5.063
  175   1HZ   LYS  21          1HZ       LYS  21  -2.776 -10.516  -7.182
  176   2HZ   LYS  21          2HZ       LYS  21  -3.735 -11.144  -6.020
  177   3HZ   LYS  21          3HZ       LYS  21  -4.094  -9.694  -6.679
  178    H    LYS  22           H        LYS  22   4.541  -9.320  -5.243
  179    HA   LYS  22           HA       LYS  22   4.994 -12.132  -5.034
  180   1HB   LYS  22          1HB       LYS  22   6.391  -9.787  -6.266
  181   2HB   LYS  22          2HB       LYS  22   7.314 -11.248  -5.978
  182   1HG   LYS  22          1HG       LYS  22   5.582 -12.574  -7.224
  183   2HG   LYS  22          2HG       LYS  22   4.686 -11.100  -7.532
  184   1HD   LYS  22          1HD       LYS  22   7.067 -10.279  -8.496
  185   2HD   LYS  22          2HD       LYS  22   7.319 -12.002  -8.692
  186   1HE   LYS  22          1HE       LYS  22   4.685 -11.539  -9.648
  187   2HE   LYS  22          2HE       LYS  22   5.628 -10.194 -10.260
  188   1HZ   LYS  22          1HZ       LYS  22   7.165 -12.450 -10.586
  189   2HZ   LYS  22          2HZ       LYS  22   5.666 -12.857 -11.092
  190   3HZ   LYS  22          3HZ       LYS  22   6.431 -11.574 -11.752
  191    H    VAL  23           H        VAL  23   6.231  -9.142  -3.451
  192    HA   VAL  23           HA       VAL  23   8.218 -10.436  -1.955
  193    HB   VAL  23           HB       VAL  23   6.883  -7.814  -2.067
  194   1HG1  VAL  23          1HG1      VAL  23   6.471  -7.932   0.212
  195   2HG1  VAL  23          2HG1      VAL  23   7.893  -8.956   0.526
  196   3HG1  VAL  23          3HG1      VAL  23   8.103  -7.224   0.175
  197   1HG2  VAL  23          1HG2      VAL  23   9.389  -8.906  -2.670
  198   2HG2  VAL  23          2HG2      VAL  23   8.926  -7.188  -2.721
  199   3HG2  VAL  23          3HG2      VAL  23   9.675  -7.865  -1.254
  200    H    ALA  24           H        ALA  24   4.714  -9.882  -1.464
  201    HA   ALA  24           HA       ALA  24   4.741 -10.728   1.247
  202   1HB   ALA  24          1HB       ALA  24   2.381 -10.488   1.104
  203   2HB   ALA  24          2HB       ALA  24   3.037  -9.241   0.017
  204   3HB   ALA  24          3HB       ALA  24   2.378 -10.752  -0.656
  205    H    GLN  25           H        GLN  25   4.221 -12.289  -1.951
  206    HA   GLN  25           HA       GLN  25   3.339 -14.712  -0.884
  207   1HB   GLN  25          1HB       GLN  25   3.785 -13.574  -3.462
  208   2HB   GLN  25          2HB       GLN  25   4.710 -15.062  -3.422
  209   1HG   GLN  25          1HG       GLN  25   2.274 -15.766  -2.198
  210   2HG   GLN  25          2HG       GLN  25   1.788 -14.681  -3.485
  211   1HE2  GLN  25          1HE2      GLN  25   1.284 -17.482  -3.284
  212   2HE2  GLN  25          2HE2      GLN  25   2.016 -18.274  -4.639
  213    H    GLU  26           H        GLU  26   6.564 -13.345  -1.615
  214    HA   GLU  26           HA       GLU  26   7.910 -15.797  -1.321
  215   1HB   GLU  26          1HB       GLU  26   8.565 -13.301  -2.290
  216   2HB   GLU  26          2HB       GLU  26   9.420 -13.295  -0.760
  217   1HG   GLU  26          1HG       GLU  26   9.799 -15.880  -2.020
  218   2HG   GLU  26          2HG       GLU  26  10.162 -14.629  -3.192
  219    H    ASN  27           H        ASN  27   6.260 -13.861   0.903
  220    HA   ASN  27           HA       ASN  27   8.056 -14.676   3.047
  221   1HB   ASN  27          1HB       ASN  27   6.244 -12.317   2.620
  222   2HB   ASN  27          2HB       ASN  27   6.286 -12.949   4.255
  223   1HD2  ASN  27          1HD2      ASN  27   7.854 -11.105   1.880
  224   2HD2  ASN  27          2HD2      ASN  27   9.332 -10.753   2.711
  225    H    ASN  28           H        ASN  28   5.603 -15.948   1.404
  226    HA   ASN  28           HA       ASN  28   3.923 -17.267   1.777
  227   1HB   ASN  28          1HB       ASN  28   5.821 -18.072   3.570
  228   2HB   ASN  28          2HB       ASN  28   4.547 -17.658   4.700
  229   1HD2  ASN  28          1HD2      ASN  28   4.321 -19.811   5.295
  230   2HD2  ASN  28          2HD2      ASN  28   3.507 -20.981   4.310
  231    H    ILE  29           H        ILE  29   3.564 -14.385   2.300
  232    HA   ILE  29           HA       ILE  29   1.718 -14.376   4.567
  233    HB   ILE  29           HB       ILE  29   3.122 -12.207   3.022
  234   1HG1  ILE  29          1HG1      ILE  29   3.155 -12.950   5.962
  235   2HG1  ILE  29          2HG1      ILE  29   4.382 -13.401   4.796
  236   1HG2  ILE  29          1HG2      ILE  29   0.902 -11.372   3.331
  237   2HG2  ILE  29          2HG2      ILE  29   0.865 -11.930   5.021
  238   3HG2  ILE  29          3HG2      ILE  29   1.953 -10.604   4.545
  239   1HD1  ILE  29          1HD1      ILE  29   4.164 -10.659   4.372
  240   2HD1  ILE  29          2HD1      ILE  29   3.925 -10.806   6.130
  241   3HD1  ILE  29          3HD1      ILE  29   5.403 -11.450   5.375
  242    H    GLU  30           H        GLU  30  -0.466 -13.645   4.320
  243    HA   GLU  30           HA       GLU  30  -1.336 -13.608   1.540
  244   1HB   GLU  30          1HB       GLU  30  -1.948 -15.589   3.524
  245   2HB   GLU  30          2HB       GLU  30  -3.418 -14.679   3.237
  246   1HG   GLU  30          1HG       GLU  30  -3.190 -15.054   0.783
  247   2HG   GLU  30          2HG       GLU  30  -1.692 -15.926   1.044
  248    H    ASN  31           H        ASN  31  -0.840 -11.727   4.111
  249    HA   ASN  31           HA       ASN  31  -3.094 -10.075   3.445
  250   1HB   ASN  31          1HB       ASN  31  -3.190  -9.649   6.120
  251   2HB   ASN  31          2HB       ASN  31  -4.184 -10.866   5.345
  252   1HD2  ASN  31          1HD2      ASN  31  -4.086 -12.852   6.070
  253   2HD2  ASN  31          2HD2      ASN  31  -2.833 -13.551   7.041
  254    HA   PRO  32           HA       PRO  32   0.956  -8.037   4.231
  255   1HB   PRO  32          1HB       PRO  32   1.371  -6.979   1.746
  256   2HB   PRO  32          2HB       PRO  32   2.051  -8.509   2.261
  257   1HG   PRO  32          1HG       PRO  32  -0.223  -8.012   0.439
  258   2HG   PRO  32          2HG       PRO  32   0.730  -9.469   0.632
  259   1HD   PRO  32          1HD       PRO  32  -1.910  -8.997   1.648
  260   2HD   PRO  32          2HD       PRO  32  -0.912 -10.408   1.939
  261    H    ILE  33           H        ILE  33   1.321  -5.967   4.939
  262    HA   ILE  33           HA       ILE  33  -0.836  -4.126   4.176
  263    HB   ILE  33           HB       ILE  33   0.254  -4.796   6.891
  264   1HG1  ILE  33          1HG1      ILE  33  -2.589  -4.383   5.926
  265   2HG1  ILE  33          2HG1      ILE  33  -1.784  -5.940   5.951
  266   1HG2  ILE  33          1HG2      ILE  33  -0.433  -2.142   5.895
  267   2HG2  ILE  33          2HG2      ILE  33  -1.433  -2.634   7.283
  268   3HG2  ILE  33          3HG2      ILE  33   0.341  -2.634   7.420
  269   1HD1  ILE  33          1HD1      ILE  33  -3.131  -5.627   7.999
  270   2HD1  ILE  33          2HD1      ILE  33  -1.400  -5.712   8.406
  271   3HD1  ILE  33          3HD1      ILE  33  -2.231  -4.138   8.377
  272    H    LEU  34           H        LEU  34   0.282  -2.930   2.658
  273    HA   LEU  34           HA       LEU  34   2.953  -2.025   3.362
  274   1HB   LEU  34          1HB       LEU  34   1.454  -1.450   0.818
  275   2HB   LEU  34          2HB       LEU  34   3.183  -1.402   1.103
  276    HG   LEU  34           HG       LEU  34   2.801  -3.334  -0.180
  277   1HD1  LEU  34          1HD1      LEU  34   3.894  -3.516   2.370
  278   2HD1  LEU  34          2HD1      LEU  34   2.830  -4.937   2.246
  279   3HD1  LEU  34          3HD1      LEU  34   4.103  -4.669   1.031
  280   1HD2  LEU  34          1HD2      LEU  34   0.971  -4.643  -0.170
  281   2HD2  LEU  34          2HD2      LEU  34   0.878  -4.691   1.607
  282   3HD2  LEU  34          3HD2      LEU  34   0.245  -3.284   0.721
  283    H    ARG  35           H        ARG  35   3.419  -0.005   4.100
  284    HA   ARG  35           HA       ARG  35   1.140   1.795   4.229
  285   1HB   ARG  35          1HB       ARG  35   1.892   1.338   6.457
  286   2HB   ARG  35          2HB       ARG  35   3.583   1.406   5.999
  287   1HG   ARG  35          1HG       ARG  35   3.639   3.746   5.986
  288   2HG   ARG  35          2HG       ARG  35   1.940   3.896   5.583
  289   1HD   ARG  35          1HD       ARG  35   1.484   4.236   7.781
  290   2HD   ARG  35          2HD       ARG  35   1.997   2.594   8.117
  291    HE   ARG  35           HE       ARG  35   3.540   5.037   8.591
  292   1HH1  ARG  35          2HH2      ARG  35   3.741   1.561   8.087
  293   2HH1  ARG  35          1HH2      ARG  35   5.276   1.406   8.876
  294   1HH2  ARG  35          2HH1      ARG  35   5.565   4.835   9.631
  295   2HH2  ARG  35          1HH1      ARG  35   6.320   3.281   9.760
  296    H    ILE  36           H        ILE  36   1.300   3.862   3.302
  297    HA   ILE  36           HA       ILE  36   3.668   4.313   1.692
  298    HB   ILE  36           HB       ILE  36   0.925   5.548   1.808
  299   1HG1  ILE  36          1HG1      ILE  36   1.155   4.757  -0.699
  300   2HG1  ILE  36          2HG1      ILE  36   2.384   3.692  -0.045
  301   1HG2  ILE  36          1HG2      ILE  36   3.390   6.762   0.875
  302   2HG2  ILE  36          2HG2      ILE  36   2.214   6.567  -0.446
  303   3HG2  ILE  36          3HG2      ILE  36   1.758   7.455   1.027
  304   1HD1  ILE  36          1HD1      ILE  36  -0.438   3.902   1.096
  305   2HD1  ILE  36          2HD1      ILE  36   0.067   2.678  -0.093
  306   3HD1  ILE  36          3HD1      ILE  36   0.804   2.702   1.527
  307    H    ARG  37           H        ARG  37   5.376   5.250   2.683
  308    HA   ARG  37           HA       ARG  37   4.720   7.452   4.472
  309   1HB   ARG  37          1HB       ARG  37   5.836   5.204   5.393
  310   2HB   ARG  37          2HB       ARG  37   7.307   5.890   4.732
  311   1HG   ARG  37          1HG       ARG  37   6.099   8.038   6.121
  312   2HG   ARG  37          2HG       ARG  37   5.829   6.649   7.155
  313   1HD   ARG  37          1HD       ARG  37   8.098   6.326   7.564
  314   2HD   ARG  37          2HD       ARG  37   8.581   6.904   5.982
  315    HE   ARG  37           HE       ARG  37   7.464   9.112   7.394
  316   1HH1  ARG  37          2HH2      ARG  37  10.267   6.991   7.566
  317   2HH1  ARG  37          1HH2      ARG  37  11.276   8.175   8.327
  318   1HH2  ARG  37          2HH1      ARG  37   8.795  10.674   8.399
  319   2HH2  ARG  37          1HH1      ARG  37  10.433  10.284   8.805
  320    H    VAL  38           H        VAL  38   6.427   9.202   4.548
  321    HA   VAL  38           HA       VAL  38   7.413   9.682   1.890
  322    HB   VAL  38           HB       VAL  38   7.637  11.316   4.426
  323   1HG1  VAL  38          1HG1      VAL  38   8.663  12.924   3.242
  324   2HG1  VAL  38          2HG1      VAL  38   8.989  11.654   2.038
  325   3HG1  VAL  38          3HG1      VAL  38   7.574  12.718   1.849
  326   1HG2  VAL  38          1HG2      VAL  38   5.695  12.090   2.325
  327   2HG2  VAL  38          2HG2      VAL  38   5.293  10.618   3.242
  328   3HG2  VAL  38          3HG2      VAL  38   5.560  12.156   4.099
  329    H    VAL  39           H        VAL  39   9.518   9.558   1.181
  330    HA   VAL  39           HA       VAL  39  11.509   8.845   3.220
  331    HB   VAL  39           HB       VAL  39  11.503   7.751   0.417
  332   1HG1  VAL  39          1HG1      VAL  39  12.928   6.017   1.399
  333   2HG1  VAL  39          2HG1      VAL  39  13.601   7.638   1.701
  334   3HG1  VAL  39          3HG1      VAL  39  12.756   6.768   3.004
  335   1HG2  VAL  39          1HG2      VAL  39  10.197   6.490   2.853
  336   2HG2  VAL  39          2HG2      VAL  39   9.362   7.097   1.403
  337   3HG2  VAL  39          3HG2      VAL  39  10.451   5.695   1.281
  338    HA   PRO  40           HA       PRO  40  12.956  12.482   1.047
  339   1HB   PRO  40          1HB       PRO  40  13.971  13.776   3.230
  340   2HB   PRO  40          2HB       PRO  40  12.338  14.021   2.644
  341   1HG   PRO  40          1HG       PRO  40  13.251  12.499   5.008
  342   2HG   PRO  40          2HG       PRO  40  11.648  13.107   4.646
  343   1HD   PRO  40          1HD       PRO  40  12.548  10.395   4.407
  344   2HD   PRO  40          2HD       PRO  40  10.982  11.025   3.936
  345    H    GLY  41           H        GLY  41  14.282   9.842   2.371
  346   1HA   GLY  41          1HA       GLY  41  17.044  10.789   2.085
  347   2HA   GLY  41          2HA       GLY  41  16.510   9.286   2.810
  348    H    GLY  42           H        GLY  42  16.252  11.009  -0.389
  349   1HA   GLY  42          1HA       GLY  42  16.991   8.455  -1.683
  350   2HA   GLY  42          2HA       GLY  42  15.663   9.439  -2.266
  351    H    CYS  43           H        CYS  43  19.201   9.230  -1.860
  352    HA   CYS  43           HA       CYS  43  19.948  11.705  -2.742
  353   1HB   CYS  43          1HB       CYS  43  21.191   9.032  -2.611
  354   2HB   CYS  43          2HB       CYS  43  21.877  10.078  -3.838
  355    HG   CYS  43           HG       CYS  43  23.198  11.401  -2.396
  356    H    SER  44           H        SER  44  18.538   8.942  -4.463
  357    HA   SER  44           HA       SER  44  19.187  10.100  -7.016
  358   1HB   SER  44          1HB       SER  44  18.307   7.479  -6.003
  359   2HB   SER  44          2HB       SER  44  17.420   7.956  -7.438
  360    HG   SER  44           HG       SER  44  20.279   7.675  -7.130
  361    H    GLY  45           H        GLY  45  16.485   9.755  -4.722
  362   1HA   GLY  45          1HA       GLY  45  15.022  11.895  -5.636
  363   2HA   GLY  45          2HA       GLY  45  14.421  10.521  -6.543
  364    H    PHE  46           H        PHE  46  13.383  12.293  -4.166
  365    HA   PHE  46           HA       PHE  46  13.054  10.323  -2.092
  366   1HB   PHE  46          1HB       PHE  46  11.656  12.268  -1.143
  367   2HB   PHE  46          2HB       PHE  46  13.315  12.698  -1.509
  368    HD1  PHE  46           1HD      PHE  46  13.838  14.224  -3.305
  369    HD2  PHE  46           2HD      PHE  46   9.822  13.078  -2.555
  370    HE1  PHE  46           1HE      PHE  46  13.030  16.096  -4.769
  371    HE2  PHE  46           2HE      PHE  46   9.014  14.950  -4.019
  372    HZ   PHE  46           HZ       PHE  46  10.628  16.437  -5.108
  373    H    GLN  47           H        GLN  47  11.598   8.694  -2.345
  374    HA   GLN  47           HA       GLN  47   8.989   9.472  -3.353
  375   1HB   GLN  47          1HB       GLN  47  10.550   7.016  -4.269
  376   2HB   GLN  47          2HB       GLN  47   8.871   7.328  -4.660
  377   1HG   GLN  47          1HG       GLN  47  11.135   9.259  -5.343
  378   2HG   GLN  47          2HG       GLN  47  10.550   8.033  -6.451
  379   1HE2  GLN  47          1HE2      GLN  47  10.316  10.246  -7.573
  380   2HE2  GLN  47          2HE2      GLN  47   8.750  10.984  -7.497
  381    H    TYR  48           H        TYR  48   7.281   7.751  -2.795
  382    HA   TYR  48           HA       TYR  48   7.741   6.940  -0.063
  383   1HB   TYR  48          1HB       TYR  48   5.354   6.482  -1.947
  384   2HB   TYR  48          2HB       TYR  48   5.295   6.553  -0.197
  385    HD1  TYR  48           1HD      TYR  48   5.577   8.546  -3.286
  386    HD2  TYR  48           2HD      TYR  48   5.264   8.681   0.979
  387    HE1  TYR  48           1HE      TYR  48   5.031  11.026  -3.398
  388    HE2  TYR  48           2HE      TYR  48   4.720  11.161   0.853
  389    HH   TYR  48           HH       TYR  48   4.056  12.788  -0.525
  390    H    ALA  49           H        ALA  49   8.911   5.081   0.216
  391    HA   ALA  49           HA       ALA  49   8.668   2.940  -1.689
  392   1HB   ALA  49          1HB       ALA  49  10.472   3.794   0.441
  393   2HB   ALA  49          2HB       ALA  49  10.099   2.058   0.560
  394   3HB   ALA  49          3HB       ALA  49  10.781   2.720  -0.944
  395    H    MET  50           H        MET  50   8.104   0.693  -0.995
  396    HA   MET  50           HA       MET  50   5.788   0.851   0.727
  397   1HB   MET  50          1HB       MET  50   6.648  -0.701  -1.619
  398   2HB   MET  50          2HB       MET  50   6.110  -1.783  -0.350
  399   1HG   MET  50          1HG       MET  50   3.967  -1.334  -0.955
  400   2HG   MET  50          2HG       MET  50   4.188   0.301  -0.365
  401   1HE   MET  50          1HE       MET  50   2.372  -0.863  -2.296
  402   2HE   MET  50          2HE       MET  50   2.218   0.487  -3.446
  403   3HE   MET  50          3HE       MET  50   2.880  -1.073  -3.989
  404    H    GLY  51           H        GLY  51   5.404  -1.437   1.958
  405   1HA   GLY  51          1HA       GLY  51   7.600  -2.876   2.917
  406   2HA   GLY  51          2HA       GLY  51   7.332  -1.533   4.009
  407    H    PHE  52           H        PHE  52   6.469  -4.733   3.303
  408    HA   PHE  52           HA       PHE  52   3.746  -4.696   4.028
  409   1HB   PHE  52          1HB       PHE  52   4.045  -7.090   3.914
  410   2HB   PHE  52          2HB       PHE  52   5.247  -6.473   2.798
  411    HD1  PHE  52           1HD      PHE  52   4.732  -7.931   6.135
  412    HD2  PHE  52           2HD      PHE  52   7.590  -6.712   3.245
  413    HE1  PHE  52           1HE      PHE  52   6.529  -9.144   7.400
  414    HE2  PHE  52           2HE      PHE  52   9.387  -7.925   4.510
  415    HZ   PHE  52           HZ       PHE  52   8.835  -9.127   6.573
  416    H    ASP  53           H        ASP  53   2.792  -4.523   6.003
  417    HA   ASP  53           HA       ASP  53   4.536  -5.000   8.292
  418   1HB   ASP  53          1HB       ASP  53   2.686  -2.771   7.612
  419   2HB   ASP  53          2HB       ASP  53   2.487  -3.380   9.243
  420    H    ASP  54           H        ASP  54   2.913  -5.290  10.379
  421    HA   ASP  54           HA       ASP  54   0.527  -6.693   9.580
  422   1HB   ASP  54          1HB       ASP  54   1.173  -8.607  11.161
  423   2HB   ASP  54          2HB       ASP  54   2.026  -8.555   9.632
  424    H    THR  55           H        THR  55   0.089  -4.405  10.700
  425    HA   THR  55           HA       THR  55  -0.942  -4.866  13.252
  426    HB   THR  55           HB       THR  55   1.487  -4.869  13.898
  427    HG1  THR  55           1HG      THR  55  -0.194  -3.948  15.303
  428   1HG2  THR  55          1HG2      THR  55   2.558  -2.517  13.892
  429   2HG2  THR  55          2HG2      THR  55   2.533  -3.352  12.320
  430   3HG2  THR  55          3HG2      THR  55   1.344  -2.074  12.668
  431    H    VAL  56           H        VAL  56  -2.221  -3.120  14.008
  432    HA   VAL  56           HA       VAL  56  -2.711  -1.182  11.884
  433    HB   VAL  56           HB       VAL  56  -4.297  -2.665  13.796
  434   1HG1  VAL  56          1HG1      VAL  56  -4.835   0.321  13.646
  435   2HG1  VAL  56          2HG1      VAL  56  -5.879  -0.900  14.415
  436   3HG1  VAL  56          3HG1      VAL  56  -4.262  -0.565  15.080
  437   1HG2  VAL  56          1HG2      VAL  56  -5.106  -0.911  11.452
  438   2HG2  VAL  56          2HG2      VAL  56  -4.605  -2.615  11.333
  439   3HG2  VAL  56          3HG2      VAL  56  -6.085  -2.183  12.223
  440    H    GLU  57           H        GLU  57  -3.061   1.109  12.452
  441    HA   GLU  57           HA       GLU  57  -1.343   1.813  14.697
  442   1HB   GLU  57          1HB       GLU  57  -2.058   3.726  12.465
  443   2HB   GLU  57          2HB       GLU  57  -0.648   3.734  13.506
  444   1HG   GLU  57          1HG       GLU  57  -1.231   1.589  11.409
  445   2HG   GLU  57          2HG       GLU  57  -0.157   2.951  11.158
  446    H    GLU  58           H        GLU  58  -1.933   4.151  15.593
  447    HA   GLU  58           HA       GLU  58  -4.683   3.936  16.360
  448   1HB   GLU  58          1HB       GLU  58  -2.512   4.570  17.794
  449   2HB   GLU  58          2HB       GLU  58  -2.903   6.194  17.263
  450   1HG   GLU  58          1HG       GLU  58  -5.322   5.710  18.076
  451   2HG   GLU  58          2HG       GLU  58  -4.661   4.291  18.865
  452    H    GLY  59           H        GLY  59  -4.382   4.528  13.591
  453   1HA   GLY  59          1HA       GLY  59  -6.173   6.320  12.936
  454   2HA   GLY  59          2HA       GLY  59  -4.860   7.408  13.341
  455    H    ASP  60           H        ASP  60  -5.212   4.247  11.561
  456    HA   ASP  60           HA       ASP  60  -3.552   5.456   9.492
  457   1HB   ASP  60          1HB       ASP  60  -3.240   3.029  10.923
  458   2HB   ASP  60          2HB       ASP  60  -3.833   2.536   9.349
  459    H    HIS  61           H        HIS  61  -4.367   5.359   7.329
  460    HA   HIS  61           HA       HIS  61  -7.132   5.011   7.047
  461   1HB   HIS  61          1HB       HIS  61  -5.919   6.588   5.690
  462   2HB   HIS  61          2HB       HIS  61  -4.897   5.327   5.031
  463    HD1  HIS  61           1HD      HIS  61  -8.396   4.221   5.226
  464    HD2  HIS  61           2HD      HIS  61  -6.018   6.344   2.499
  465    HE1  HIS  61           1HE      HIS  61  -9.655   4.194   3.007
  466    H    VAL  62           H        VAL  62  -8.308   3.180   6.804
  467    HA   VAL  62           HA       VAL  62  -6.841   0.735   6.194
  468    HB   VAL  62           HB       VAL  62  -9.002   1.480   7.912
  469   1HG1  VAL  62          1HG1      VAL  62 -10.638   0.867   6.332
  470   2HG1  VAL  62          2HG1      VAL  62  -9.694  -0.530   5.762
  471   3HG1  VAL  62          3HG1      VAL  62 -10.456  -0.568   7.370
  472   1HG2  VAL  62          1HG2      VAL  62  -8.191  -0.231   9.137
  473   2HG2  VAL  62          2HG2      VAL  62  -8.236  -1.368   7.768
  474   3HG2  VAL  62          3HG2      VAL  62  -6.872  -0.237   7.942
  475    H    PHE  63           H        PHE  63  -6.589   0.462   4.017
  476    HA   PHE  63           HA       PHE  63  -9.007   0.853   2.397
  477   1HB   PHE  63          1HB       PHE  63  -6.286   1.858   2.240
  478   2HB   PHE  63          2HB       PHE  63  -6.489   0.736   0.910
  479    HD1  PHE  63           1HD      PHE  63  -6.098   3.820   0.891
  480    HD2  PHE  63           2HD      PHE  63  -9.512   1.323   0.544
  481    HE1  PHE  63           1HE      PHE  63  -7.267   5.603  -0.434
  482    HE2  PHE  63           2HE      PHE  63 -10.681   3.107  -0.781
  483    HZ   PHE  63           HZ       PHE  63  -9.544   5.225  -1.253
  484    H    GLU  64           H        GLU  64  -9.900  -1.093   1.896
  485    HA   GLU  64           HA       GLU  64  -8.275  -3.424   1.949
  486   1HB   GLU  64          1HB       GLU  64 -11.193  -3.050   1.143
  487   2HB   GLU  64          2HB       GLU  64 -10.412  -4.598   1.395
  488   1HG   GLU  64          1HG       GLU  64 -10.100  -4.188   3.744
  489   2HG   GLU  64          2HG       GLU  64 -10.418  -2.473   3.573
  490    H    TYR  65           H        TYR  65  -7.204  -4.347   0.246
  491    HA   TYR  65           HA       TYR  65  -7.897  -3.340  -2.429
  492   1HB   TYR  65          1HB       TYR  65  -5.421  -3.989  -0.845
  493   2HB   TYR  65          2HB       TYR  65  -5.376  -4.576  -2.496
  494    HD1  TYR  65           1HD      TYR  65  -5.479  -1.573  -0.365
  495    HD2  TYR  65           2HD      TYR  65  -5.252  -3.034  -4.380
  496    HE1  TYR  65           1HE      TYR  65  -4.781   0.734  -1.174
  497    HE2  TYR  65           2HE      TYR  65  -4.556  -0.722  -5.175
  498    HH   TYR  65           HH       TYR  65  -3.374   1.561  -3.257
  499    H    ASP  66           H        ASP  66  -6.453  -5.243  -3.928
  500    HA   ASP  66           HA       ASP  66  -8.345  -7.278  -4.026
  501   1HB   ASP  66          1HB       ASP  66  -6.737  -6.352  -5.864
  502   2HB   ASP  66          2HB       ASP  66  -5.536  -7.435  -5.189
  503    H    GLY  67           H        GLY  67  -8.064  -7.865  -1.588
  504   1HA   GLY  67          1HA       GLY  67  -7.575  -9.670  -0.263
  505   2HA   GLY  67          2HA       GLY  67  -6.342 -10.193  -1.394
  506    H    VAL  68           H        VAL  68  -5.322  -7.219  -1.396
  507    HA   VAL  68           HA       VAL  68  -3.634  -7.604   0.953
  508    HB   VAL  68           HB       VAL  68  -3.309  -5.696  -1.368
  509   1HG1  VAL  68          1HG1      VAL  68  -1.570  -6.547   0.939
  510   2HG1  VAL  68          2HG1      VAL  68  -0.836  -6.006  -0.589
  511   3HG1  VAL  68          3HG1      VAL  68  -1.911  -4.914   0.318
  512   1HG2  VAL  68          1HG2      VAL  68  -3.096  -7.623  -2.560
  513   2HG2  VAL  68          2HG2      VAL  68  -1.458  -7.589  -1.863
  514   3HG2  VAL  68          3HG2      VAL  68  -2.719  -8.604  -1.123
  515    H    LYS  69           H        LYS  69  -2.905  -5.381   1.976
  516    HA   LYS  69           HA       LYS  69  -5.180  -3.555   2.090
  517   1HB   LYS  69          1HB       LYS  69  -5.561  -5.141   3.900
  518   2HB   LYS  69          2HB       LYS  69  -3.930  -4.910   4.498
  519   1HG   LYS  69          1HG       LYS  69  -4.531  -2.388   4.699
  520   2HG   LYS  69          2HG       LYS  69  -6.196  -2.875   4.449
  521   1HD   LYS  69          1HD       LYS  69  -6.174  -4.278   6.440
  522   2HD   LYS  69          2HD       LYS  69  -4.439  -4.108   6.617
  523   1HE   LYS  69          1HE       LYS  69  -5.562  -1.453   6.530
  524   2HE   LYS  69          2HE       LYS  69  -6.524  -2.393   7.653
  525   1HZ   LYS  69          1HZ       LYS  69  -4.574  -1.358   8.660
  526   2HZ   LYS  69          2HZ       LYS  69  -4.556  -2.983   8.825
  527   3HZ   LYS  69          3HZ       LYS  69  -3.590  -2.263   7.723
  528    H    VAL  70           H        VAL  70  -4.605  -1.401   2.774
  529    HA   VAL  70           HA       VAL  70  -1.712  -0.949   2.914
  530    HB   VAL  70           HB       VAL  70  -3.620   0.754   1.310
  531   1HG1  VAL  70          1HG1      VAL  70  -1.373   1.637   2.241
  532   2HG1  VAL  70          2HG1      VAL  70  -0.620   0.586   1.017
  533   3HG1  VAL  70          3HG1      VAL  70  -1.729   1.884   0.515
  534   1HG2  VAL  70          1HG2      VAL  70  -2.800  -0.311  -0.710
  535   2HG2  VAL  70          2HG2      VAL  70  -1.741  -1.380   0.242
  536   3HG2  VAL  70          3HG2      VAL  70  -3.510  -1.542   0.362
  537    H    VAL  71           H        VAL  71  -1.112   1.012   4.067
  538    HA   VAL  71           HA       VAL  71  -3.280   2.338   5.479
  539    HB   VAL  71           HB       VAL  71  -2.491   1.867   7.627
  540   1HG1  VAL  71          1HG1      VAL  71  -2.434  -0.642   7.741
  541   2HG1  VAL  71          2HG1      VAL  71  -3.780   0.022   6.785
  542   3HG1  VAL  71          3HG1      VAL  71  -2.359  -0.667   5.963
  543   1HG2  VAL  71          1HG2      VAL  71  -0.398   0.474   8.003
  544   2HG2  VAL  71          2HG2      VAL  71  -0.007   0.761   6.291
  545   3HG2  VAL  71          3HG2      VAL  71  -0.138   2.134   7.416
  546    H    ILE  72           H        ILE  72  -2.932   4.435   4.959
  547    HA   ILE  72           HA       ILE  72  -0.181   5.295   4.551
  548    HB   ILE  72           HB       ILE  72  -2.723   6.842   4.068
  549   1HG1  ILE  72          1HG1      ILE  72  -1.540   5.763   1.665
  550   2HG1  ILE  72          2HG1      ILE  72  -1.931   4.458   2.767
  551   1HG2  ILE  72          1HG2      ILE  72  -0.775   8.242   4.132
  552   2HG2  ILE  72          2HG2      ILE  72   0.118   7.136   3.060
  553   3HG2  ILE  72          3HG2      ILE  72  -1.277   8.048   2.435
  554   1HD1  ILE  72          1HD1      ILE  72  -4.192   4.799   2.589
  555   2HD1  ILE  72          2HD1      ILE  72  -4.022   6.571   2.563
  556   3HD1  ILE  72          3HD1      ILE  72  -3.746   5.628   1.078
  557    H    ASP  73           H        ASP  73   0.543   7.378   5.528
  558    HA   ASP  73           HA       ASP  73  -0.220   7.355   8.286
  559   1HB   ASP  73          1HB       ASP  73   1.753   9.234   6.924
  560   2HB   ASP  73          2HB       ASP  73   1.702   8.799   8.620
  561    HA   PRO  74           HA       PRO  74  -2.588  11.037   8.017
  562   1HB   PRO  74          1HB       PRO  74  -2.166  12.241  10.434
  563   2HB   PRO  74          2HB       PRO  74  -3.266  10.895  10.213
  564   1HG   PRO  74          1HG       PRO  74  -0.577  10.908  11.439
  565   2HG   PRO  74          2HG       PRO  74  -1.844   9.706  11.585
  566   1HD   PRO  74          1HD       PRO  74   0.522   9.519   9.975
  567   2HD   PRO  74          2HD       PRO  74  -0.800   8.370  10.032
  568    H    PHE  75           H        PHE  75   0.778  11.339   8.581
  569    HA   PHE  75           HA       PHE  75   0.705  14.171   7.992
  570   1HB   PHE  75          1HB       PHE  75   2.671  12.023   8.845
  571   2HB   PHE  75          2HB       PHE  75   3.347  13.422   8.036
  572    HD1  PHE  75           1HD      PHE  75   3.724  15.414   9.215
  573    HD2  PHE  75           2HD      PHE  75   1.255  12.422  10.934
  574    HE1  PHE  75           1HE      PHE  75   3.702  16.678  11.383
  575    HE2  PHE  75           2HE      PHE  75   1.232  13.686  13.102
  576    HZ   PHE  75           HZ       PHE  75   2.456  15.799  13.301
  577    H    SER  76           H        SER  76   1.132  11.090   6.353
  578    HA   SER  76           HA       SER  76   2.489  12.340   4.149
  579   1HB   SER  76          1HB       SER  76   3.143  10.062   4.851
  580   2HB   SER  76          2HB       SER  76   1.512   9.482   4.579
  581    HG   SER  76           HG       SER  76   2.710  10.789   2.376
  582    H    MET  77           H        MET  77  -0.737  11.692   5.251
  583    HA   MET  77           HA       MET  77  -2.052  11.166   2.910
  584   1HB   MET  77          1HB       MET  77  -2.686  11.734   5.599
  585   2HB   MET  77          2HB       MET  77  -3.464  13.043   4.732
  586   1HG   MET  77          1HG       MET  77  -3.800  10.142   3.862
  587   2HG   MET  77          2HG       MET  77  -4.832  10.855   5.086
  588   1HE   MET  77          1HE       MET  77  -4.095  11.313   0.904
  589   2HE   MET  77          2HE       MET  77  -4.317   9.876   1.930
  590   3HE   MET  77          3HE       MET  77  -5.692  10.535   1.011
  591    HA   PRO  78           HA       PRO  78  -2.332  15.868   2.306
  592   1HB   PRO  78          1HB       PRO  78  -0.748  17.523   3.796
  593   2HB   PRO  78          2HB       PRO  78  -2.414  17.166   4.206
  594   1HG   PRO  78          1HG       PRO  78   0.062  16.152   5.463
  595   2HG   PRO  78          2HG       PRO  78  -1.571  16.156   6.100
  596   1HD   PRO  78          1HD       PRO  78  -0.163  13.911   5.003
  597   2HD   PRO  78          2HD       PRO  78  -1.833  13.943   5.533
  598    H    TYR  79           H        TYR  79   0.230  13.897   2.289
  599    HA   TYR  79           HA       TYR  79   1.800  15.735   0.622
  600   1HB   TYR  79          1HB       TYR  79   2.470  14.144   2.783
  601   2HB   TYR  79          2HB       TYR  79   2.681  12.969   1.501
  602    HD1  TYR  79           1HD      TYR  79   3.563  15.295  -0.522
  603    HD2  TYR  79           2HD      TYR  79   4.863  14.000   3.343
  604    HE1  TYR  79           1HE      TYR  79   5.885  16.221  -0.984
  605    HE2  TYR  79           2HE      TYR  79   7.181  14.931   2.868
  606    HH   TYR  79           HH       TYR  79   7.821  16.746  -0.094
  607    H    VAL  80           H        VAL  80  -0.207  12.847   0.635
  608    HA   VAL  80           HA       VAL  80   0.338  12.573  -2.227
  609    HB   VAL  80           HB       VAL  80   0.269  10.135  -1.998
  610   1HG1  VAL  80          1HG1      VAL  80   2.478  10.383  -0.223
  611   2HG1  VAL  80          2HG1      VAL  80   2.491  10.303  -2.001
  612   3HG1  VAL  80          3HG1      VAL  80   2.396  11.880  -1.182
  613   1HG2  VAL  80          1HG2      VAL  80   0.001   8.985  -0.038
  614   2HG2  VAL  80          2HG2      VAL  80   0.725  10.275   0.952
  615   3HG2  VAL  80          3HG2      VAL  80  -0.946  10.439   0.360
  616    H    ASN  81           H        ASN  81  -1.716  14.117  -1.121
  617    HA   ASN  81           HA       ASN  81  -4.023  12.473  -0.858
  618   1HB   ASN  81          1HB       ASN  81  -5.188  14.799  -0.913
  619   2HB   ASN  81          2HB       ASN  81  -4.081  14.506   0.414
  620   1HD2  ASN  81          1HD2      ASN  81  -4.940  16.562  -2.056
  621   2HD2  ASN  81          2HD2      ASN  81  -3.525  17.557  -2.152
  622    H    GLY  82           H        GLY  82  -5.739  12.294  -2.447
  623   1HA   GLY  82          1HA       GLY  82  -6.491  12.011  -4.557
  624   2HA   GLY  82          2HA       GLY  82  -6.178  13.729  -4.703
  625    H    ALA  83           H        ALA  83  -4.100  10.743  -4.507
  626    HA   ALA  83           HA       ALA  83  -3.115  11.248  -7.165
  627   1HB   ALA  83          1HB       ALA  83  -1.794  12.462  -5.001
  628   2HB   ALA  83          2HB       ALA  83  -0.832  11.010  -5.364
  629   3HB   ALA  83          3HB       ALA  83  -1.148  12.209  -6.640
  630    H    GLU  84           H        GLU  84  -1.382   9.477  -7.691
  631    HA   GLU  84           HA       GLU  84  -2.084   7.090  -6.169
  632   1HB   GLU  84          1HB       GLU  84  -2.171   5.799  -8.240
  633   2HB   GLU  84          2HB       GLU  84  -3.278   7.151  -8.360
  634   1HG   GLU  84          1HG       GLU  84  -0.945   8.272  -9.352
  635   2HG   GLU  84          2HG       GLU  84  -0.780   6.611  -9.885
  636    H    LEU  85           H        LEU  85  -0.410   5.422  -6.074
  637    HA   LEU  85           HA       LEU  85   2.246   6.560  -6.580
  638   1HB   LEU  85          1HB       LEU  85   2.416   6.203  -4.390
  639   2HB   LEU  85          2HB       LEU  85   1.040   5.120  -4.346
  640    HG   LEU  85           HG       LEU  85   2.494   3.283  -5.197
  641   1HD1  LEU  85          1HD1      LEU  85   4.591   3.569  -5.900
  642   2HD1  LEU  85          2HD1      LEU  85   4.227   5.311  -5.919
  643   3HD1  LEU  85          3HD1      LEU  85   5.016   4.582  -4.500
  644   1HD2  LEU  85          1HD2      LEU  85   2.056   3.918  -2.711
  645   2HD2  LEU  85          2HD2      LEU  85   3.304   2.714  -3.108
  646   3HD2  LEU  85          3HD2      LEU  85   3.773   4.385  -2.713
  647    H    ASP  86           H        ASP  86   3.070   5.846  -8.474
  648    HA   ASP  86           HA       ASP  86   2.277   3.216  -9.355
  649   1HB   ASP  86          1HB       ASP  86   2.318   5.304 -10.859
  650   2HB   ASP  86          2HB       ASP  86   4.067   5.247 -10.764
  651    H    TYR  87           H        TYR  87   3.572   1.605  -8.414
  652    HA   TYR  87           HA       TYR  87   6.338   2.175  -7.808
  653   1HB   TYR  87          1HB       TYR  87   4.246   0.609  -6.787
  654   2HB   TYR  87          2HB       TYR  87   5.152  -0.591  -7.686
  655    HD1  TYR  87           1HD      TYR  87   7.141  -1.530  -6.804
  656    HD2  TYR  87           2HD      TYR  87   5.464   1.962  -4.988
  657    HE1  TYR  87           1HE      TYR  87   8.758  -1.757  -4.855
  658    HE2  TYR  87           2HE      TYR  87   7.086   1.723  -3.046
  659    HH   TYR  87           HH       TYR  87   9.740  -0.453  -3.173
  660    H    VAL  88           H        VAL  88   7.963   1.892  -9.245
  661    HA   VAL  88           HA       VAL  88   7.466   0.523 -11.698
  662    HB   VAL  88           HB       VAL  88   9.803   1.928 -10.432
  663   1HG1  VAL  88          1HG1      VAL  88  10.911   1.582 -12.742
  664   2HG1  VAL  88          2HG1      VAL  88  10.966   0.242 -11.571
  665   3HG1  VAL  88          3HG1      VAL  88   9.795   0.205 -12.912
  666   1HG2  VAL  88          1HG2      VAL  88   8.006   2.454 -12.813
  667   2HG2  VAL  88          2HG2      VAL  88   8.192   3.425 -11.332
  668   3HG2  VAL  88          3HG2      VAL  88   9.516   3.349 -12.519
  669    H    VAL  89           H        VAL  89   8.473  -1.417 -12.457
  670    HA   VAL  89           HA       VAL  89   9.662  -3.046 -10.325
  671    HB   VAL  89           HB       VAL  89   7.704  -4.040 -12.399
  672   1HG1  VAL  89          1HG1      VAL  89   8.776  -5.951 -11.782
  673   2HG1  VAL  89          2HG1      VAL  89   9.304  -5.285 -10.218
  674   3HG1  VAL  89          3HG1      VAL  89   7.632  -5.862 -10.421
  675   1HG2  VAL  89          1HG2      VAL  89   7.254  -2.844  -9.705
  676   2HG2  VAL  89          2HG2      VAL  89   6.210  -2.855 -11.148
  677   3HG2  VAL  89          3HG2      VAL  89   6.318  -4.301 -10.116
  678    H    ASP  90           H        ASP  90  11.729  -3.473 -10.884
  679    HA   ASP  90           HA       ASP  90  12.254  -4.574 -13.428
  680   1HB   ASP  90          1HB       ASP  90  12.310  -1.850 -13.484
  681   2HB   ASP  90          2HB       ASP  90  13.940  -2.141 -12.910
  682    H    PHE  91           H        PHE  91  15.167  -3.607 -13.220
  683    HA   PHE  91           HA       PHE  91  16.161  -5.633 -11.627
  684   1HB   PHE  91          1HB       PHE  91  17.104  -3.881 -13.499
  685   2HB   PHE  91          2HB       PHE  91  17.657  -3.024 -12.074
  686    HD1  PHE  91           1HD      PHE  91  19.875  -3.378 -11.608
  687    HD2  PHE  91           2HD      PHE  91  17.604  -6.603 -13.170
  688    HE1  PHE  91           1HE      PHE  91  21.902  -4.854 -11.506
  689    HE2  PHE  91           2HE      PHE  91  19.631  -8.080 -13.068
  690    HZ   PHE  91           HZ       PHE  91  21.756  -7.188 -12.237
  691    H    MET  92           H        MET  92  14.754  -2.628 -10.690
  692    HA   MET  92           HA       MET  92  16.349  -2.335  -8.339
  693   1HB   MET  92          1HB       MET  92  14.256  -0.854  -9.817
  694   2HB   MET  92          2HB       MET  92  13.974  -0.796  -8.088
  695   1HG   MET  92          1HG       MET  92  16.651  -0.282  -8.094
  696   2HG   MET  92          2HG       MET  92  16.251   0.344  -9.681
  697   1HE   MET  92          1HE       MET  92  16.961   2.644  -9.090
  698   2HE   MET  92          2HE       MET  92  16.278   3.677  -7.812
  699   3HE   MET  92          3HE       MET  92  17.351   2.323  -7.383
  700    H    GLY  93           H        GLY  93  14.271  -4.694  -9.127
  701   1HA   GLY  93          1HA       GLY  93  12.911  -6.092  -8.009
  702   2HA   GLY  93          2HA       GLY  93  13.786  -5.609  -6.570
  703    H    GLY  94           H        GLY  94  12.171  -3.051  -8.357
  704   1HA   GLY  94          1HA       GLY  94   9.781  -2.586  -8.023
  705   2HA   GLY  94          2HA       GLY  94   9.996  -3.057  -6.349
  706    H    GLY  95           H        GLY  95  10.653  -0.570  -8.805
  707   1HA   GLY  95          1HA       GLY  95  12.084   1.145  -6.961
  708   2HA   GLY  95          2HA       GLY  95  11.644   1.483  -8.624
  709    H    PHE  96           H        PHE  96  11.100   3.654  -7.523
  710    HA   PHE  96           HA       PHE  96   8.300   3.523  -6.662
  711   1HB   PHE  96          1HB       PHE  96  10.183   5.709  -5.733
  712   2HB   PHE  96          2HB       PHE  96   8.817   5.018  -4.880
  713    HD1  PHE  96           1HD      PHE  96  12.363   4.991  -5.264
  714    HD2  PHE  96           2HD      PHE  96   9.080   2.656  -3.931
  715    HE1  PHE  96           1HE      PHE  96  13.926   3.562  -3.917
  716    HE2  PHE  96           2HE      PHE  96  10.643   1.227  -2.584
  717    HZ   PHE  96           HZ       PHE  96  13.047   1.698  -2.592
  718    H    THR  97           H        THR  97   6.920   5.043  -7.585
  719    HA   THR  97           HA       THR  97   7.988   7.344  -8.931
  720    HB   THR  97           HB       THR  97   7.103   4.849 -10.414
  721    HG1  THR  97           1HG      THR  97   9.276   5.222 -10.717
  722   1HG2  THR  97          1HG2      THR  97   7.037   6.464 -12.462
  723   2HG2  THR  97          2HG2      THR  97   5.586   6.417 -11.431
  724   3HG2  THR  97          3HG2      THR  97   6.748   7.756 -11.272
  725    H    ILE  98           H        ILE  98   6.534   8.980  -8.961
  726    HA   ILE  98           HA       ILE  98   3.813   8.231  -8.147
  727    HB   ILE  98           HB       ILE  98   5.452  10.693  -7.551
  728   1HG1  ILE  98          1HG1      ILE  98   5.935   8.644  -6.214
  729   2HG1  ILE  98          2HG1      ILE  98   5.360  10.002  -5.268
  730   1HG2  ILE  98          1HG2      ILE  98   3.028  10.713  -6.092
  731   2HG2  ILE  98          2HG2      ILE  98   3.579  11.858  -7.338
  732   3HG2  ILE  98          3HG2      ILE  98   2.606  10.441  -7.800
  733   1HD1  ILE  98          1HD1      ILE  98   3.028   8.573  -6.091
  734   2HD1  ILE  98          2HD1      ILE  98   4.202   7.360  -5.527
  735   3HD1  ILE  98          3HD1      ILE  98   3.710   8.689  -4.450
  736    H    ARG  99           H        ARG  99   2.142   8.741  -9.484
  737    HA   ARG  99           HA       ARG  99   2.888  10.320 -11.808
  738   1HB   ARG  99          1HB       ARG  99   0.996   8.008 -11.368
  739   2HB   ARG  99          2HB       ARG  99   0.576   9.167 -12.614
  740   1HG   ARG  99          1HG       ARG  99   3.210   8.796 -13.232
  741   2HG   ARG  99          2HG       ARG  99   2.870   7.237 -12.507
  742   1HD   ARG  99          1HD       ARG  99   1.731   6.556 -14.353
  743   2HD   ARG  99          2HD       ARG  99   0.676   7.954 -14.278
  744    HE   ARG  99           HE       ARG  99   3.020   7.636 -15.986
  745   1HH1  ARG  99          2HH2      ARG  99   0.966   9.998 -14.377
  746   2HH1  ARG  99          1HH2      ARG  99   1.358  11.277 -15.477
  747   1HH2  ARG  99          2HH1      ARG  99   3.537   9.324 -17.437
  748   2HH2  ARG  99          1HH1      ARG  99   2.830  10.891 -17.230
  749    H    ASN 100           H        ASN 100   2.073  12.391 -11.829
  750    HA   ASN 100           HA       ASN 100  -0.429  12.793 -10.385
  751   1HB   ASN 100          1HB       ASN 100   2.147  14.232 -10.327
  752   2HB   ASN 100          2HB       ASN 100   0.822  15.317 -10.700
  753   1HD2  ASN 100          1HD2      ASN 100   0.316  16.358  -8.928
  754   2HD2  ASN 100          2HD2      ASN 100   0.022  15.678  -7.362
  755    HA   PRO 101           HA       PRO 101  -1.639  13.985 -14.479
  756   1HB   PRO 101          1HB       PRO 101  -4.309  14.296 -13.991
  757   2HB   PRO 101          2HB       PRO 101  -3.580  12.751 -14.379
  758   1HG   PRO 101          1HG       PRO 101  -4.526  13.749 -11.762
  759   2HG   PRO 101          2HG       PRO 101  -4.198  12.099 -12.255
  760   1HD   PRO 101          1HD       PRO 101  -2.536  13.762 -10.612
  761   2HD   PRO 101          2HD       PRO 101  -2.156  12.156 -11.200
  Start of MODEL   10
    1    H    MET   1           H        MET   1 -16.417  -1.631  16.423
    2    HA   MET   1           HA       MET   1 -15.470  -2.200  18.316
    3   1HB   MET   1          1HB       MET   1 -15.117  -4.701  16.737
    4   2HB   MET   1          2HB       MET   1 -13.866  -4.481  17.945
    5   1HG   MET   1          1HG       MET   1 -15.602  -4.187  19.713
    6   2HG   MET   1          2HG       MET   1 -16.869  -4.354  18.514
    7   1HE   MET   1          1HE       MET   1 -17.500  -7.397  20.270
    8   2HE   MET   1          2HE       MET   1 -16.067  -6.971  21.236
    9   3HE   MET   1          3HE       MET   1 -17.190  -5.698  20.703
   10    H    GLN   2           H        GLN   2 -14.108  -0.365  18.268
   11    HA   GLN   2           HA       GLN   2 -12.287   0.808  18.033
   12   1HB   GLN   2          1HB       GLN   2 -11.087  -1.921  18.638
   13   2HB   GLN   2          2HB       GLN   2 -10.100  -0.476  18.544
   14   1HG   GLN   2          1HG       GLN   2 -10.681   0.075  20.663
   15   2HG   GLN   2          2HG       GLN   2 -12.366   0.169  20.189
   16   1HE2  GLN   2          1HE2      GLN   2 -10.143  -1.358  22.119
   17   2HE2  GLN   2          2HE2      GLN   2 -11.023  -2.781  22.566
   18    H    GLU   3           H        GLU   3 -12.885   1.133  15.699
   19    HA   GLU   3           HA       GLU   3 -10.657   0.283  14.083
   20   1HB   GLU   3          1HB       GLU   3 -13.198  -0.983  13.864
   21   2HB   GLU   3          2HB       GLU   3 -13.076   0.082  12.478
   22   1HG   GLU   3          1HG       GLU   3 -10.711  -0.903  12.104
   23   2HG   GLU   3          2HG       GLU   3 -11.131  -2.118  13.296
   24    H    GLN   4           H        GLN   4 -10.267   1.708  12.253
   25    HA   GLN   4           HA       GLN   4 -11.662   4.236  12.607
   26   1HB   GLN   4          1HB       GLN   4  -8.906   3.579  12.415
   27   2HB   GLN   4          2HB       GLN   4  -9.295   4.380  10.906
   28   1HG   GLN   4          1HG       GLN   4 -10.421   5.650  13.373
   29   2HG   GLN   4          2HG       GLN   4  -8.677   5.715  13.215
   30   1HE2  GLN   4          1HE2      GLN   4  -9.704   8.051  13.207
   31   2HE2  GLN   4          2HE2      GLN   4  -9.853   8.777  11.641
   32    H    ALA   5           H        ALA   5 -13.516   3.774  11.302
   33    HA   ALA   5           HA       ALA   5 -13.234   2.729   8.679
   34   1HB   ALA   5          1HB       ALA   5 -15.655   3.388   8.530
   35   2HB   ALA   5          2HB       ALA   5 -15.271   2.394   9.955
   36   3HB   ALA   5          3HB       ALA   5 -15.500   4.150  10.131
   37    H    GLN   6           H        GLN   6 -12.166   3.830   7.105
   38    HA   GLN   6           HA       GLN   6 -13.165   6.269   6.227
   39   1HB   GLN   6          1HB       GLN   6 -11.832   6.991   8.313
   40   2HB   GLN   6          2HB       GLN   6 -10.385   6.534   7.436
   41   1HG   GLN   6          1HG       GLN   6 -10.410   8.487   6.288
   42   2HG   GLN   6          2HG       GLN   6 -12.020   8.152   5.684
   43   1HE2  GLN   6          1HE2      GLN   6 -10.095   9.793   8.034
   44   2HE2  GLN   6          2HE2      GLN   6 -11.335  10.755   8.769
   45    H    GLN   7           H        GLN   7 -12.700   6.396   4.052
   46    HA   GLN   7           HA       GLN   7 -10.417   4.803   3.174
   47   1HB   GLN   7          1HB       GLN   7 -12.674   3.804   2.618
   48   2HB   GLN   7          2HB       GLN   7 -13.031   5.228   1.661
   49   1HG   GLN   7          1HG       GLN   7 -10.662   4.637   0.529
   50   2HG   GLN   7          2HG       GLN   7 -11.032   3.032   1.127
   51   1HE2  GLN   7          1HE2      GLN   7 -12.236   1.764  -0.066
   52   2HE2  GLN   7          2HE2      GLN   7 -13.271   2.231  -1.374
   53    H    PHE   8           H        PHE   8  -8.837   6.286   2.687
   54    HA   PHE   8           HA       PHE   8  -9.503   8.892   1.769
   55   1HB   PHE   8          1HB       PHE   8  -7.477   8.693   3.023
   56   2HB   PHE   8          2HB       PHE   8  -7.064   7.158   2.285
   57    HD1  PHE   8           1HD      PHE   8  -7.373  10.778   1.455
   58    HD2  PHE   8           2HD      PHE   8  -5.447   7.089   0.621
   59    HE1  PHE   8           1HE      PHE   8  -5.800  11.952  -0.109
   60    HE2  PHE   8           2HE      PHE   8  -3.874   8.264  -0.943
   61    HZ   PHE   8           HZ       PHE   8  -4.070  10.682  -1.289
   62    H    ILE   9           H        ILE   9  -8.563   9.838  -0.283
   63    HA   ILE   9           HA       ILE   9  -9.312   8.139  -2.471
   64    HB   ILE   9           HB       ILE   9  -8.214  10.948  -2.539
   65   1HG1  ILE   9          1HG1      ILE   9 -10.146  10.739  -0.972
   66   2HG1  ILE   9          2HG1      ILE   9 -10.435  11.796  -2.339
   67   1HG2  ILE   9          1HG2      ILE   9  -8.356  10.662  -4.738
   68   2HG2  ILE   9          2HG2      ILE   9  -9.144   9.077  -4.548
   69   3HG2  ILE   9          3HG2      ILE   9 -10.123  10.564  -4.543
   70   1HD1  ILE   9          1HD1      ILE   9 -12.002   9.577  -1.540
   71   2HD1  ILE   9          2HD1      ILE   9 -12.178  10.528  -3.034
   72   3HD1  ILE   9          3HD1      ILE   9 -11.174   9.059  -3.028
   73    H    PHE  10           H        PHE  10  -7.929   6.620  -3.213
   74    HA   PHE  10           HA       PHE  10  -5.316   7.456  -4.025
   75   1HB   PHE  10          1HB       PHE  10  -5.274   6.798  -1.485
   76   2HB   PHE  10          2HB       PHE  10  -5.667   5.171  -2.002
   77    HD1  PHE  10           1HD      PHE  10  -3.919   3.699  -2.279
   78    HD2  PHE  10           2HD      PHE  10  -3.178   7.845  -2.795
   79    HE1  PHE  10           1HE      PHE  10  -1.480   3.220  -2.627
   80    HE2  PHE  10           2HE      PHE  10  -0.739   7.366  -3.142
   81    HZ   PHE  10           HZ       PHE  10   0.081   5.059  -3.054
   82    H    LYS  11           H        LYS  11  -4.630   6.254  -5.780
   83    HA   LYS  11           HA       LYS  11  -5.938   3.679  -6.213
   84   1HB   LYS  11          1HB       LYS  11  -5.851   5.921  -8.254
   85   2HB   LYS  11          2HB       LYS  11  -6.366   4.278  -8.577
   86   1HG   LYS  11          1HG       LYS  11  -7.657   5.837  -6.319
   87   2HG   LYS  11          2HG       LYS  11  -8.163   6.127  -7.971
   88   1HD   LYS  11          1HD       LYS  11  -8.819   3.802  -8.271
   89   2HD   LYS  11          2HD       LYS  11  -8.063   3.329  -6.763
   90   1HE   LYS  11          1HE       LYS  11  -9.711   4.504  -5.444
   91   2HE   LYS  11          2HE       LYS  11 -10.313   5.381  -6.837
   92   1HZ   LYS  11          1HZ       LYS  11 -10.876   3.103  -7.735
   93   2HZ   LYS  11          2HZ       LYS  11 -10.656   2.546  -6.216
   94   3HZ   LYS  11          3HZ       LYS  11 -11.804   3.667  -6.516
   95    H    VAL  12           H        VAL  12  -4.293   2.246  -6.253
   96    HA   VAL  12           HA       VAL  12  -1.787   3.150  -7.486
   97    HB   VAL  12           HB       VAL  12  -2.091   2.320  -4.988
   98   1HG1  VAL  12          1HG1      VAL  12  -1.469  -0.294  -6.389
   99   2HG1  VAL  12          2HG1      VAL  12  -1.737  -0.011  -4.652
  100   3HG1  VAL  12          3HG1      VAL  12  -3.093   0.133  -5.797
  101   1HG2  VAL  12          1HG2      VAL  12   0.156   1.874  -6.935
  102   2HG2  VAL  12          2HG2      VAL  12   0.033   3.025  -5.584
  103   3HG2  VAL  12          3HG2      VAL  12   0.311   1.297  -5.259
  104    H    THR  13           H        THR  13  -0.910   2.001  -9.201
  105    HA   THR  13           HA       THR  13  -2.652   0.508 -10.788
  106    HB   THR  13           HB       THR  13  -0.310  -0.074 -11.889
  107    HG1  THR  13           1HG      THR  13   0.667   0.490  -9.690
  108   1HG2  THR  13          1HG2      THR  13  -1.248   1.712 -13.056
  109   2HG2  THR  13          2HG2      THR  13  -1.644   2.603 -11.567
  110   3HG2  THR  13          3HG2      THR  13   0.022   2.613 -12.193
  111    H    ASP  14           H        ASP  14  -2.100  -1.773 -11.631
  112    HA   ASP  14           HA       ASP  14  -2.478  -3.482  -9.465
  113   1HB   ASP  14          1HB       ASP  14  -1.860  -3.904 -12.413
  114   2HB   ASP  14          2HB       ASP  14  -2.010  -5.272 -11.327
  115    H    LYS  15           H        LYS  15   0.332  -2.387 -11.364
  116    HA   LYS  15           HA       LYS  15   2.099  -4.459 -10.701
  117   1HB   LYS  15          1HB       LYS  15   2.133  -2.247 -12.343
  118   2HB   LYS  15          2HB       LYS  15   3.276  -1.790 -11.096
  119   1HG   LYS  15          1HG       LYS  15   4.460  -2.990 -12.879
  120   2HG   LYS  15          2HG       LYS  15   4.493  -3.953 -11.414
  121   1HD   LYS  15          1HD       LYS  15   3.288  -5.641 -12.364
  122   2HD   LYS  15          2HD       LYS  15   2.105  -4.535 -13.034
  123   1HE   LYS  15          1HE       LYS  15   4.645  -4.234 -14.442
  124   2HE   LYS  15          2HE       LYS  15   4.167  -5.920 -14.435
  125   1HZ   LYS  15          1HZ       LYS  15   3.256  -4.344 -16.219
  126   2HZ   LYS  15          2HZ       LYS  15   2.252  -5.447 -15.556
  127   3HZ   LYS  15          3HZ       LYS  15   2.183  -3.888 -15.076
  128    H    ALA  16           H        ALA  16   1.328  -1.294  -9.139
  129    HA   ALA  16           HA       ALA  16   3.271  -1.485  -7.140
  130   1HB   ALA  16          1HB       ALA  16   2.132   0.353  -6.163
  131   2HB   ALA  16          2HB       ALA  16   1.843   0.518  -7.911
  132   3HB   ALA  16          3HB       ALA  16   0.568  -0.139  -6.857
  133    H    VAL  17           H        VAL  17  -0.246  -2.394  -7.167
  134    HA   VAL  17           HA       VAL  17  -0.264  -3.388  -4.559
  135    HB   VAL  17           HB       VAL  17  -1.978  -3.411  -6.946
  136   1HG1  VAL  17          1HG1      VAL  17  -2.150  -5.726  -6.787
  137   2HG1  VAL  17          2HG1      VAL  17  -1.970  -5.723  -5.016
  138   3HG1  VAL  17          3HG1      VAL  17  -3.491  -5.170  -5.757
  139   1HG2  VAL  17          1HG2      VAL  17  -3.133  -2.066  -5.596
  140   2HG2  VAL  17          2HG2      VAL  17  -3.413  -3.419  -4.474
  141   3HG2  VAL  17          3HG2      VAL  17  -1.976  -2.386  -4.281
  142    H    GLU  18           H        GLU  18   0.036  -5.118  -7.743
  143    HA   GLU  18           HA       GLU  18   0.325  -7.619  -6.734
  144   1HB   GLU  18          1HB       GLU  18   0.080  -7.063  -9.143
  145   2HB   GLU  18          2HB       GLU  18   1.709  -6.417  -9.173
  146   1HG   GLU  18          1HG       GLU  18   2.015  -8.988  -8.048
  147   2HG   GLU  18          2HG       GLU  18   0.814  -9.216  -9.304
  148    H    GLU  19           H        GLU  19   2.585  -4.917  -6.663
  149    HA   GLU  19           HA       GLU  19   4.948  -6.311  -6.431
  150   1HB   GLU  19          1HB       GLU  19   4.497  -3.761  -6.685
  151   2HB   GLU  19          2HB       GLU  19   4.356  -3.732  -4.938
  152   1HG   GLU  19          1HG       GLU  19   6.674  -3.191  -5.700
  153   2HG   GLU  19          2HG       GLU  19   6.634  -4.613  -4.677
  154    H    ILE  20           H        ILE  20   2.409  -5.516  -4.029
  155    HA   ILE  20           HA       ILE  20   3.966  -6.385  -1.806
  156    HB   ILE  20           HB       ILE  20   1.055  -5.717  -2.202
  157   1HG1  ILE  20          1HG1      ILE  20   1.720  -3.803  -0.676
  158   2HG1  ILE  20          2HG1      ILE  20   3.388  -4.286  -0.907
  159   1HG2  ILE  20          1HG2      ILE  20   0.787  -7.165  -0.454
  160   2HG2  ILE  20          2HG2      ILE  20   2.445  -6.928   0.150
  161   3HG2  ILE  20          3HG2      ILE  20   1.206  -5.683   0.438
  162   1HD1  ILE  20          1HD1      ILE  20   3.382  -3.733  -3.199
  163   2HD1  ILE  20          2HD1      ILE  20   1.611  -3.861  -3.323
  164   3HD1  ILE  20          3HD1      ILE  20   2.347  -2.466  -2.497
  165    H    LYS  21           H        LYS  21   1.645  -7.846  -4.096
  166    HA   LYS  21           HA       LYS  21   1.119 -10.171  -2.669
  167   1HB   LYS  21          1HB       LYS  21   1.095  -9.470  -5.604
  168   2HB   LYS  21          2HB       LYS  21   0.712 -11.089  -5.054
  169   1HG   LYS  21          1HG       LYS  21  -1.068 -10.162  -3.558
  170   2HG   LYS  21          2HG       LYS  21  -0.683  -8.542  -4.103
  171   1HD   LYS  21          1HD       LYS  21  -1.106 -10.267  -6.413
  172   2HD   LYS  21          2HD       LYS  21  -2.468 -10.411  -5.320
  173   1HE   LYS  21          1HE       LYS  21  -3.114  -8.196  -5.596
  174   2HE   LYS  21          2HE       LYS  21  -1.471  -7.625  -5.813
  175   1HZ   LYS  21          1HZ       LYS  21  -2.454  -7.496  -7.889
  176   2HZ   LYS  21          2HZ       LYS  21  -1.562  -8.860  -7.989
  177   3HZ   LYS  21          3HZ       LYS  21  -3.178  -8.956  -7.780
  178    H    LYS  22           H        LYS  22   3.791  -9.308  -4.934
  179    HA   LYS  22           HA       LYS  22   4.948 -11.902  -4.786
  180   1HB   LYS  22          1HB       LYS  22   5.181  -9.705  -6.452
  181   2HB   LYS  22          2HB       LYS  22   6.705  -9.691  -5.588
  182   1HG   LYS  22          1HG       LYS  22   6.720 -12.293  -6.104
  183   2HG   LYS  22          2HG       LYS  22   5.545 -11.879  -7.336
  184   1HD   LYS  22          1HD       LYS  22   8.085 -10.251  -7.173
  185   2HD   LYS  22          2HD       LYS  22   8.172 -11.859  -7.863
  186   1HE   LYS  22          1HE       LYS  22   5.877 -10.705  -9.055
  187   2HE   LYS  22          2HE       LYS  22   7.050  -9.404  -9.019
  188   1HZ   LYS  22          1HZ       LYS  22   8.068 -10.376 -10.690
  189   2HZ   LYS  22          2HZ       LYS  22   8.368 -11.709  -9.795
  190   3HZ   LYS  22          3HZ       LYS  22   7.005 -11.617 -10.690
  191    H    VAL  23           H        VAL  23   5.644  -8.685  -3.274
  192    HA   VAL  23           HA       VAL  23   7.878  -9.482  -1.846
  193    HB   VAL  23           HB       VAL  23   5.813  -7.338  -1.614
  194   1HG1  VAL  23          1HG1      VAL  23   7.854  -8.026   0.515
  195   2HG1  VAL  23          2HG1      VAL  23   7.161  -6.397   0.332
  196   3HG1  VAL  23          3HG1      VAL  23   6.101  -7.780   0.700
  197   1HG2  VAL  23          1HG2      VAL  23   8.015  -5.972  -1.707
  198   2HG2  VAL  23          2HG2      VAL  23   8.771  -7.512  -2.180
  199   3HG2  VAL  23          3HG2      VAL  23   7.472  -6.816  -3.177
  200    H    ALA  24           H        ALA  24   4.367  -9.764  -1.120
  201    HA   ALA  24           HA       ALA  24   4.809 -10.738   1.517
  202   1HB   ALA  24          1HB       ALA  24   2.746  -9.624   1.036
  203   2HB   ALA  24          2HB       ALA  24   2.430 -10.667  -0.371
  204   3HB   ALA  24          3HB       ALA  24   2.340 -11.341   1.274
  205    H    GLN  25           H        GLN  25   4.309 -12.169  -1.743
  206    HA   GLN  25           HA       GLN  25   3.899 -14.759  -0.937
  207   1HB   GLN  25          1HB       GLN  25   4.533 -13.338  -3.399
  208   2HB   GLN  25          2HB       GLN  25   5.409 -14.855  -3.348
  209   1HG   GLN  25          1HG       GLN  25   3.142 -15.937  -2.642
  210   2HG   GLN  25          2HG       GLN  25   2.401 -14.431  -3.147
  211   1HE2  GLN  25          1HE2      GLN  25   1.309 -15.186  -4.874
  212   2HE2  GLN  25          2HE2      GLN  25   2.036 -15.796  -6.323
  213    H    GLU  26           H        GLU  26   6.932 -12.890  -1.390
  214    HA   GLU  26           HA       GLU  26   8.565 -15.174  -1.024
  215   1HB   GLU  26          1HB       GLU  26   8.928 -12.586  -2.003
  216   2HB   GLU  26          2HB       GLU  26   9.812 -12.550  -0.491
  217   1HG   GLU  26          1HG       GLU  26  10.614 -14.993  -1.493
  218   2HG   GLU  26          2HG       GLU  26  10.372 -14.097  -2.979
  219    H    ASN  27           H        ASN  27   6.569 -13.494   1.072
  220    HA   ASN  27           HA       ASN  27   8.380 -13.995   3.302
  221   1HB   ASN  27          1HB       ASN  27   6.221 -11.914   2.831
  222   2HB   ASN  27          2HB       ASN  27   6.568 -12.404   4.477
  223   1HD2  ASN  27          1HD2      ASN  27   7.356 -10.333   2.007
  224   2HD2  ASN  27          2HD2      ASN  27   8.900  -9.760   2.544
  225    H    ASN  28           H        ASN  28   5.979 -15.409   1.579
  226    HA   ASN  28           HA       ASN  28   4.395 -16.846   1.935
  227   1HB   ASN  28          1HB       ASN  28   6.386 -17.631   3.610
  228   2HB   ASN  28          2HB       ASN  28   5.161 -17.306   4.821
  229   1HD2  ASN  28          1HD2      ASN  28   4.907 -19.421   5.399
  230   2HD2  ASN  28          2HD2      ASN  28   4.138 -20.615   4.407
  231    H    ILE  29           H        ILE  29   3.835 -14.036   2.563
  232    HA   ILE  29           HA       ILE  29   2.093 -14.220   4.903
  233    HB   ILE  29           HB       ILE  29   3.263 -11.921   3.354
  234   1HG1  ILE  29          1HG1      ILE  29   3.459 -12.722   6.273
  235   2HG1  ILE  29          2HG1      ILE  29   4.679 -13.032   5.054
  236   1HG2  ILE  29          1HG2      ILE  29   1.064 -11.850   5.434
  237   2HG2  ILE  29          2HG2      ILE  29   2.029 -10.436   4.943
  238   3HG2  ILE  29          3HG2      ILE  29   0.997 -11.266   3.753
  239   1HD1  ILE  29          1HD1      ILE  29   5.495 -11.033   5.903
  240   2HD1  ILE  29          2HD1      ILE  29   4.428 -10.387   4.633
  241   3HD1  ILE  29          3HD1      ILE  29   3.874 -10.429   6.324
  242    H    GLU  30           H        GLU  30  -0.145 -13.887   4.772
  243    HA   GLU  30           HA       GLU  30  -1.139 -13.842   2.028
  244   1HB   GLU  30          1HB       GLU  30  -1.508 -15.822   4.046
  245   2HB   GLU  30          2HB       GLU  30  -3.046 -14.995   3.895
  246   1HG   GLU  30          1HG       GLU  30  -3.250 -15.528   1.578
  247   2HG   GLU  30          2HG       GLU  30  -1.541 -15.878   1.410
  248    H    ASN  31           H        ASN  31  -0.663 -11.874   4.551
  249    HA   ASN  31           HA       ASN  31  -3.028 -10.370   3.925
  250   1HB   ASN  31          1HB       ASN  31  -2.424 -11.550   6.637
  251   2HB   ASN  31          2HB       ASN  31  -3.045  -9.911   6.610
  252   1HD2  ASN  31          1HD2      ASN  31  -4.580 -11.613   7.835
  253   2HD2  ASN  31          2HD2      ASN  31  -5.972 -12.086   6.920
  254    HA   PRO  32           HA       PRO  32   0.920  -8.092   4.575
  255   1HB   PRO  32          1HB       PRO  32   1.223  -7.070   2.059
  256   2HB   PRO  32          2HB       PRO  32   2.000  -8.547   2.593
  257   1HG   PRO  32          1HG       PRO  32  -0.334  -8.221   0.808
  258   2HG   PRO  32          2HG       PRO  32   0.704  -9.617   1.014
  259   1HD   PRO  32          1HD       PRO  32  -1.938  -9.272   2.075
  260   2HD   PRO  32          2HD       PRO  32  -0.856 -10.617   2.375
  261    H    ILE  33           H        ILE  33   1.416  -5.776   4.626
  262    HA   ILE  33           HA       ILE  33  -0.999  -4.200   4.161
  263    HB   ILE  33           HB       ILE  33   0.532  -4.370   6.754
  264   1HG1  ILE  33          1HG1      ILE  33  -2.439  -4.685   6.314
  265   2HG1  ILE  33          2HG1      ILE  33  -1.337  -6.041   6.176
  266   1HG2  ILE  33          1HG2      ILE  33  -1.580  -2.357   5.935
  267   2HG2  ILE  33          2HG2      ILE  33  -0.887  -2.545   7.564
  268   3HG2  ILE  33          3HG2      ILE  33   0.146  -2.023   6.212
  269   1HD1  ILE  33          1HD1      ILE  33  -0.831  -6.057   8.445
  270   2HD1  ILE  33          2HD1      ILE  33  -1.092  -4.305   8.623
  271   3HD1  ILE  33          3HD1      ILE  33  -2.486  -5.406   8.514
  272    H    LEU  34           H        LEU  34  -0.436  -2.642   2.749
  273    HA   LEU  34           HA       LEU  34   2.357  -1.833   2.668
  274   1HB   LEU  34          1HB       LEU  34   0.880  -2.542   0.663
  275   2HB   LEU  34          2HB       LEU  34   0.192  -0.935   0.791
  276    HG   LEU  34           HG       LEU  34   2.625  -0.079   0.645
  277   1HD1  LEU  34          1HD1      LEU  34   4.254  -1.579   0.564
  278   2HD1  LEU  34          2HD1      LEU  34   3.078  -2.914   0.503
  279   3HD1  LEU  34          3HD1      LEU  34   3.625  -2.139  -1.004
  280   1HD2  LEU  34          1HD2      LEU  34   2.576  -0.449  -1.916
  281   2HD2  LEU  34          2HD2      LEU  34   1.020  -1.258  -1.610
  282   3HD2  LEU  34          3HD2      LEU  34   1.244   0.446  -1.146
  283    H    ARG  35           H        ARG  35   3.103   0.110   3.397
  284    HA   ARG  35           HA       ARG  35   1.031   1.962   4.270
  285   1HB   ARG  35          1HB       ARG  35   2.150   1.022   6.230
  286   2HB   ARG  35          2HB       ARG  35   3.734   1.295   5.530
  287   1HG   ARG  35          1HG       ARG  35   1.928   3.686   5.859
  288   2HG   ARG  35          2HG       ARG  35   2.641   3.006   7.308
  289   1HD   ARG  35          1HD       ARG  35   4.493   3.420   4.977
  290   2HD   ARG  35          2HD       ARG  35   3.907   4.866   5.775
  291    HE   ARG  35           HE       ARG  35   4.982   4.175   7.817
  292   1HH1  ARG  35          2HH2      ARG  35   5.510   1.925   5.163
  293   2HH1  ARG  35          1HH2      ARG  35   6.847   1.134   5.930
  294   1HH2  ARG  35          2HH1      ARG  35   6.745   3.132   8.830
  295   2HH2  ARG  35          1HH1      ARG  35   7.554   1.825   8.030
  296    H    ILE  36           H        ILE  36   1.342   4.189   3.764
  297    HA   ILE  36           HA       ILE  36   3.410   4.656   1.772
  298    HB   ILE  36           HB       ILE  36   0.813   5.934   2.511
  299   1HG1  ILE  36          1HG1      ILE  36   0.805   4.184   0.828
  300   2HG1  ILE  36          2HG1      ILE  36   0.407   5.729   0.102
  301   1HG2  ILE  36          1HG2      ILE  36   3.208   7.344   1.474
  302   2HG2  ILE  36          2HG2      ILE  36   1.672   7.659   0.631
  303   3HG2  ILE  36          3HG2      ILE  36   1.805   7.960   2.380
  304   1HD1  ILE  36          1HD1      ILE  36   2.908   4.076  -0.192
  305   2HD1  ILE  36          2HD1      ILE  36   1.977   4.951  -1.431
  306   3HD1  ILE  36          3HD1      ILE  36   3.047   5.845  -0.326
  307    H    ARG  37           H        ARG  37   5.354   5.343   2.483
  308    HA   ARG  37           HA       ARG  37   5.282   7.290   4.642
  309   1HB   ARG  37          1HB       ARG  37   6.318   4.720   4.890
  310   2HB   ARG  37          2HB       ARG  37   7.750   5.630   4.451
  311   1HG   ARG  37          1HG       ARG  37   7.028   7.326   6.295
  312   2HG   ARG  37          2HG       ARG  37   5.910   6.088   6.833
  313   1HD   ARG  37          1HD       ARG  37   7.854   4.476   7.038
  314   2HD   ARG  37          2HD       ARG  37   8.943   5.777   6.599
  315    HE   ARG  37           HE       ARG  37   7.329   6.696   8.762
  316   1HH1  ARG  37          2HH2      ARG  37   9.841   4.313   8.137
  317   2HH1  ARG  37          1HH2      ARG  37  10.446   4.338   9.760
  318   1HH2  ARG  37          2HH1      ARG  37   8.126   6.730  10.903
  319   2HH2  ARG  37          1HH1      ARG  37   9.464   5.722  11.344
  320    H    VAL  38           H        VAL  38   6.590   9.125   4.314
  321    HA   VAL  38           HA       VAL  38   7.664   9.430   1.674
  322    HB   VAL  38           HB       VAL  38   7.976  11.389   3.925
  323   1HG1  VAL  38          1HG1      VAL  38   7.303  11.805   0.995
  324   2HG1  VAL  38          2HG1      VAL  38   7.784  13.038   2.186
  325   3HG1  VAL  38          3HG1      VAL  38   8.957  11.810   1.653
  326   1HG2  VAL  38          1HG2      VAL  38   5.430  10.419   2.722
  327   2HG2  VAL  38          2HG2      VAL  38   5.753  11.106   4.331
  328   3HG2  VAL  38          3HG2      VAL  38   5.611  12.179   2.918
  329    H    VAL  39           H        VAL  39   9.864   9.792   1.111
  330    HA   VAL  39           HA       VAL  39  11.849   9.528   3.188
  331    HB   VAL  39           HB       VAL  39  11.374   7.219   2.811
  332   1HG1  VAL  39          1HG1      VAL  39  12.031   7.351  -0.112
  333   2HG1  VAL  39          2HG1      VAL  39  11.035   6.179   0.784
  334   3HG1  VAL  39          3HG1      VAL  39  10.394   7.800   0.424
  335   1HG2  VAL  39          1HG2      VAL  39  13.598   6.553   1.558
  336   2HG2  VAL  39          2HG2      VAL  39  13.917   8.302   1.639
  337   3HG2  VAL  39          3HG2      VAL  39  13.654   7.375   3.136
  338    HA   PRO  40           HA       PRO  40  13.555  12.253   0.251
  339   1HB   PRO  40          1HB       PRO  40  15.781  12.973   1.663
  340   2HB   PRO  40          2HB       PRO  40  14.216  13.728   1.890
  341   1HG   PRO  40          1HG       PRO  40  15.599  11.772   3.623
  342   2HG   PRO  40          2HG       PRO  40  14.269  12.842   4.019
  343   1HD   PRO  40          1HD       PRO  40  14.109  10.026   3.499
  344   2HD   PRO  40          2HD       PRO  40  12.767  11.118   3.780
  345    H    GLY  41           H        GLY  41  14.206  11.422  -1.632
  346   1HA   GLY  41          1HA       GLY  41  16.701  10.919  -2.342
  347   2HA   GLY  41          2HA       GLY  41  16.328   9.421  -1.514
  348    H    GLY  42           H        GLY  42  16.944   9.191  -4.158
  349   1HA   GLY  42          1HA       GLY  42  15.598   7.656  -5.544
  350   2HA   GLY  42          2HA       GLY  42  14.315   8.847  -5.475
  351    H    CYS  43           H        CYS  43  16.674   7.660  -7.463
  352    HA   CYS  43           HA       CYS  43  17.855  10.021  -8.438
  353   1HB   CYS  43          1HB       CYS  43  19.003   7.984  -8.846
  354   2HB   CYS  43          2HB       CYS  43  17.589   7.219  -9.545
  355    HG   CYS  43           HG       CYS  43  19.804   8.204 -11.116
  356    H    SER  44           H        SER  44  14.973   8.023  -9.307
  357    HA   SER  44           HA       SER  44  14.348   9.408 -11.623
  358   1HB   SER  44          1HB       SER  44  13.164   7.354  -9.940
  359   2HB   SER  44          2HB       SER  44  11.922   8.485 -10.438
  360    HG   SER  44           HG       SER  44  12.361   8.070 -12.614
  361    H    GLY  45           H        GLY  45  13.413   9.865  -8.168
  362   1HA   GLY  45          1HA       GLY  45  13.263  12.492  -7.958
  363   2HA   GLY  45          2HA       GLY  45  11.784  12.191  -8.848
  364    H    PHE  46           H        PHE  46  11.730  13.307  -6.253
  365    HA   PHE  46           HA       PHE  46  11.608  11.795  -4.074
  366   1HB   PHE  46          1HB       PHE  46   9.413  13.684  -5.119
  367   2HB   PHE  46          2HB       PHE  46   9.677  13.307  -3.428
  368    HD1  PHE  46           1HD      PHE  46  12.147  13.816  -2.577
  369    HD2  PHE  46           2HD      PHE  46  10.324  15.632  -5.951
  370    HE1  PHE  46           1HE      PHE  46  13.737  15.750  -2.395
  371    HE2  PHE  46           2HE      PHE  46  11.914  17.566  -5.769
  372    HZ   PHE  46           HZ       PHE  46  13.601  17.602  -3.993
  373    H    GLN  47           H        GLN  47  10.934   9.700  -3.867
  374    HA   GLN  47           HA       GLN  47   8.174   9.203  -4.596
  375   1HB   GLN  47          1HB       GLN  47   8.924   6.885  -5.431
  376   2HB   GLN  47          2HB       GLN  47   9.247   8.246  -6.487
  377   1HG   GLN  47          1HG       GLN  47  11.533   8.183  -4.887
  378   2HG   GLN  47          2HG       GLN  47  11.149   6.481  -5.055
  379   1HE2  GLN  47          1HE2      GLN  47  13.389   7.006  -6.131
  380   2HE2  GLN  47          2HE2      GLN  47  13.357   7.175  -7.854
  381    H    TYR  48           H        TYR  48   7.067   8.076  -3.014
  382    HA   TYR  48           HA       TYR  48   8.493   7.508  -0.594
  383   1HB   TYR  48          1HB       TYR  48   5.637   6.700  -1.332
  384   2HB   TYR  48          2HB       TYR  48   6.219   7.252   0.226
  385    HD1  TYR  48           1HD      TYR  48   3.974   8.169  -2.030
  386    HD2  TYR  48           2HD      TYR  48   7.583   9.764  -0.377
  387    HE1  TYR  48           1HE      TYR  48   3.186  10.526  -2.565
  388    HE2  TYR  48           2HE      TYR  48   6.783  12.116  -0.918
  389    HH   TYR  48           HH       TYR  48   4.131  13.086  -1.234
  390    H    ALA  49           H        ALA  49   9.030   5.527   0.291
  391    HA   ALA  49           HA       ALA  49   9.042   3.311  -1.541
  392   1HB   ALA  49          1HB       ALA  49  10.158   3.892   1.210
  393   2HB   ALA  49          2HB       ALA  49  10.180   2.241   0.545
  394   3HB   ALA  49          3HB       ALA  49  11.029   3.555  -0.305
  395    H    MET  50           H        MET  50   8.228   1.132  -0.901
  396    HA   MET  50           HA       MET  50   6.021   1.304   0.981
  397   1HB   MET  50          1HB       MET  50   4.674  -0.097  -0.722
  398   2HB   MET  50          2HB       MET  50   4.934   1.576  -1.174
  399   1HG   MET  50          1HG       MET  50   6.175   0.999  -3.002
  400   2HG   MET  50          2HG       MET  50   7.152  -0.130  -2.085
  401   1HE   MET  50          1HE       MET  50   7.252  -2.366  -2.573
  402   2HE   MET  50          2HE       MET  50   6.016  -2.680  -1.331
  403   3HE   MET  50          3HE       MET  50   5.903  -3.474  -2.920
  404    H    GLY  51           H        GLY  51   5.506  -0.689   2.047
  405   1HA   GLY  51          1HA       GLY  51   6.677  -3.166   1.290
  406   2HA   GLY  51          2HA       GLY  51   7.610  -2.408   2.565
  407    H    PHE  52           H        PHE  52   6.483  -4.773   3.243
  408    HA   PHE  52           HA       PHE  52   3.842  -4.431   4.276
  409   1HB   PHE  52          1HB       PHE  52   4.378  -6.732   5.204
  410   2HB   PHE  52          2HB       PHE  52   4.743  -6.619   3.493
  411    HD1  PHE  52           1HD      PHE  52   6.972  -6.864   2.691
  412    HD2  PHE  52           2HD      PHE  52   6.236  -6.658   6.865
  413    HE1  PHE  52           1HE      PHE  52   9.324  -7.614   3.143
  414    HE2  PHE  52           2HE      PHE  52   8.589  -7.409   7.317
  415    HZ   PHE  52           HZ       PHE  52  10.105  -7.877   5.450
  416    H    ASP  53           H        ASP  53   3.237  -3.668   6.255
  417    HA   ASP  53           HA       ASP  53   5.359  -2.867   8.012
  418   1HB   ASP  53          1HB       ASP  53   2.897  -1.784   7.331
  419   2HB   ASP  53          2HB       ASP  53   2.530  -2.521   8.878
  420    H    ASP  54           H        ASP  54   4.672  -3.178  10.540
  421    HA   ASP  54           HA       ASP  54   4.480  -5.997  10.867
  422   1HB   ASP  54          1HB       ASP  54   5.350  -3.677  12.414
  423   2HB   ASP  54          2HB       ASP  54   4.309  -4.688  13.397
  424    H    THR  55           H        THR  55   2.499  -3.050  11.359
  425    HA   THR  55           HA       THR  55   0.095  -4.550  11.466
  426    HB   THR  55           HB       THR  55   1.315  -4.650  13.869
  427    HG1  THR  55           1HG      THR  55  -0.821  -5.466  13.347
  428   1HG2  THR  55          1HG2      THR  55  -0.256  -2.019  13.861
  429   2HG2  THR  55          2HG2      THR  55   0.265  -2.881  15.329
  430   3HG2  THR  55          3HG2      THR  55   1.479  -2.199  14.219
  431    H    VAL  56           H        VAL  56  -1.808  -2.969  12.064
  432    HA   VAL  56           HA       VAL  56  -1.268  -0.594  10.479
  433    HB   VAL  56           HB       VAL  56  -3.261  -2.396  10.399
  434   1HG1  VAL  56          1HG1      VAL  56  -5.238  -1.691  11.473
  435   2HG1  VAL  56          2HG1      VAL  56  -3.978  -1.583  12.726
  436   3HG1  VAL  56          3HG1      VAL  56  -4.545  -0.109  11.905
  437   1HG2  VAL  56          1HG2      VAL  56  -2.689   0.145   9.267
  438   2HG2  VAL  56          2HG2      VAL  56  -3.746  -1.135   8.626
  439   3HG2  VAL  56          3HG2      VAL  56  -4.421   0.132   9.677
  440    H    GLU  57           H        GLU  57  -2.039   1.543  11.202
  441    HA   GLU  57           HA       GLU  57  -1.393   1.872  13.967
  442   1HB   GLU  57          1HB       GLU  57  -2.283   4.091  12.102
  443   2HB   GLU  57          2HB       GLU  57  -1.198   4.193  13.474
  444   1HG   GLU  57          1HG       GLU  57   0.047   2.304  11.807
  445   2HG   GLU  57          2HG       GLU  57  -0.611   3.468  10.674
  446    H    GLU  58           H        GLU  58  -2.818   3.604  15.224
  447    HA   GLU  58           HA       GLU  58  -5.466   2.497  15.187
  448   1HB   GLU  58          1HB       GLU  58  -3.904   3.035  17.262
  449   2HB   GLU  58          2HB       GLU  58  -4.553   4.655  17.098
  450   1HG   GLU  58          1HG       GLU  58  -6.112   3.700  18.559
  451   2HG   GLU  58          2HG       GLU  58  -6.901   3.438  17.016
  452    H    GLY  59           H        GLY  59  -4.403   4.387  13.029
  453   1HA   GLY  59          1HA       GLY  59  -6.758   5.902  12.676
  454   2HA   GLY  59          2HA       GLY  59  -5.490   6.942  13.292
  455    H    ASP  60           H        ASP  60  -5.510   4.117  10.995
  456    HA   ASP  60           HA       ASP  60  -4.032   5.840   9.170
  457   1HB   ASP  60          1HB       ASP  60  -3.450   3.271  10.146
  458   2HB   ASP  60          2HB       ASP  60  -4.101   2.951   8.551
  459    H    HIS  61           H        HIS  61  -4.448   5.104   6.731
  460    HA   HIS  61           HA       HIS  61  -7.331   4.931   6.432
  461   1HB   HIS  61          1HB       HIS  61  -5.081   5.786   4.608
  462   2HB   HIS  61          2HB       HIS  61  -6.701   5.499   4.003
  463    HD1  HIS  61           1HD      HIS  61  -8.622   7.123   4.889
  464    HD2  HIS  61           2HD      HIS  61  -4.713   8.199   5.964
  465    HE1  HIS  61           1HE      HIS  61  -8.740   9.544   5.687
  466    H    VAL  62           H        VAL  62  -7.892   2.769   6.673
  467    HA   VAL  62           HA       VAL  62  -6.306   0.722   5.466
  468    HB   VAL  62           HB       VAL  62  -8.296   0.953   7.451
  469   1HG1  VAL  62          1HG1      VAL  62  -9.142  -0.838   5.155
  470   2HG1  VAL  62          2HG1      VAL  62  -9.764  -0.999   6.815
  471   3HG1  VAL  62          3HG1      VAL  62 -10.057   0.497   5.896
  472   1HG2  VAL  62          1HG2      VAL  62  -6.519  -0.408   7.987
  473   2HG2  VAL  62          2HG2      VAL  62  -7.742  -1.632   7.569
  474   3HG2  VAL  62          3HG2      VAL  62  -6.487  -1.188   6.387
  475    H    PHE  63           H        PHE  63  -6.294   0.262   3.333
  476    HA   PHE  63           HA       PHE  63  -8.763   0.848   1.855
  477   1HB   PHE  63          1HB       PHE  63  -5.988   1.601   1.543
  478   2HB   PHE  63          2HB       PHE  63  -6.326   0.458   0.259
  479    HD1  PHE  63           1HD      PHE  63  -6.004   3.742   0.700
  480    HD2  PHE  63           2HD      PHE  63  -8.994   1.029  -0.605
  481    HE1  PHE  63           1HE      PHE  63  -7.075   5.570  -0.645
  482    HE2  PHE  63           2HE      PHE  63 -10.065   2.857  -1.951
  483    HZ   PHE  63           HZ       PHE  63  -9.093   5.106  -1.955
  484    H    GLU  64           H        GLU  64  -9.877  -0.989   1.395
  485    HA   GLU  64           HA       GLU  64  -8.583  -3.493   1.483
  486   1HB   GLU  64          1HB       GLU  64 -11.373  -2.749   0.497
  487   2HB   GLU  64          2HB       GLU  64 -10.823  -4.380   0.830
  488   1HG   GLU  64          1HG       GLU  64 -10.308  -3.634   3.219
  489   2HG   GLU  64          2HG       GLU  64 -11.068  -2.100   2.845
  490    H    TYR  65           H        TYR  65  -7.846  -4.812  -0.188
  491    HA   TYR  65           HA       TYR  65  -8.371  -3.909  -2.921
  492   1HB   TYR  65          1HB       TYR  65  -5.956  -3.602  -1.367
  493   2HB   TYR  65          2HB       TYR  65  -5.642  -4.938  -2.456
  494    HD1  TYR  65           1HD      TYR  65  -7.001  -4.189  -4.926
  495    HD2  TYR  65           2HD      TYR  65  -4.828  -1.736  -2.175
  496    HE1  TYR  65           1HE      TYR  65  -6.486  -2.540  -6.792
  497    HE2  TYR  65           2HE      TYR  65  -4.319  -0.096  -4.051
  498    HH   TYR  65           HH       TYR  65  -5.940  -0.190  -7.015
  499    H    ASP  66           H        ASP  66  -6.397  -5.825  -3.993
  500    HA   ASP  66           HA       ASP  66  -8.077  -8.030  -4.118
  501   1HB   ASP  66          1HB       ASP  66  -6.189  -7.182  -5.736
  502   2HB   ASP  66          2HB       ASP  66  -5.098  -8.107  -4.724
  503    H    GLY  67           H        GLY  67  -8.247  -8.318  -1.634
  504   1HA   GLY  67          1HA       GLY  67  -7.831  -9.572   0.185
  505   2HA   GLY  67          2HA       GLY  67  -6.744 -10.543  -0.787
  506    H    VAL  68           H        VAL  68  -6.501  -6.999  -0.136
  507    HA   VAL  68           HA       VAL  68  -4.376  -7.434   1.764
  508    HB   VAL  68           HB       VAL  68  -3.848  -6.076  -0.887
  509   1HG1  VAL  68          1HG1      VAL  68  -2.631  -4.952   0.854
  510   2HG1  VAL  68          2HG1      VAL  68  -2.104  -6.499   1.559
  511   3HG1  VAL  68          3HG1      VAL  68  -1.488  -5.990  -0.032
  512   1HG2  VAL  68          1HG2      VAL  68  -2.206  -7.926  -1.224
  513   2HG2  VAL  68          2HG2      VAL  68  -2.868  -8.727   0.221
  514   3HG2  VAL  68          3HG2      VAL  68  -3.900  -8.471  -1.206
  515    H    LYS  69           H        LYS  69  -4.016  -5.590   3.071
  516    HA   LYS  69           HA       LYS  69  -5.923  -3.418   2.545
  517   1HB   LYS  69          1HB       LYS  69  -4.893  -4.317   5.248
  518   2HB   LYS  69          2HB       LYS  69  -6.154  -3.144   4.926
  519   1HG   LYS  69          1HG       LYS  69  -7.533  -4.959   5.248
  520   2HG   LYS  69          2HG       LYS  69  -7.195  -5.245   3.553
  521   1HD   LYS  69          1HD       LYS  69  -6.218  -7.224   4.062
  522   2HD   LYS  69          2HD       LYS  69  -5.027  -6.398   5.047
  523   1HE   LYS  69          1HE       LYS  69  -6.077  -6.951   7.011
  524   2HE   LYS  69          2HE       LYS  69  -7.672  -6.616   6.368
  525   1HZ   LYS  69          1HZ       LYS  69  -7.210  -8.976   6.867
  526   2HZ   LYS  69          2HZ       LYS  69  -7.712  -8.715   5.335
  527   3HZ   LYS  69          3HZ       LYS  69  -6.135  -9.007   5.638
  528    H    VAL  70           H        VAL  70  -5.119  -1.388   2.282
  529    HA   VAL  70           HA       VAL  70  -2.233  -1.106   2.693
  530    HB   VAL  70           HB       VAL  70  -4.226   0.316   0.927
  531   1HG1  VAL  70          1HG1      VAL  70  -1.297   0.976   1.386
  532   2HG1  VAL  70          2HG1      VAL  70  -2.314   1.658   0.095
  533   3HG1  VAL  70          3HG1      VAL  70  -2.697   1.994   1.800
  534   1HG2  VAL  70          1HG2      VAL  70  -1.732  -1.269   0.228
  535   2HG2  VAL  70          2HG2      VAL  70  -3.391  -1.911   0.182
  536   3HG2  VAL  70          3HG2      VAL  70  -2.921  -0.582  -0.904
  537    H    VAL  71           H        VAL  71  -1.484   1.079   3.477
  538    HA   VAL  71           HA       VAL  71  -3.467   2.482   5.071
  539    HB   VAL  71           HB       VAL  71  -2.532   2.098   7.114
  540   1HG1  VAL  71          1HG1      VAL  71  -1.966  -0.344   7.321
  541   2HG1  VAL  71          2HG1      VAL  71  -3.472  -0.004   6.435
  542   3HG1  VAL  71          3HG1      VAL  71  -1.995  -0.442   5.544
  543   1HG2  VAL  71          1HG2      VAL  71   0.057   1.191   5.810
  544   2HG2  VAL  71          2HG2      VAL  71  -0.252   2.814   6.473
  545   3HG2  VAL  71          3HG2      VAL  71  -0.239   1.399   7.553
  546    H    ILE  72           H        ILE  72  -2.651   4.610   5.812
  547    HA   ILE  72           HA       ILE  72  -0.181   5.458   4.540
  548    HB   ILE  72           HB       ILE  72  -2.728   6.981   4.038
  549   1HG1  ILE  72          1HG1      ILE  72  -1.424   5.021   2.128
  550   2HG1  ILE  72          2HG1      ILE  72  -2.867   4.675   3.060
  551   1HG2  ILE  72          1HG2      ILE  72  -0.009   7.607   3.729
  552   2HG2  ILE  72          2HG2      ILE  72  -0.614   7.268   2.090
  553   3HG2  ILE  72          3HG2      ILE  72  -1.413   8.500   3.097
  554   1HD1  ILE  72          1HD1      ILE  72  -2.897   7.238   1.510
  555   2HD1  ILE  72          2HD1      ILE  72  -2.948   5.732   0.562
  556   3HD1  ILE  72          3HD1      ILE  72  -4.202   6.058   1.783
  557    H    ASP  73           H        ASP  73   0.908   6.117   6.327
  558    HA   ASP  73           HA       ASP  73   0.008   6.740   8.708
  559   1HB   ASP  73          1HB       ASP  73   2.103   8.506   7.378
  560   2HB   ASP  73          2HB       ASP  73   2.017   8.052   9.069
  561    HA   PRO  74           HA       PRO  74  -2.139  10.555   8.455
  562   1HB   PRO  74          1HB       PRO  74  -1.717  11.668  10.915
  563   2HB   PRO  74          2HB       PRO  74  -2.890  10.399  10.626
  564   1HG   PRO  74          1HG       PRO  74  -0.243  10.213  11.929
  565   2HG   PRO  74          2HG       PRO  74  -1.585   9.089  12.005
  566   1HD   PRO  74          1HD       PRO  74   0.812   8.797  10.458
  567   2HD   PRO  74          2HD       PRO  74  -0.580   7.732  10.446
  568    H    PHE  75           H        PHE  75   1.221  10.603   9.039
  569    HA   PHE  75           HA       PHE  75   1.388  13.453   8.661
  570   1HB   PHE  75          1HB       PHE  75   2.909  11.352   9.816
  571   2HB   PHE  75          2HB       PHE  75   3.819  11.753   8.373
  572    HD1  PHE  75           1HD      PHE  75   3.360  12.521  11.754
  573    HD2  PHE  75           2HD      PHE  75   4.229  14.352   8.026
  574    HE1  PHE  75           1HE      PHE  75   4.401  14.466  12.952
  575    HE2  PHE  75           2HE      PHE  75   5.270  16.297   9.223
  576    HZ   PHE  75           HZ       PHE  75   5.343  16.331  11.672
  577    H    SER  76           H        SER  76   1.612  10.472   6.751
  578    HA   SER  76           HA       SER  76   2.863  11.874   4.580
  579   1HB   SER  76          1HB       SER  76   2.530   9.583   3.429
  580   2HB   SER  76          2HB       SER  76   3.633   9.645   4.789
  581    HG   SER  76           HG       SER  76   1.968   7.849   4.731
  582    H    MET  77           H        MET  77  -0.310  11.224   5.811
  583    HA   MET  77           HA       MET  77  -1.772  10.895   3.523
  584   1HB   MET  77          1HB       MET  77  -2.206  11.429   6.305
  585   2HB   MET  77          2HB       MET  77  -3.113  12.661   5.450
  586   1HG   MET  77          1HG       MET  77  -3.412   9.947   4.277
  587   2HG   MET  77          2HG       MET  77  -3.994  10.063   5.926
  588   1HE   MET  77          1HE       MET  77  -4.775  10.481   2.346
  589   2HE   MET  77          2HE       MET  77  -5.749  11.962   2.183
  590   3HE   MET  77          3HE       MET  77  -4.002  12.076   2.508
  591    HA   PRO  78           HA       PRO  78  -1.971  15.628   3.233
  592   1HB   PRO  78          1HB       PRO  78  -0.325  17.162   4.784
  593   2HB   PRO  78          2HB       PRO  78  -1.984  16.798   5.216
  594   1HG   PRO  78          1HG       PRO  78   0.511  15.674   6.334
  595   2HG   PRO  78          2HG       PRO  78  -1.103  15.655   7.015
  596   1HD   PRO  78          1HD       PRO  78   0.245  13.472   5.734
  597   2HD   PRO  78          2HD       PRO  78  -1.410  13.488   6.311
  598    H    TYR  79           H        TYR  79   0.562  13.633   3.013
  599    HA   TYR  79           HA       TYR  79   2.045  15.551   1.347
  600   1HB   TYR  79          1HB       TYR  79   2.788  13.887   3.499
  601   2HB   TYR  79          2HB       TYR  79   3.181  12.880   2.120
  602    HD1  TYR  79           1HD      TYR  79   5.131  14.052   4.173
  603    HD2  TYR  79           2HD      TYR  79   3.850  15.419   0.327
  604    HE1  TYR  79           1HE      TYR  79   7.325  15.304   3.880
  605    HE2  TYR  79           2HE      TYR  79   6.047  16.667   0.046
  606    HH   TYR  79           HH       TYR  79   8.052  17.366   2.535
  607    H    VAL  80           H        VAL  80  -0.091  12.872   1.304
  608    HA   VAL  80           HA       VAL  80   0.533  12.459  -1.506
  609    HB   VAL  80           HB       VAL  80   0.642  10.102  -1.341
  610   1HG1  VAL  80          1HG1      VAL  80   2.357  10.972   0.987
  611   2HG1  VAL  80          2HG1      VAL  80   2.721   9.796  -0.299
  612   3HG1  VAL  80          3HG1      VAL  80   2.684  11.537  -0.669
  613   1HG2  VAL  80          1HG2      VAL  80  -0.545  10.546   1.324
  614   2HG2  VAL  80          2HG2      VAL  80  -0.711   9.172   0.204
  615   3HG2  VAL  80          3HG2      VAL  80   0.710   9.285   1.271
  616    H    ASN  81           H        ASN  81  -1.494  14.053  -0.588
  617    HA   ASN  81           HA       ASN  81  -3.825  12.391  -0.323
  618   1HB   ASN  81          1HB       ASN  81  -4.979  14.715  -0.231
  619   2HB   ASN  81          2HB       ASN  81  -3.878  14.341   1.080
  620   1HD2  ASN  81          1HD2      ASN  81  -4.696  16.501  -1.347
  621   2HD2  ASN  81          2HD2      ASN  81  -3.292  17.516  -1.346
  622    H    GLY  82           H        GLY  82  -5.447  12.223  -1.975
  623   1HA   GLY  82          1HA       GLY  82  -6.200  12.126  -4.095
  624   2HA   GLY  82          2HA       GLY  82  -5.859  13.845  -4.138
  625    H    ALA  83           H        ALA  83  -3.866  10.794  -4.110
  626    HA   ALA  83           HA       ALA  83  -2.801  11.466  -6.699
  627   1HB   ALA  83          1HB       ALA  83  -1.476  12.382  -4.349
  628   2HB   ALA  83          2HB       ALA  83  -0.529  11.013  -4.981
  629   3HB   ALA  83          3HB       ALA  83  -0.879  12.411  -6.026
  630    H    GLU  84           H        GLU  84  -0.945   9.692  -7.162
  631    HA   GLU  84           HA       GLU  84  -1.805   7.222  -5.888
  632   1HB   GLU  84          1HB       GLU  84  -1.578   6.140  -8.215
  633   2HB   GLU  84          2HB       GLU  84  -2.998   7.130  -7.940
  634   1HG   GLU  84          1HG       GLU  84  -1.514   9.093  -8.909
  635   2HG   GLU  84          2HG       GLU  84  -0.513   7.803  -9.546
  636    H    LEU  85           H        LEU  85  -0.172   5.349  -6.697
  637    HA   LEU  85           HA       LEU  85   2.514   6.496  -6.875
  638   1HB   LEU  85          1HB       LEU  85   2.794   6.060  -4.717
  639   2HB   LEU  85          2HB       LEU  85   1.344   5.081  -4.619
  640    HG   LEU  85           HG       LEU  85   2.568   3.135  -5.479
  641   1HD1  LEU  85          1HD1      LEU  85   4.561   5.150  -6.143
  642   2HD1  LEU  85          2HD1      LEU  85   5.260   3.783  -5.242
  643   3HD1  LEU  85          3HD1      LEU  85   4.360   3.488  -6.750
  644   1HD2  LEU  85          1HD2      LEU  85   2.449   3.662  -3.032
  645   2HD2  LEU  85          2HD2      LEU  85   3.830   2.647  -3.511
  646   3HD2  LEU  85          3HD2      LEU  85   4.074   4.376  -3.164
  647    H    ASP  86           H        ASP  86   3.201   5.815  -8.839
  648    HA   ASP  86           HA       ASP  86   2.318   3.209  -9.714
  649   1HB   ASP  86          1HB       ASP  86   2.142   5.117 -11.286
  650   2HB   ASP  86          2HB       ASP  86   3.856   5.442 -11.121
  651    H    TYR  87           H        TYR  87   3.782   1.455  -9.917
  652    HA   TYR  87           HA       TYR  87   6.387   1.837  -8.726
  653   1HB   TYR  87          1HB       TYR  87   4.762  -0.096  -8.282
  654   2HB   TYR  87          2HB       TYR  87   4.892  -0.558  -9.968
  655    HD1  TYR  87           1HD      TYR  87   7.082  -1.434 -10.852
  656    HD2  TYR  87           2HD      TYR  87   6.417  -0.750  -6.681
  657    HE1  TYR  87           1HE      TYR  87   9.069  -2.916 -10.284
  658    HE2  TYR  87           2HE      TYR  87   8.406  -2.234  -6.128
  659    HH   TYR  87           HH       TYR  87   9.934  -3.550  -6.896
  660    H    VAL  88           H        VAL  88   7.813   2.856 -10.120
  661    HA   VAL  88           HA       VAL  88   7.956   1.808 -12.846
  662    HB   VAL  88           HB       VAL  88   8.837   4.341 -11.488
  663   1HG1  VAL  88          1HG1      VAL  88   9.916   4.982 -13.669
  664   2HG1  VAL  88          2HG1      VAL  88  10.782   3.726 -12.751
  665   3HG1  VAL  88          3HG1      VAL  88   9.795   3.275 -14.162
  666   1HG2  VAL  88          1HG2      VAL  88   7.670   5.158 -13.730
  667   2HG2  VAL  88          2HG2      VAL  88   6.901   3.556 -13.632
  668   3HG2  VAL  88          3HG2      VAL  88   6.719   4.713 -12.292
  669    H    VAL  89           H        VAL  89  10.071   1.247 -13.756
  670    HA   VAL  89           HA       VAL  89  12.016   0.522 -11.680
  671    HB   VAL  89           HB       VAL  89  11.091  -1.146 -14.027
  672   1HG1  VAL  89          1HG1      VAL  89  13.489  -1.285 -12.284
  673   2HG1  VAL  89          2HG1      VAL  89  12.624  -2.819 -12.545
  674   3HG1  VAL  89          3HG1      VAL  89  13.231  -1.890 -13.937
  675   1HG2  VAL  89          1HG2      VAL  89  10.026  -0.892 -11.424
  676   2HG2  VAL  89          2HG2      VAL  89   9.638  -2.125 -12.648
  677   3HG2  VAL  89          3HG2      VAL  89  10.916  -2.433 -11.449
  678    H    ASP  90           H        ASP  90  14.052   1.249 -12.081
  679    HA   ASP  90           HA       ASP  90  14.980   1.492 -14.735
  680   1HB   ASP  90          1HB       ASP  90  14.571   4.043 -13.103
  681   2HB   ASP  90          2HB       ASP  90  15.439   3.955 -14.623
  682    H    PHE  91           H        PHE  91  17.116   3.358 -14.219
  683    HA   PHE  91           HA       PHE  91  19.220   3.125 -13.486
  684   1HB   PHE  91          1HB       PHE  91  17.582   4.470 -11.782
  685   2HB   PHE  91          2HB       PHE  91  17.988   3.152 -10.701
  686    HD1  PHE  91           1HD      PHE  91  19.966   5.195 -13.132
  687    HD2  PHE  91           2HD      PHE  91  19.544   3.808  -9.144
  688    HE1  PHE  91           1HE      PHE  91  22.093   6.368 -12.499
  689    HE2  PHE  91           2HE      PHE  91  21.670   4.981  -8.511
  690    HZ   PHE  91           HZ       PHE  91  22.920   6.247 -10.196
  691    H    MET  92           H        MET  92  19.675   2.187 -10.534
  692    HA   MET  92           HA       MET  92  20.506  -0.381 -11.239
  693   1HB   MET  92          1HB       MET  92  21.295  -0.481  -8.939
  694   2HB   MET  92          2HB       MET  92  21.456   1.193  -9.431
  695   1HG   MET  92          1HG       MET  92  19.113   1.583  -8.402
  696   2HG   MET  92          2HG       MET  92  19.252  -0.019  -7.704
  697   1HE   MET  92          1HE       MET  92  19.746  -0.424  -5.825
  698   2HE   MET  92          2HE       MET  92  21.294  -0.083  -5.016
  699   3HE   MET  92          3HE       MET  92  19.857   0.897  -4.638
  700    H    GLY  93           H        GLY  93  17.429   0.855 -10.285
  701   1HA   GLY  93          1HA       GLY  93  15.885  -1.261 -10.651
  702   2HA   GLY  93          2HA       GLY  93  16.532  -1.641  -9.067
  703    H    GLY  94           H        GLY  94  13.958  -0.199 -10.636
  704   1HA   GLY  94          1HA       GLY  94  13.537   1.924  -8.666
  705   2HA   GLY  94          2HA       GLY  94  12.609   1.622 -10.122
  706    H    GLY  95           H        GLY  95  10.647   1.786  -8.783
  707   1HA   GLY  95          1HA       GLY  95   9.198  -0.318  -8.296
  708   2HA   GLY  95          2HA       GLY  95  10.240  -0.421  -6.890
  709    H    PHE  96           H        PHE  96  10.363   2.774  -7.228
  710    HA   PHE  96           HA       PHE  96   7.746   3.269  -6.003
  711   1HB   PHE  96          1HB       PHE  96  10.320   4.665  -5.152
  712   2HB   PHE  96          2HB       PHE  96   8.857   4.441  -4.213
  713    HD1  PHE  96           1HD      PHE  96  12.061   3.661  -4.019
  714    HD2  PHE  96           2HD      PHE  96   8.368   1.592  -4.313
  715    HE1  PHE  96           1HE      PHE  96  13.089   1.667  -2.894
  716    HE2  PHE  96           2HE      PHE  96   9.396  -0.402  -3.188
  717    HZ   PHE  96           HZ       PHE  96  11.744  -0.341  -2.492
  718    H    THR  97           H        THR  97   6.724   4.547  -7.492
  719    HA   THR  97           HA       THR  97   8.074   7.021  -8.230
  720    HB   THR  97           HB       THR  97   7.340   4.756 -10.082
  721    HG1  THR  97           1HG      THR  97   9.550   5.327  -9.744
  722   1HG2  THR  97          1HG2      THR  97   6.934   7.725 -10.635
  723   2HG2  THR  97          2HG2      THR  97   7.440   6.616 -11.932
  724   3HG2  THR  97          3HG2      THR  97   5.887   6.363 -11.101
  725    H    ILE  98           H        ILE  98   6.716   8.765  -8.430
  726    HA   ILE  98           HA       ILE  98   3.854   8.162  -8.262
  727    HB   ILE  98           HB       ILE  98   5.454   9.989  -6.478
  728   1HG1  ILE  98          1HG1      ILE  98   3.703   8.511  -4.940
  729   2HG1  ILE  98          2HG1      ILE  98   4.153   7.368  -6.190
  730   1HG2  ILE  98          1HG2      ILE  98   3.226  10.652  -5.522
  731   2HG2  ILE  98          2HG2      ILE  98   3.582  11.301  -7.141
  732   3HG2  ILE  98          3HG2      ILE  98   2.468   9.924  -6.959
  733   1HD1  ILE  98          1HD1      ILE  98   6.524   7.654  -5.717
  734   2HD1  ILE  98          2HD1      ILE  98   6.186   9.011  -4.616
  735   3HD1  ILE  98          3HD1      ILE  98   5.688   7.360  -4.174
  736    H    ARG  99           H        ARG  99   2.501   9.621  -9.361
  737    HA   ARG  99           HA       ARG  99   3.957  11.678 -10.816
  738   1HB   ARG  99          1HB       ARG  99   2.490  11.220 -12.788
  739   2HB   ARG  99          2HB       ARG  99   3.443   9.814 -12.357
  740   1HG   ARG  99          1HG       ARG  99   1.515   8.628 -12.232
  741   2HG   ARG  99          2HG       ARG  99   1.098   9.555 -10.804
  742   1HD   ARG  99          1HD       ARG  99  -0.585  10.597 -11.918
  743   2HD   ARG  99          2HD       ARG  99   0.534  11.184 -13.133
  744    HE   ARG  99           HE       ARG  99  -0.063   8.378 -13.553
  745   1HH1  ARG  99          2HH2      ARG  99  -1.369  11.613 -14.006
  746   2HH1  ARG  99          1HH2      ARG  99  -2.376  11.159 -15.340
  747   1HH2  ARG  99          2HH1      ARG  99  -1.390   7.777 -15.313
  748   2HH2  ARG  99          1HH1      ARG  99  -2.388   8.962 -16.089
  749    H    ASN 100           H        ASN 100   3.073  13.716 -10.554
  750    HA   ASN 100           HA       ASN 100   0.490  13.811  -9.252
  751   1HB   ASN 100          1HB       ASN 100   1.098  16.102  -8.626
  752   2HB   ASN 100          2HB       ASN 100   2.468  15.065  -8.278
  753   1HD2  ASN 100          1HD2      ASN 100   4.349  15.267  -9.378
  754   2HD2  ASN 100          2HD2      ASN 100   4.693  16.520 -10.524
  755    HA   PRO 101           HA       PRO 101  -1.228  15.342 -12.996
  756   1HB   PRO 101          1HB       PRO 101  -3.607  16.317 -12.068
  757   2HB   PRO 101          2HB       PRO 101  -3.336  14.621 -12.413
  758   1HG   PRO 101          1HG       PRO 101  -3.487  15.977  -9.791
  759   2HG   PRO 101          2HG       PRO 101  -3.644  14.269 -10.155
  760   1HD   PRO 101          1HD       PRO 101  -1.355  15.581  -9.028
  761   2HD   PRO 101          2HD       PRO 101  -1.472  13.897  -9.500
  Start of MODEL   11
    1    H    MET   1           H        MET   1 -19.699   6.293  15.937
    2    HA   MET   1           HA       MET   1 -20.526   6.854  18.161
    3   1HB   MET   1          1HB       MET   1 -21.884   4.311  17.625
    4   2HB   MET   1          2HB       MET   1 -20.970   4.180  19.115
    5   1HG   MET   1          1HG       MET   1 -22.051   6.383  19.864
    6   2HG   MET   1          2HG       MET   1 -23.083   6.284  18.451
    7   1HE   MET   1          1HE       MET   1 -24.342   6.136  21.677
    8   2HE   MET   1          2HE       MET   1 -24.893   6.577  20.044
    9   3HE   MET   1          3HE       MET   1 -25.700   5.262  20.930
   10    H    GLN   2           H        GLN   2 -18.222   7.261  18.120
   11    HA   GLN   2           HA       GLN   2 -16.216   6.979  18.918
   12   1HB   GLN   2          1HB       GLN   2 -17.630   5.432  20.644
   13   2HB   GLN   2          2HB       GLN   2 -16.615   4.189  19.941
   14   1HG   GLN   2          1HG       GLN   2 -14.940   4.853  21.316
   15   2HG   GLN   2          2HG       GLN   2 -14.855   6.357  20.420
   16   1HE2  GLN   2          1HE2      GLN   2 -14.101   6.716  22.811
   17   2HE2  GLN   2          2HE2      GLN   2 -15.285   7.411  23.866
   18    H    GLU   3           H        GLU   3 -15.835   6.874  16.501
   19    HA   GLU   3           HA       GLU   3 -14.488   4.370  15.934
   20   1HB   GLU   3          1HB       GLU   3 -16.727   5.602  14.358
   21   2HB   GLU   3          2HB       GLU   3 -15.406   4.899  13.445
   22   1HG   GLU   3          1HG       GLU   3 -16.407   3.230  15.713
   23   2HG   GLU   3          2HG       GLU   3 -17.550   3.469  14.406
   24    H    GLN   4           H        GLN   4 -12.773   4.593  14.267
   25    HA   GLN   4           HA       GLN   4 -11.865   7.361  14.176
   26   1HB   GLN   4          1HB       GLN   4 -10.519   4.789  14.703
   27   2HB   GLN   4          2HB       GLN   4  -9.678   5.753  13.505
   28   1HG   GLN   4          1HG       GLN   4  -8.813   6.386  15.681
   29   2HG   GLN   4          2HG       GLN   4  -9.776   7.727  15.091
   30   1HE2  GLN   4          1HE2      GLN   4 -10.036   4.731  16.988
   31   2HE2  GLN   4          2HE2      GLN   4 -11.161   5.312  18.170
   32    H    ALA   5           H        ALA   5 -12.418   8.271  12.233
   33    HA   ALA   5           HA       ALA   5 -13.040   6.868   9.941
   34   1HB   ALA   5          1HB       ALA   5 -13.253   9.425  10.742
   35   2HB   ALA   5          2HB       ALA   5 -11.817   9.590   9.704
   36   3HB   ALA   5          3HB       ALA   5 -13.336   8.957   9.027
   37    H    GLN   6           H        GLN   6 -11.752   5.460   8.859
   38    HA   GLN   6           HA       GLN   6  -9.003   6.339   8.434
   39   1HB   GLN   6          1HB       GLN   6  -8.347   3.912   8.469
   40   2HB   GLN   6          2HB       GLN   6  -8.930   4.499  10.014
   41   1HG   GLN   6          1HG       GLN   6 -11.099   3.448   8.293
   42   2HG   GLN   6          2HG       GLN   6  -9.880   2.244   8.661
   43   1HE2  GLN   6          1HE2      GLN   6  -9.068   2.470  11.057
   44   2HE2  GLN   6          2HE2      GLN   6 -10.315   2.481  12.260
   45    H    GLN   7           H        GLN   7 -11.049   7.079   6.680
   46    HA   GLN   7           HA       GLN   7 -10.540   5.258   4.457
   47   1HB   GLN   7          1HB       GLN   7 -12.756   5.822   3.553
   48   2HB   GLN   7          2HB       GLN   7 -12.913   5.163   5.169
   49   1HG   GLN   7          1HG       GLN   7 -12.654   7.853   5.736
   50   2HG   GLN   7          2HG       GLN   7 -13.468   7.924   4.186
   51   1HE2  GLN   7          1HE2      GLN   7 -15.051   8.913   5.767
   52   2HE2  GLN   7          2HE2      GLN   7 -16.253   7.870   6.450
   53    H    PHE   8           H        PHE   8  -8.963   6.257   3.256
   54    HA   PHE   8           HA       PHE   8  -9.378   9.114   2.713
   55   1HB   PHE   8          1HB       PHE   8  -6.748   7.541   2.623
   56   2HB   PHE   8          2HB       PHE   8  -6.931   9.282   2.700
   57    HD1  PHE   8           1HD      PHE   8  -7.691   6.219   4.689
   58    HD2  PHE   8           2HD      PHE   8  -6.710  10.347   4.745
   59    HE1  PHE   8           1HE      PHE   8  -7.469   6.132   7.187
   60    HE2  PHE   8           2HE      PHE   8  -6.489  10.261   7.243
   61    HZ   PHE   8           HZ       PHE   8  -6.871   8.154   8.435
   62    H    ILE   9           H        ILE   9  -8.524   9.852   0.569
   63    HA   ILE   9           HA       ILE   9  -9.226   7.888  -1.430
   64    HB   ILE   9           HB       ILE   9  -8.497  10.807  -1.695
   65   1HG1  ILE   9          1HG1      ILE   9 -10.505  10.286  -0.240
   66   2HG1  ILE   9          2HG1      ILE   9 -10.788  11.342  -1.609
   67   1HG2  ILE   9          1HG2      ILE   9 -10.179  10.019  -3.786
   68   2HG2  ILE   9          2HG2      ILE   9  -8.441  10.395  -3.877
   69   3HG2  ILE   9          3HG2      ILE   9  -8.977   8.714  -3.639
   70   1HD1  ILE   9          1HD1      ILE   9 -11.154   8.657  -2.549
   71   2HD1  ILE   9          2HD1      ILE   9 -12.036   8.811  -1.011
   72   3HD1  ILE   9          3HD1      ILE   9 -12.387   9.927  -2.353
   73    H    PHE  10           H        PHE  10  -7.755   6.546  -2.308
   74    HA   PHE  10           HA       PHE  10  -5.174   7.603  -3.018
   75   1HB   PHE  10          1HB       PHE  10  -5.214   6.693  -0.537
   76   2HB   PHE  10          2HB       PHE  10  -5.441   5.109  -1.250
   77    HD1  PHE  10           1HD      PHE  10  -3.547   3.828  -1.457
   78    HD2  PHE  10           2HD      PHE  10  -3.175   8.045  -1.743
   79    HE1  PHE  10           1HE      PHE  10  -1.062   3.591  -1.722
   80    HE2  PHE  10           2HE      PHE  10  -0.690   7.808  -2.008
   81    HZ   PHE  10           HZ       PHE  10   0.336   5.584  -1.994
   82    H    LYS  11           H        LYS  11  -5.033   6.973  -5.118
   83    HA   LYS  11           HA       LYS  11  -6.120   4.332  -5.785
   84   1HB   LYS  11          1HB       LYS  11  -5.661   6.785  -7.508
   85   2HB   LYS  11          2HB       LYS  11  -6.176   5.227  -8.121
   86   1HG   LYS  11          1HG       LYS  11  -7.691   6.667  -5.904
   87   2HG   LYS  11          2HG       LYS  11  -8.033   6.955  -7.598
   88   1HD   LYS  11          1HD       LYS  11  -8.725   4.682  -7.964
   89   2HD   LYS  11          2HD       LYS  11  -8.004   4.132  -6.464
   90   1HE   LYS  11          1HE       LYS  11  -9.814   4.775  -5.204
   91   2HE   LYS  11          2HE       LYS  11 -10.018   6.279  -6.079
   92   1HZ   LYS  11          1HZ       LYS  11 -11.122   3.671  -6.661
   93   2HZ   LYS  11          2HZ       LYS  11 -11.809   5.147  -6.798
   94   3HZ   LYS  11          3HZ       LYS  11 -10.763   4.623  -7.938
   95    H    VAL  12           H        VAL  12  -4.667   2.729  -6.018
   96    HA   VAL  12           HA       VAL  12  -1.958   3.522  -6.839
   97    HB   VAL  12           HB       VAL  12  -2.587   2.488  -4.466
   98   1HG1  VAL  12          1HG1      VAL  12  -2.441   0.129  -4.337
   99   2HG1  VAL  12          2HG1      VAL  12  -3.603   0.460  -5.644
  100   3HG1  VAL  12          3HG1      VAL  12  -1.934  -0.016  -6.037
  101   1HG2  VAL  12          1HG2      VAL  12  -0.364   3.189  -5.023
  102   2HG2  VAL  12          2HG2      VAL  12  -0.260   1.522  -4.409
  103   3HG2  VAL  12          3HG2      VAL  12  -0.156   1.835  -6.159
  104    H    THR  13           H        THR  13  -1.047   2.484  -8.596
  105    HA   THR  13           HA       THR  13  -2.762   1.266 -10.435
  106    HB   THR  13           HB       THR  13  -0.606   0.847 -11.648
  107    HG1  THR  13           1HG      THR  13   1.172   0.656 -10.338
  108   1HG2  THR  13          1HG2      THR  13  -0.833   3.104 -12.064
  109   2HG2  THR  13          2HG2      THR  13  -1.267   3.456 -10.374
  110   3HG2  THR  13          3HG2      THR  13   0.444   3.290 -10.837
  111    H    ASP  14           H        ASP  14  -2.193  -0.967 -11.468
  112    HA   ASP  14           HA       ASP  14  -2.791  -2.833  -9.442
  113   1HB   ASP  14          1HB       ASP  14  -2.847  -2.678 -12.336
  114   2HB   ASP  14          2HB       ASP  14  -2.013  -4.150 -11.881
  115    H    LYS  15           H        LYS  15   0.080  -1.711 -11.197
  116    HA   LYS  15           HA       LYS  15   1.696  -3.980 -10.807
  117   1HB   LYS  15          1HB       LYS  15   1.877  -1.593 -12.191
  118   2HB   LYS  15          2HB       LYS  15   3.078  -1.392 -10.931
  119   1HG   LYS  15          1HG       LYS  15   4.018  -3.673 -11.539
  120   2HG   LYS  15          2HG       LYS  15   2.885  -3.741 -12.874
  121   1HD   LYS  15          1HD       LYS  15   4.060  -1.234 -13.224
  122   2HD   LYS  15          2HD       LYS  15   5.397  -2.188 -12.612
  123   1HE   LYS  15          1HE       LYS  15   3.638  -3.253 -14.852
  124   2HE   LYS  15          2HE       LYS  15   4.957  -2.154 -15.201
  125   1HZ   LYS  15          1HZ       LYS  15   6.271  -3.899 -15.109
  126   2HZ   LYS  15          2HZ       LYS  15   5.977  -4.049 -13.509
  127   3HZ   LYS  15          3HZ       LYS  15   5.076  -4.882 -14.587
  128    H    ALA  16           H        ALA  16   1.072  -1.000  -8.882
  129    HA   ALA  16           HA       ALA  16   3.037  -1.519  -6.945
  130   1HB   ALA  16          1HB       ALA  16   1.650   0.628  -7.523
  131   2HB   ALA  16          2HB       ALA  16   0.457  -0.050  -6.390
  132   3HB   ALA  16          3HB       ALA  16   2.106   0.318  -5.830
  133    H    VAL  17           H        VAL  17  -0.522  -2.218  -7.081
  134    HA   VAL  17           HA       VAL  17  -0.716  -3.402  -4.591
  135    HB   VAL  17           HB       VAL  17  -2.225  -3.442  -7.149
  136   1HG1  VAL  17          1HG1      VAL  17  -2.502  -5.727  -6.807
  137   2HG1  VAL  17          2HG1      VAL  17  -2.456  -5.573  -5.034
  138   3HG1  VAL  17          3HG1      VAL  17  -3.894  -5.039  -5.937
  139   1HG2  VAL  17          1HG2      VAL  17  -2.574  -2.517  -4.344
  140   2HG2  VAL  17          2HG2      VAL  17  -3.045  -1.746  -5.878
  141   3HG2  VAL  17          3HG2      VAL  17  -4.043  -3.052  -5.195
  142    H    GLU  18           H        GLU  18   0.045  -4.865  -7.818
  143    HA   GLU  18           HA       GLU  18   0.229  -7.455  -6.863
  144   1HB   GLU  18          1HB       GLU  18   1.231  -5.989  -9.298
  145   2HB   GLU  18          2HB       GLU  18   1.845  -7.603  -8.996
  146   1HG   GLU  18          1HG       GLU  18  -0.398  -8.552  -9.013
  147   2HG   GLU  18          2HG       GLU  18  -1.137  -6.963  -9.003
  148    H    GLU  19           H        GLU  19   2.630  -4.790  -7.103
  149    HA   GLU  19           HA       GLU  19   4.895  -6.231  -6.620
  150   1HB   GLU  19          1HB       GLU  19   5.172  -3.961  -7.225
  151   2HB   GLU  19          2HB       GLU  19   4.061  -3.390  -5.996
  152   1HG   GLU  19          1HG       GLU  19   6.323  -2.862  -5.268
  153   2HG   GLU  19          2HG       GLU  19   5.696  -4.118  -4.219
  154    H    ILE  20           H        ILE  20   2.275  -5.288  -4.424
  155    HA   ILE  20           HA       ILE  20   3.711  -5.668  -2.025
  156    HB   ILE  20           HB       ILE  20   0.736  -5.915  -2.441
  157   1HG1  ILE  20          1HG1      ILE  20   1.062  -3.896  -3.490
  158   2HG1  ILE  20          2HG1      ILE  20   0.861  -3.380  -1.828
  159   1HG2  ILE  20          1HG2      ILE  20   0.921  -6.376  -0.245
  160   2HG2  ILE  20          2HG2      ILE  20   2.541  -5.651  -0.114
  161   3HG2  ILE  20          3HG2      ILE  20   1.096  -4.611  -0.095
  162   1HD1  ILE  20          1HD1      ILE  20   3.369  -3.488  -3.496
  163   2HD1  ILE  20          2HD1      ILE  20   2.796  -2.211  -2.397
  164   3HD1  ILE  20          3HD1      ILE  20   3.513  -3.699  -1.735
  165    H    LYS  21           H        LYS  21   1.892  -7.803  -4.244
  166    HA   LYS  21           HA       LYS  21   1.920 -10.006  -2.439
  167   1HB   LYS  21          1HB       LYS  21   1.387  -9.870  -5.422
  168   2HB   LYS  21          2HB       LYS  21   1.103 -11.268  -4.406
  169   1HG   LYS  21          1HG       LYS  21  -0.798 -10.376  -3.476
  170   2HG   LYS  21          2HG       LYS  21  -0.106  -8.771  -3.347
  171   1HD   LYS  21          1HD       LYS  21  -1.054  -8.093  -5.303
  172   2HD   LYS  21          2HD       LYS  21  -0.501  -9.519  -6.158
  173   1HE   LYS  21          1HE       LYS  21  -2.643 -10.193  -4.263
  174   2HE   LYS  21          2HE       LYS  21  -3.158  -8.939  -5.375
  175   1HZ   LYS  21          1HZ       LYS  21  -3.502 -10.639  -6.736
  176   2HZ   LYS  21          2HZ       LYS  21  -1.888 -10.651  -6.984
  177   3HZ   LYS  21          3HZ       LYS  21  -2.555 -11.675  -5.901
  178    H    LYS  22           H        LYS  22   4.138  -8.589  -4.787
  179    HA   LYS  22           HA       LYS  22   5.675 -10.913  -5.227
  180   1HB   LYS  22          1HB       LYS  22   5.628  -8.190  -6.094
  181   2HB   LYS  22          2HB       LYS  22   7.246  -8.540  -5.521
  182   1HG   LYS  22          1HG       LYS  22   6.932 -10.794  -6.915
  183   2HG   LYS  22          2HG       LYS  22   5.697  -9.874  -7.751
  184   1HD   LYS  22          1HD       LYS  22   7.393  -9.080  -9.049
  185   2HD   LYS  22          2HD       LYS  22   7.791  -8.053  -7.686
  186   1HE   LYS  22          1HE       LYS  22   9.347  -9.801  -6.812
  187   2HE   LYS  22          2HE       LYS  22   8.935 -10.850  -8.154
  188   1HZ   LYS  22          1HZ       LYS  22  10.879  -9.726  -8.739
  189   2HZ   LYS  22          2HZ       LYS  22   9.706  -8.997  -9.610
  190   3HZ   LYS  22          3HZ       LYS  22  10.311  -8.265  -8.281
  191    H    VAL  23           H        VAL  23   5.514  -8.471  -2.659
  192    HA   VAL  23           HA       VAL  23   8.009  -9.419  -1.520
  193    HB   VAL  23           HB       VAL  23   6.117  -7.154  -1.063
  194   1HG1  VAL  23          1HG1      VAL  23   7.865  -8.420   1.034
  195   2HG1  VAL  23          2HG1      VAL  23   7.616  -6.658   1.024
  196   3HG1  VAL  23          3HG1      VAL  23   6.221  -7.753   1.177
  197   1HG2  VAL  23          1HG2      VAL  23   7.780  -6.229  -2.258
  198   2HG2  VAL  23          2HG2      VAL  23   8.704  -6.260  -0.737
  199   3HG2  VAL  23          3HG2      VAL  23   8.897  -7.574  -1.922
  200    H    ALA  24           H        ALA  24   4.479  -9.697  -1.141
  201    HA   ALA  24           HA       ALA  24   4.644 -10.916   1.434
  202   1HB   ALA  24          1HB       ALA  24   2.255 -11.387  -0.260
  203   2HB   ALA  24          2HB       ALA  24   2.379 -10.716   1.384
  204   3HB   ALA  24          3HB       ALA  24   2.686  -9.675  -0.027
  205    H    GLN  25           H        GLN  25   4.352 -12.019  -1.988
  206    HA   GLN  25           HA       GLN  25   3.882 -14.660  -1.487
  207   1HB   GLN  25          1HB       GLN  25   4.675 -15.066  -3.751
  208   2HB   GLN  25          2HB       GLN  25   3.815 -13.539  -3.727
  209   1HG   GLN  25          1HG       GLN  25   5.897 -12.271  -3.697
  210   2HG   GLN  25          2HG       GLN  25   6.845 -13.719  -3.420
  211   1HE2  GLN  25          1HE2      GLN  25   7.836 -12.533  -5.372
  212   2HE2  GLN  25          2HE2      GLN  25   7.355 -13.096  -6.938
  213    H    GLU  26           H        GLU  26   6.793 -12.758  -0.990
  214    HA   GLU  26           HA       GLU  26   8.428 -15.126  -0.863
  215   1HB   GLU  26          1HB       GLU  26   8.875 -12.315  -1.329
  216   2HB   GLU  26          2HB       GLU  26   9.824 -12.788   0.066
  217   1HG   GLU  26          1HG       GLU  26   9.941 -14.786  -2.111
  218   2HG   GLU  26          2HG       GLU  26  10.519 -13.210  -2.616
  219    H    ASN  27           H        ASN  27   6.197 -13.668   1.128
  220    HA   ASN  27           HA       ASN  27   7.707 -14.481   3.486
  221   1HB   ASN  27          1HB       ASN  27   5.806 -12.142   3.053
  222   2HB   ASN  27          2HB       ASN  27   6.032 -12.797   4.663
  223   1HD2  ASN  27          1HD2      ASN  27   7.283 -10.840   2.176
  224   2HD2  ASN  27          2HD2      ASN  27   8.787 -10.379   2.901
  225    H    ASN  28           H        ASN  28   5.325 -15.336   1.362
  226    HA   ASN  28           HA       ASN  28   3.546 -16.575   1.391
  227   1HB   ASN  28          1HB       ASN  28   5.223 -17.924   2.952
  228   2HB   ASN  28          2HB       ASN  28   4.125 -17.469   4.240
  229   1HD2  ASN  28          1HD2      ASN  28   3.327 -19.449   4.676
  230   2HD2  ASN  28          2HD2      ASN  28   2.339 -20.382   3.603
  231    H    ILE  29           H        ILE  29   3.214 -13.844   2.289
  232    HA   ILE  29           HA       ILE  29   1.314 -14.069   4.500
  233    HB   ILE  29           HB       ILE  29   2.775 -11.742   3.262
  234   1HG1  ILE  29          1HG1      ILE  29   2.840 -12.956   6.040
  235   2HG1  ILE  29          2HG1      ILE  29   4.071 -13.144   4.808
  236   1HG2  ILE  29          1HG2      ILE  29   0.442 -11.764   5.168
  237   2HG2  ILE  29          2HG2      ILE  29   1.636 -10.444   5.168
  238   3HG2  ILE  29          3HG2      ILE  29   0.691 -10.789   3.700
  239   1HD1  ILE  29          1HD1      ILE  29   3.562 -10.870   6.613
  240   2HD1  ILE  29          2HD1      ILE  29   5.039 -11.296   5.716
  241   3HD1  ILE  29          3HD1      ILE  29   3.745 -10.373   4.914
  242    H    GLU  30           H        GLU  30  -0.850 -13.983   4.157
  243    HA   GLU  30           HA       GLU  30  -1.654 -13.488   1.416
  244   1HB   GLU  30          1HB       GLU  30  -2.439 -15.377   3.428
  245   2HB   GLU  30          2HB       GLU  30  -3.835 -14.371   3.096
  246   1HG   GLU  30          1HG       GLU  30  -3.908 -14.981   0.811
  247   2HG   GLU  30          2HG       GLU  30  -2.220 -15.448   0.773
  248    H    ASN  31           H        ASN  31  -1.063 -11.588   3.950
  249    HA   ASN  31           HA       ASN  31  -3.185  -9.797   3.214
  250   1HB   ASN  31          1HB       ASN  31  -3.348  -9.287   5.844
  251   2HB   ASN  31          2HB       ASN  31  -4.341 -10.534   5.114
  252   1HD2  ASN  31          1HD2      ASN  31  -2.038  -9.790   7.445
  253   2HD2  ASN  31          2HD2      ASN  31  -1.601 -11.384   7.964
  254    HA   PRO  32           HA       PRO  32   0.988  -8.034   4.022
  255   1HB   PRO  32          1HB       PRO  32   1.513  -7.063   1.522
  256   2HB   PRO  32          2HB       PRO  32   2.075  -8.626   2.081
  257   1HG   PRO  32          1HG       PRO  32  -0.130  -8.009   0.211
  258   2HG   PRO  32          2HG       PRO  32   0.713  -9.526   0.451
  259   1HD   PRO  32          1HD       PRO  32  -1.901  -8.846   1.414
  260   2HD   PRO  32          2HD       PRO  32  -1.010 -10.317   1.751
  261    H    ILE  33           H        ILE  33   0.798  -6.301   5.284
  262    HA   ILE  33           HA       ILE  33  -0.949  -4.210   4.218
  263    HB   ILE  33           HB       ILE  33  -0.003  -4.895   6.995
  264   1HG1  ILE  33          1HG1      ILE  33  -2.786  -4.714   5.803
  265   2HG1  ILE  33          2HG1      ILE  33  -1.888  -6.202   6.029
  266   1HG2  ILE  33          1HG2      ILE  33  -0.598  -2.295   5.965
  267   2HG2  ILE  33          2HG2      ILE  33  -1.902  -2.786   7.073
  268   3HG2  ILE  33          3HG2      ILE  33  -0.212  -2.784   7.632
  269   1HD1  ILE  33          1HD1      ILE  33  -3.457  -5.804   7.911
  270   2HD1  ILE  33          2HD1      ILE  33  -1.769  -5.787   8.476
  271   3HD1  ILE  33          3HD1      ILE  33  -2.650  -4.256   8.257
  272    H    LEU  34           H        LEU  34   0.304  -3.016   2.812
  273    HA   LEU  34           HA       LEU  34   2.970  -2.264   3.692
  274   1HB   LEU  34          1HB       LEU  34   1.477  -1.982   1.088
  275   2HB   LEU  34          2HB       LEU  34   3.037  -1.238   1.377
  276    HG   LEU  34           HG       LEU  34   2.791  -3.596   0.192
  277   1HD1  LEU  34          1HD1      LEU  34   5.043  -3.775   0.376
  278   2HD1  LEU  34          2HD1      LEU  34   4.862  -2.142   1.060
  279   3HD1  LEU  34          3HD1      LEU  34   5.036  -3.545   2.141
  280   1HD2  LEU  34          1HD2      LEU  34   3.276  -5.424   1.844
  281   2HD2  LEU  34          2HD2      LEU  34   2.803  -4.295   3.137
  282   3HD2  LEU  34          3HD2      LEU  34   1.619  -4.778   1.898
  283    H    ARG  35           H        ARG  35   3.576  -0.193   4.284
  284    HA   ARG  35           HA       ARG  35   1.354   1.686   4.410
  285   1HB   ARG  35          1HB       ARG  35   2.198   2.513   6.503
  286   2HB   ARG  35          2HB       ARG  35   2.284   0.768   6.634
  287   1HG   ARG  35          1HG       ARG  35   4.748   1.259   5.551
  288   2HG   ARG  35          2HG       ARG  35   4.503   2.769   6.405
  289   1HD   ARG  35          1HD       ARG  35   3.668   0.692   8.194
  290   2HD   ARG  35          2HD       ARG  35   5.181   0.156   7.491
  291    HE   ARG  35           HE       ARG  35   4.881   2.252   9.422
  292   1HH1  ARG  35          2HH2      ARG  35   6.677   1.517   6.487
  293   2HH1  ARG  35          1HH2      ARG  35   8.019   2.530   6.902
  294   1HH2  ARG  35          2HH1      ARG  35   6.652   3.588   9.971
  295   2HH2  ARG  35          1HH1      ARG  35   8.005   3.716   8.897
  296    H    ILE  36           H        ILE  36   1.764   3.861   3.754
  297    HA   ILE  36           HA       ILE  36   4.189   4.165   2.189
  298    HB   ILE  36           HB       ILE  36   1.521   5.497   2.316
  299   1HG1  ILE  36          1HG1      ILE  36   1.790   3.641   0.793
  300   2HG1  ILE  36          2HG1      ILE  36   1.613   5.128  -0.118
  301   1HG2  ILE  36          1HG2      ILE  36   4.086   6.788   1.432
  302   2HG2  ILE  36          2HG2      ILE  36   2.551   7.172   0.617
  303   3HG2  ILE  36          3HG2      ILE  36   2.731   7.469   2.363
  304   1HD1  ILE  36          1HD1      ILE  36   4.310   5.118   0.070
  305   2HD1  ILE  36          2HD1      ILE  36   4.020   3.366   0.202
  306   3HD1  ILE  36          3HD1      ILE  36   3.446   4.258  -1.228
  307    H    ARG  37           H        ARG  37   5.809   5.673   2.594
  308    HA   ARG  37           HA       ARG  37   5.411   7.421   4.843
  309   1HB   ARG  37          1HB       ARG  37   6.459   5.177   5.630
  310   2HB   ARG  37          2HB       ARG  37   7.884   5.635   4.719
  311   1HG   ARG  37          1HG       ARG  37   7.020   7.881   6.362
  312   2HG   ARG  37          2HG       ARG  37   7.170   6.450   7.363
  313   1HD   ARG  37          1HD       ARG  37   9.480   6.138   6.776
  314   2HD   ARG  37          2HD       ARG  37   9.364   7.211   5.395
  315    HE   ARG  37           HE       ARG  37   9.654   9.054   6.817
  316   1HH1  ARG  37          2HH2      ARG  37   8.860   6.212   8.735
  317   2HH1  ARG  37          1HH2      ARG  37   9.175   6.989  10.250
  318   1HH2  ARG  37          2HH1      ARG  37  10.070  10.080   8.816
  319   2HH2  ARG  37          1HH1      ARG  37   9.868   9.204  10.297
  320    H    VAL  38           H        VAL  38   6.809   9.297   4.763
  321    HA   VAL  38           HA       VAL  38   7.893   9.769   2.139
  322    HB   VAL  38           HB       VAL  38   7.842  11.555   4.577
  323   1HG1  VAL  38          1HG1      VAL  38   9.214  12.701   3.158
  324   2HG1  VAL  38          2HG1      VAL  38   8.544  11.928   1.701
  325   3HG1  VAL  38          3HG1      VAL  38   7.649  13.240   2.505
  326   1HG2  VAL  38          1HG2      VAL  38   5.678  10.661   2.796
  327   2HG2  VAL  38          2HG2      VAL  38   5.604  11.446   4.392
  328   3HG2  VAL  38          3HG2      VAL  38   5.819  12.431   2.925
  329    H    VAL  39           H        VAL  39   9.921   9.172   1.594
  330    HA   VAL  39           HA       VAL  39  11.968   9.407   3.681
  331    HB   VAL  39           HB       VAL  39  11.324   7.069   3.466
  332   1HG1  VAL  39          1HG1      VAL  39  10.634   7.446   0.963
  333   2HG1  VAL  39          2HG1      VAL  39  12.322   6.988   0.631
  334   3HG1  VAL  39          3HG1      VAL  39  11.247   5.860   1.491
  335   1HG2  VAL  39          1HG2      VAL  39  13.986   8.120   2.925
  336   2HG2  VAL  39          2HG2      VAL  39  13.480   6.783   3.985
  337   3HG2  VAL  39          3HG2      VAL  39  13.772   6.485   2.255
  338    HA   PRO  40           HA       PRO  40  13.189  11.755   0.061
  339   1HB   PRO  40          1HB       PRO  40  14.120  13.950   1.396
  340   2HB   PRO  40          2HB       PRO  40  12.478  13.817   0.800
  341   1HG   PRO  40          1HG       PRO  40  13.466  13.584   3.576
  342   2HG   PRO  40          2HG       PRO  40  11.833  13.877   3.013
  343   1HD   PRO  40          1HD       PRO  40  12.887  11.403   4.011
  344   2HD   PRO  40          2HD       PRO  40  11.289  11.667   3.340
  345    H    GLY  41           H        GLY  41  14.663   9.948  -0.216
  346   1HA   GLY  41          1HA       GLY  41  16.921   9.421   1.100
  347   2HA   GLY  41          2HA       GLY  41  16.832   9.425  -0.651
  348    H    GLY  42           H        GLY  42  16.261  12.388  -0.783
  349   1HA   GLY  42          1HA       GLY  42  18.185  13.929   0.483
  350   2HA   GLY  42          2HA       GLY  42  18.951  13.278  -0.953
  351    H    CYS  43           H        CYS  43  19.074  15.472  -1.827
  352    HA   CYS  43           HA       CYS  43  16.729  16.985  -2.216
  353   1HB   CYS  43          1HB       CYS  43  18.194  18.337  -3.755
  354   2HB   CYS  43          2HB       CYS  43  18.795  18.162  -2.118
  355    HG   CYS  43           HG       CYS  43  19.709  16.753  -4.941
  356    H    SER  44           H        SER  44  18.012  14.134  -3.656
  357    HA   SER  44           HA       SER  44  17.366  14.531  -6.311
  358   1HB   SER  44          1HB       SER  44  17.853  12.187  -4.519
  359   2HB   SER  44          2HB       SER  44  16.983  11.839  -6.000
  360    HG   SER  44           HG       SER  44  19.216  11.632  -6.414
  361    H    GLY  45           H        GLY  45  15.355  14.353  -3.529
  362   1HA   GLY  45          1HA       GLY  45  13.059  14.856  -3.703
  363   2HA   GLY  45          2HA       GLY  45  12.985  14.023  -5.242
  364    H    PHE  46           H        PHE  46  13.696  11.557  -5.100
  365    HA   PHE  46           HA       PHE  46  13.190   9.538  -4.378
  366   1HB   PHE  46          1HB       PHE  46  13.827  11.141  -1.887
  367   2HB   PHE  46          2HB       PHE  46  13.091   9.572  -1.623
  368    HD1  PHE  46           1HD      PHE  46  14.458   7.713  -1.464
  369    HD2  PHE  46           2HD      PHE  46  15.903  11.137  -3.512
  370    HE1  PHE  46           1HE      PHE  46  16.703   6.618  -1.711
  371    HE2  PHE  46           2HE      PHE  46  18.148  10.043  -3.759
  372    HZ   PHE  46           HZ       PHE  46  18.521   7.796  -2.855
  373    H    GLN  47           H        GLN  47  11.270   8.452  -4.419
  374    HA   GLN  47           HA       GLN  47   8.959   9.931  -3.542
  375   1HB   GLN  47          1HB       GLN  47   9.053   7.236  -4.961
  376   2HB   GLN  47          2HB       GLN  47   7.669   8.302  -4.818
  377   1HG   GLN  47          1HG       GLN  47  10.171   9.437  -6.056
  378   2HG   GLN  47          2HG       GLN  47   9.249   8.289  -7.008
  379   1HE2  GLN  47          1HE2      GLN  47   8.506   9.692  -8.507
  380   2HE2  GLN  47          2HE2      GLN  47   7.373  10.965  -8.198
  381    H    TYR  48           H        TYR  48   7.106   8.167  -2.715
  382    HA   TYR  48           HA       TYR  48   8.118   7.359  -0.161
  383   1HB   TYR  48          1HB       TYR  48   5.427   6.772  -1.527
  384   2HB   TYR  48          2HB       TYR  48   5.709   6.920   0.196
  385    HD1  TYR  48           1HD      TYR  48   4.903   8.676  -2.859
  386    HD2  TYR  48           2HD      TYR  48   6.251   9.200   1.167
  387    HE1  TYR  48           1HE      TYR  48   4.266  11.135  -2.958
  388    HE2  TYR  48           2HE      TYR  48   5.609  11.657   1.055
  389    HH   TYR  48           HH       TYR  48   3.708  12.949  -0.532
  390    H    ALA  49           H        ALA  49   9.083   5.440   0.257
  391    HA   ALA  49           HA       ALA  49   8.811   3.300  -1.658
  392   1HB   ALA  49          1HB       ALA  49  10.433   2.212   0.044
  393   2HB   ALA  49          2HB       ALA  49  11.012   3.632  -0.860
  394   3HB   ALA  49          3HB       ALA  49  10.469   3.810   0.826
  395    H    MET  50           H        MET  50   8.263   1.057  -0.930
  396    HA   MET  50           HA       MET  50   6.006   1.237   0.874
  397   1HB   MET  50          1HB       MET  50   6.578  -0.133  -1.583
  398   2HB   MET  50          2HB       MET  50   6.442  -1.386  -0.367
  399   1HG   MET  50          1HG       MET  50   4.198  -1.169  -0.977
  400   2HG   MET  50          2HG       MET  50   4.257  -0.040   0.362
  401   1HE   MET  50          1HE       MET  50   3.273   0.759  -3.919
  402   2HE   MET  50          2HE       MET  50   3.891  -0.754  -3.214
  403   3HE   MET  50          3HE       MET  50   2.328  -0.094  -2.675
  404    H    GLY  51           H        GLY  51   5.613  -0.829   2.280
  405   1HA   GLY  51          1HA       GLY  51   7.728  -2.486   3.057
  406   2HA   GLY  51          2HA       GLY  51   7.747  -1.076   4.098
  407    H    PHE  52           H        PHE  52   6.532  -4.184   3.784
  408    HA   PHE  52           HA       PHE  52   3.898  -3.824   4.735
  409   1HB   PHE  52          1HB       PHE  52   4.201  -6.326   5.193
  410   2HB   PHE  52          2HB       PHE  52   4.652  -5.865   3.563
  411    HD1  PHE  52           1HD      PHE  52   6.895  -6.097   2.793
  412    HD2  PHE  52           2HD      PHE  52   5.978  -6.782   6.879
  413    HE1  PHE  52           1HE      PHE  52   9.164  -7.116   3.132
  414    HE2  PHE  52           2HE      PHE  52   8.247  -7.801   7.218
  415    HZ   PHE  52           HZ       PHE  52   9.813  -7.956   5.340
  416    H    ASP  53           H        ASP  53   3.123  -3.525   6.783
  417    HA   ASP  53           HA       ASP  53   5.106  -3.348   8.860
  418   1HB   ASP  53          1HB       ASP  53   2.832  -1.876   8.229
  419   2HB   ASP  53          2HB       ASP  53   2.250  -2.880   9.541
  420    H    ASP  54           H        ASP  54   4.047  -4.112  11.177
  421    HA   ASP  54           HA       ASP  54   3.303  -6.871  10.710
  422   1HB   ASP  54          1HB       ASP  54   4.487  -5.341  13.049
  423   2HB   ASP  54          2HB       ASP  54   3.752  -6.909  13.316
  424    H    THR  55           H        THR  55   1.951  -3.819  11.411
  425    HA   THR  55           HA       THR  55  -0.588  -4.916  12.044
  426    HB   THR  55           HB       THR  55   1.145  -3.733  14.249
  427    HG1  THR  55           1HG      THR  55   0.938  -5.934  14.526
  428   1HG2  THR  55          1HG2      THR  55  -0.920  -3.565  15.631
  429   2HG2  THR  55          2HG2      THR  55  -1.006  -2.435  14.259
  430   3HG2  THR  55          3HG2      THR  55  -1.911  -3.967  14.209
  431    H    VAL  56           H        VAL  56  -2.210  -3.087  12.495
  432    HA   VAL  56           HA       VAL  56  -1.487  -0.938  10.664
  433    HB   VAL  56           HB       VAL  56  -3.887  -2.438  11.362
  434   1HG1  VAL  56          1HG1      VAL  56  -4.534  -0.408  12.533
  435   2HG1  VAL  56          2HG1      VAL  56  -4.105   0.581  11.116
  436   3HG1  VAL  56          3HG1      VAL  56  -5.470  -0.558  11.026
  437   1HG2  VAL  56          1HG2      VAL  56  -3.750  -0.609   9.010
  438   2HG2  VAL  56          2HG2      VAL  56  -2.554  -1.925   9.093
  439   3HG2  VAL  56          3HG2      VAL  56  -4.294  -2.300   9.121
  440    H    GLU  57           H        GLU  57  -2.055   1.313  11.208
  441    HA   GLU  57           HA       GLU  57  -1.377   1.799  13.948
  442   1HB   GLU  57          1HB       GLU  57  -1.989   3.924  11.869
  443   2HB   GLU  57          2HB       GLU  57  -0.942   4.047  13.269
  444   1HG   GLU  57          1HG       GLU  57   0.595   2.333  12.229
  445   2HG   GLU  57          2HG       GLU  57  -0.431   2.309  10.809
  446    H    GLU  58           H        GLU  58  -2.614   3.794  15.016
  447    HA   GLU  58           HA       GLU  58  -5.356   2.965  15.066
  448   1HB   GLU  58          1HB       GLU  58  -3.584   3.846  16.998
  449   2HB   GLU  58          2HB       GLU  58  -4.538   5.290  16.724
  450   1HG   GLU  58          1HG       GLU  58  -5.802   4.194  18.373
  451   2HG   GLU  58          2HG       GLU  58  -6.615   3.681  16.907
  452    H    GLY  59           H        GLY  59  -4.197   4.409  12.672
  453   1HA   GLY  59          1HA       GLY  59  -6.358   6.015  12.018
  454   2HA   GLY  59          2HA       GLY  59  -5.135   7.086  12.670
  455    H    ASP  60           H        ASP  60  -5.206   4.161  10.498
  456    HA   ASP  60           HA       ASP  60  -3.496   5.701   8.706
  457   1HB   ASP  60          1HB       ASP  60  -2.864   3.315   9.995
  458   2HB   ASP  60          2HB       ASP  60  -3.449   2.741   8.446
  459    H    HIS  61           H        HIS  61  -3.939   5.361   6.382
  460    HA   HIS  61           HA       HIS  61  -6.661   4.968   5.825
  461   1HB   HIS  61          1HB       HIS  61  -5.295   6.497   4.539
  462   2HB   HIS  61          2HB       HIS  61  -4.233   5.200   4.030
  463    HD1  HIS  61           1HD      HIS  61  -7.785   4.203   3.961
  464    HD2  HIS  61           2HD      HIS  61  -5.070   6.052   1.353
  465    HE1  HIS  61           1HE      HIS  61  -8.827   4.074   1.636
  466    H    VAL  62           H        VAL  62  -6.865   2.802   6.922
  467    HA   VAL  62           HA       VAL  62  -5.618   0.572   5.639
  468    HB   VAL  62           HB       VAL  62  -6.396   0.910   8.093
  469   1HG1  VAL  62          1HG1      VAL  62  -8.587   0.351   8.679
  470   2HG1  VAL  62          2HG1      VAL  62  -8.803   1.376   7.239
  471   3HG1  VAL  62          3HG1      VAL  62  -8.927  -0.394   7.098
  472   1HG2  VAL  62          1HG2      VAL  62  -6.205  -1.365   8.426
  473   2HG2  VAL  62          2HG2      VAL  62  -7.193  -1.770   7.001
  474   3HG2  VAL  62          3HG2      VAL  62  -5.517  -1.209   6.792
  475    H    PHE  63           H        PHE  63  -6.163   0.381   3.479
  476    HA   PHE  63           HA       PHE  63  -9.044   0.224   2.933
  477   1HB   PHE  63          1HB       PHE  63  -7.060   1.889   1.863
  478   2HB   PHE  63          2HB       PHE  63  -7.032   0.556   0.725
  479    HD1  PHE  63           1HD      PHE  63  -9.983   1.930   2.518
  480    HD2  PHE  63           2HD      PHE  63  -7.968   1.511  -1.193
  481    HE1  PHE  63           1HE      PHE  63 -11.969   2.902   1.330
  482    HE2  PHE  63           2HE      PHE  63  -9.954   2.483  -2.381
  483    HZ   PHE  63           HZ       PHE  63 -11.931   3.167  -1.105
  484    H    GLU  64           H        GLU  64  -9.825  -1.523   1.681
  485    HA   GLU  64           HA       GLU  64  -8.054  -3.784   1.721
  486   1HB   GLU  64          1HB       GLU  64 -10.971  -3.685   0.847
  487   2HB   GLU  64          2HB       GLU  64 -10.054  -5.111   1.293
  488   1HG   GLU  64          1HG       GLU  64 -10.058  -4.574   3.587
  489   2HG   GLU  64          2HG       GLU  64 -10.270  -2.859   3.296
  490    H    TYR  65           H        TYR  65  -7.316  -4.927  -0.109
  491    HA   TYR  65           HA       TYR  65  -8.038  -3.745  -2.701
  492   1HB   TYR  65          1HB       TYR  65  -5.327  -4.666  -1.558
  493   2HB   TYR  65          2HB       TYR  65  -5.552  -4.182  -3.227
  494    HD1  TYR  65           1HD      TYR  65  -5.830  -2.913   0.276
  495    HD2  TYR  65           2HD      TYR  65  -5.339  -1.923  -3.857
  496    HE1  TYR  65           1HE      TYR  65  -5.347  -0.497   0.904
  497    HE2  TYR  65           2HE      TYR  65  -4.858   0.489  -3.215
  498    HH   TYR  65           HH       TYR  65  -4.821   1.949  -1.611
  499    H    ASP  66           H        ASP  66  -6.301  -5.498  -4.202
  500    HA   ASP  66           HA       ASP  66  -8.009  -7.665  -4.435
  501   1HB   ASP  66          1HB       ASP  66  -6.341  -6.630  -6.144
  502   2HB   ASP  66          2HB       ASP  66  -5.110  -7.603  -5.366
  503    H    GLY  67           H        GLY  67  -7.911  -8.282  -2.004
  504   1HA   GLY  67          1HA       GLY  67  -7.357  -9.851  -0.482
  505   2HA   GLY  67          2HA       GLY  67  -6.281 -10.583  -1.655
  506    H    VAL  68           H        VAL  68  -5.759  -7.171  -1.144
  507    HA   VAL  68           HA       VAL  68  -3.658  -7.754   0.814
  508    HB   VAL  68           HB       VAL  68  -3.369  -6.112  -1.710
  509   1HG1  VAL  68          1HG1      VAL  68  -2.052  -5.038  -0.071
  510   2HG1  VAL  68          2HG1      VAL  68  -1.522  -6.582   0.639
  511   3HG1  VAL  68          3HG1      VAL  68  -0.920  -6.084  -0.961
  512   1HG2  VAL  68          1HG2      VAL  68  -3.368  -8.689  -1.865
  513   2HG2  VAL  68          2HG2      VAL  68  -2.007  -7.804  -2.594
  514   3HG2  VAL  68          3HG2      VAL  68  -1.807  -8.600  -1.015
  515    H    LYS  69           H        LYS  69  -2.871  -5.681   1.891
  516    HA   LYS  69           HA       LYS  69  -5.027  -3.692   1.938
  517   1HB   LYS  69          1HB       LYS  69  -4.143  -5.465   4.081
  518   2HB   LYS  69          2HB       LYS  69  -4.002  -3.778   4.534
  519   1HG   LYS  69          1HG       LYS  69  -6.525  -4.481   3.101
  520   2HG   LYS  69          2HG       LYS  69  -6.339  -5.235   4.671
  521   1HD   LYS  69          1HD       LYS  69  -5.959  -3.025   5.727
  522   2HD   LYS  69          2HD       LYS  69  -6.029  -2.239   4.163
  523   1HE   LYS  69          1HE       LYS  69  -8.216  -1.929   5.030
  524   2HE   LYS  69          2HE       LYS  69  -8.406  -3.280   3.930
  525   1HZ   LYS  69          1HZ       LYS  69  -8.805  -4.658   5.613
  526   2HZ   LYS  69          2HZ       LYS  69  -7.670  -4.017   6.596
  527   3HZ   LYS  69          3HZ       LYS  69  -9.138  -3.313   6.478
  528    H    VAL  70           H        VAL  70  -4.364  -1.533   2.202
  529    HA   VAL  70           HA       VAL  70  -1.467  -1.131   2.367
  530    HB   VAL  70           HB       VAL  70  -3.278   0.306   0.424
  531   1HG1  VAL  70          1HG1      VAL  70  -0.251   0.127   0.488
  532   2HG1  VAL  70          2HG1      VAL  70  -1.261   1.180  -0.531
  533   3HG1  VAL  70          3HG1      VAL  70  -1.182   1.452   1.227
  534   1HG2  VAL  70          1HG2      VAL  70  -1.585  -2.168   0.049
  535   2HG2  VAL  70          2HG2      VAL  70  -3.280  -1.889  -0.417
  536   3HG2  VAL  70          3HG2      VAL  70  -1.968  -1.080  -1.307
  537    H    VAL  71           H        VAL  71  -0.854   0.975   3.217
  538    HA   VAL  71           HA       VAL  71  -3.029   2.571   4.294
  539    HB   VAL  71           HB       VAL  71  -2.313   2.448   6.534
  540   1HG1  VAL  71          1HG1      VAL  71  -2.127  -0.432   5.623
  541   2HG1  VAL  71          2HG1      VAL  71  -2.823   0.215   7.128
  542   3HG1  VAL  71          3HG1      VAL  71  -3.648   0.490   5.575
  543   1HG2  VAL  71          1HG2      VAL  71  -0.360   1.143   7.288
  544   2HG2  VAL  71          2HG2      VAL  71   0.041   0.775   5.593
  545   3HG2  VAL  71          3HG2      VAL  71   0.105   2.455   6.178
  546    H    ILE  72           H        ILE  72  -2.229   4.704   5.088
  547    HA   ILE  72           HA       ILE  72   0.460   5.346   4.171
  548    HB   ILE  72           HB       ILE  72  -1.874   7.041   3.327
  549   1HG1  ILE  72          1HG1      ILE  72  -1.146   5.836   1.013
  550   2HG1  ILE  72          2HG1      ILE  72  -0.903   4.504   2.126
  551   1HG2  ILE  72          1HG2      ILE  72  -0.324   8.398   2.505
  552   2HG2  ILE  72          2HG2      ILE  72   0.914   7.396   3.301
  553   3HG2  ILE  72          3HG2      ILE  72   0.448   7.063   1.616
  554   1HD1  ILE  72          1HD1      ILE  72  -3.312   5.059   1.019
  555   2HD1  ILE  72          2HD1      ILE  72  -3.150   4.321   2.631
  556   3HD1  ILE  72          3HD1      ILE  72  -3.434   6.072   2.478
  557    H    ASP  73           H        ASP  73   1.492   6.454   5.741
  558    HA   ASP  73           HA       ASP  73   0.572   6.957   8.146
  559   1HB   ASP  73          1HB       ASP  73   2.600   8.336   6.415
  560   2HB   ASP  73          2HB       ASP  73   2.157   9.169   7.892
  561    HA   PRO  74           HA       PRO  74  -2.184  10.360   7.916
  562   1HB   PRO  74          1HB       PRO  74  -1.877  11.571  10.346
  563   2HB   PRO  74          2HB       PRO  74  -2.832  10.121  10.112
  564   1HG   PRO  74          1HG       PRO  74  -0.152  10.399  11.329
  565   2HG   PRO  74          2HG       PRO  74  -1.287   9.070  11.464
  566   1HD   PRO  74          1HD       PRO  74   1.078   9.150   9.842
  567   2HD   PRO  74          2HD       PRO  74  -0.118   7.869   9.890
  568    H    PHE  75           H        PHE  75   1.137  10.987   8.425
  569    HA   PHE  75           HA       PHE  75   0.795  13.812   7.950
  570   1HB   PHE  75          1HB       PHE  75   2.951  11.806   8.635
  571   2HB   PHE  75          2HB       PHE  75   3.498  13.239   7.789
  572    HD1  PHE  75           1HD      PHE  75   2.481  15.511   8.818
  573    HD2  PHE  75           2HD      PHE  75   2.997  11.869  10.934
  574    HE1  PHE  75           1HE      PHE  75   2.521  16.776  10.986
  575    HE2  PHE  75           2HE      PHE  75   3.037  13.133  13.102
  576    HZ   PHE  75           HZ       PHE  75   2.798  15.572  13.102
  577    H    SER  76           H        SER  76   1.437  10.852   6.145
  578    HA   SER  76           HA       SER  76   2.513  12.333   3.930
  579   1HB   SER  76          1HB       SER  76   1.794   9.375   4.051
  580   2HB   SER  76          2HB       SER  76   2.849  10.155   2.889
  581    HG   SER  76           HG       SER  76   4.279   9.323   4.345
  582    H    MET  77           H        MET  77  -0.551  11.276   5.175
  583    HA   MET  77           HA       MET  77  -1.935  10.710   2.881
  584   1HB   MET  77          1HB       MET  77  -2.470  11.046   5.622
  585   2HB   MET  77          2HB       MET  77  -3.421  12.326   4.895
  586   1HG   MET  77          1HG       MET  77  -3.532   9.408   3.990
  587   2HG   MET  77          2HG       MET  77  -4.656  10.116   5.132
  588   1HE   MET  77          1HE       MET  77  -3.481   9.833   1.480
  589   2HE   MET  77          2HE       MET  77  -4.843   8.802   1.982
  590   3HE   MET  77          3HE       MET  77  -5.085  10.054   0.740
  591    HA   PRO  78           HA       PRO  78  -2.780  15.372   2.553
  592   1HB   PRO  78          1HB       PRO  78  -1.306  17.125   4.044
  593   2HB   PRO  78          2HB       PRO  78  -2.894  16.559   4.523
  594   1HG   PRO  78          1HG       PRO  78  -0.249  15.778   5.586
  595   2HG   PRO  78          2HG       PRO  78  -1.830  15.562   6.310
  596   1HD   PRO  78          1HD       PRO  78  -0.246  13.551   5.017
  597   2HD   PRO  78          2HD       PRO  78  -1.874  13.364   5.637
  598    H    TYR  79           H        TYR  79  -0.041  13.702   2.261
  599    HA   TYR  79           HA       TYR  79   1.197  15.788   0.601
  600   1HB   TYR  79          1HB       TYR  79   2.106  13.984   2.629
  601   2HB   TYR  79          2HB       TYR  79   2.645  13.245   1.135
  602    HD1  TYR  79           1HD      TYR  79   4.314  14.488   3.456
  603    HD2  TYR  79           2HD      TYR  79   3.040  15.970  -0.350
  604    HE1  TYR  79           1HE      TYR  79   6.309  16.063   3.393
  605    HE2  TYR  79           2HE      TYR  79   5.039  17.539  -0.400
  606    HH   TYR  79           HH       TYR  79   6.848  18.178   0.587
  607    H    VAL  80           H        VAL  80  -0.539  12.767   0.585
  608    HA   VAL  80           HA       VAL  80  -0.055  12.590  -2.290
  609    HB   VAL  80           HB       VAL  80   0.052  10.118  -2.076
  610   1HG1  VAL  80          1HG1      VAL  80   2.429  10.429  -0.668
  611   2HG1  VAL  80          2HG1      VAL  80   2.202  10.643  -2.421
  612   3HG1  VAL  80          3HG1      VAL  80   2.116  12.050  -1.334
  613   1HG2  VAL  80          1HG2      VAL  80  -0.297   9.062  -0.143
  614   2HG2  VAL  80          2HG2      VAL  80   0.990   9.999   0.653
  615   3HG2  VAL  80          3HG2      VAL  80  -0.672  10.634   0.604
  616    H    ASN  81           H        ASN  81  -2.202  13.821  -0.758
  617    HA   ASN  81           HA       ASN  81  -4.318  11.993  -0.542
  618   1HB   ASN  81          1HB       ASN  81  -5.709  14.187  -0.500
  619   2HB   ASN  81          2HB       ASN  81  -4.501  14.004   0.756
  620   1HD2  ASN  81          1HD2      ASN  81  -5.490  15.700  -2.078
  621   2HD2  ASN  81          2HD2      ASN  81  -4.270  16.929  -2.096
  622    H    GLY  82           H        GLY  82  -5.287  11.033  -2.336
  623   1HA   GLY  82          1HA       GLY  82  -6.469  10.969  -4.282
  624   2HA   GLY  82          2HA       GLY  82  -6.167  12.676  -4.540
  625    H    ALA  83           H        ALA  83  -3.144  11.635  -3.809
  626    HA   ALA  83           HA       ALA  83  -2.307  11.678  -6.515
  627   1HB   ALA  83          1HB       ALA  83  -0.530  10.685  -4.315
  628   2HB   ALA  83          2HB       ALA  83  -0.194  11.857  -5.612
  629   3HB   ALA  83          3HB       ALA  83  -1.151  12.349  -4.194
  630    H    GLU  84           H        GLU  84  -1.026   9.934  -7.580
  631    HA   GLU  84           HA       GLU  84  -2.087   7.338  -6.775
  632   1HB   GLU  84          1HB       GLU  84  -1.359   8.322  -9.570
  633   2HB   GLU  84          2HB       GLU  84  -1.915   6.704  -9.192
  634   1HG   GLU  84          1HG       GLU  84  -4.052   7.651  -8.290
  635   2HG   GLU  84          2HG       GLU  84  -3.496   9.268  -8.674
  636    H    LEU  85           H        LEU  85  -0.586   5.874  -6.086
  637    HA   LEU  85           HA       LEU  85   2.207   6.532  -6.505
  638   1HB   LEU  85          1HB       LEU  85   2.019   5.991  -4.333
  639   2HB   LEU  85          2HB       LEU  85   0.619   4.967  -4.580
  640    HG   LEU  85           HG       LEU  85   2.064   3.154  -5.399
  641   1HD1  LEU  85          1HD1      LEU  85   4.632   3.749  -4.661
  642   2HD1  LEU  85          2HD1      LEU  85   4.002   3.782  -6.326
  643   3HD1  LEU  85          3HD1      LEU  85   4.087   5.285  -5.376
  644   1HD2  LEU  85          1HD2      LEU  85   3.528   3.274  -3.038
  645   2HD2  LEU  85          2HD2      LEU  85   2.077   4.251  -2.706
  646   3HD2  LEU  85          3HD2      LEU  85   1.909   2.568  -3.259
  647    H    ASP  86           H        ASP  86   3.051   5.919  -8.432
  648    HA   ASP  86           HA       ASP  86   2.061   3.454  -9.573
  649   1HB   ASP  86          1HB       ASP  86   2.613   5.876 -10.718
  650   2HB   ASP  86          2HB       ASP  86   4.162   5.092 -10.953
  651    H    TYR  87           H        TYR  87   3.193   1.752  -8.526
  652    HA   TYR  87           HA       TYR  87   6.016   2.058  -7.983
  653   1HB   TYR  87          1HB       TYR  87   3.801   0.729  -6.885
  654   2HB   TYR  87          2HB       TYR  87   4.567  -0.573  -7.773
  655    HD1  TYR  87           1HD      TYR  87   6.851  -1.336  -7.166
  656    HD2  TYR  87           2HD      TYR  87   4.803   1.647  -4.883
  657    HE1  TYR  87           1HE      TYR  87   8.478  -1.681  -5.243
  658    HE2  TYR  87           2HE      TYR  87   6.437   1.292  -2.967
  659    HH   TYR  87           HH       TYR  87   9.092  -1.054  -3.274
  660    H    VAL  88           H        VAL  88   7.670   1.298  -9.224
  661    HA   VAL  88           HA       VAL  88   6.928  -0.060 -11.681
  662    HB   VAL  88           HB       VAL  88   9.492   1.185 -10.677
  663   1HG1  VAL  88          1HG1      VAL  88  10.104   0.921 -13.200
  664   2HG1  VAL  88          2HG1      VAL  88  10.301  -0.467 -12.103
  665   3HG1  VAL  88          3HG1      VAL  88   8.887  -0.377 -13.180
  666   1HG2  VAL  88          1HG2      VAL  88   9.009   3.038 -11.973
  667   2HG2  VAL  88          2HG2      VAL  88   7.924   2.134 -13.058
  668   3HG2  VAL  88          3HG2      VAL  88   7.383   2.571 -11.420
  669    H    VAL  89           H        VAL  89   7.726  -2.114 -12.297
  670    HA   VAL  89           HA       VAL  89   9.052  -3.595 -10.137
  671    HB   VAL  89           HB       VAL  89   6.888  -4.710 -11.921
  672   1HG1  VAL  89          1HG1      VAL  89   8.788  -5.980 -10.363
  673   2HG1  VAL  89          2HG1      VAL  89   7.364  -5.932  -9.296
  674   3HG1  VAL  89          3HG1      VAL  89   7.245  -6.681 -10.907
  675   1HG2  VAL  89          1HG2      VAL  89   5.320  -4.474 -10.085
  676   2HG2  VAL  89          2HG2      VAL  89   6.575  -3.734  -9.063
  677   3HG2  VAL  89          3HG2      VAL  89   5.983  -2.877 -10.506
  678    H    ASP  90           H        ASP  90  11.068  -4.028 -10.875
  679    HA   ASP  90           HA       ASP  90  11.319  -5.487 -13.277
  680   1HB   ASP  90          1HB       ASP  90  11.302  -2.841 -13.789
  681   2HB   ASP  90          2HB       ASP  90  12.970  -2.961 -13.267
  682    H    PHE  91           H        PHE  91  14.226  -4.471 -13.523
  683    HA   PHE  91           HA       PHE  91  15.428  -6.269 -11.803
  684   1HB   PHE  91          1HB       PHE  91  16.124  -4.741 -13.968
  685   2HB   PHE  91          2HB       PHE  91  16.824  -3.732 -12.718
  686    HD1  PHE  91           1HD      PHE  91  16.787  -7.281 -13.866
  687    HD2  PHE  91           2HD      PHE  91  18.982  -4.166 -11.999
  688    HE1  PHE  91           1HE      PHE  91  18.828  -8.741 -13.830
  689    HE2  PHE  91           2HE      PHE  91  21.023  -5.626 -11.962
  690    HZ   PHE  91           HZ       PHE  91  20.922  -7.896 -12.878
  691    H    MET  92           H        MET  92  14.061  -3.180 -11.107
  692    HA   MET  92           HA       MET  92  15.888  -2.521  -9.032
  693   1HB   MET  92          1HB       MET  92  13.721  -1.287 -10.482
  694   2HB   MET  92          2HB       MET  92  13.278  -1.231  -8.787
  695   1HG   MET  92          1HG       MET  92  14.526   0.754  -9.025
  696   2HG   MET  92          2HG       MET  92  15.732  -0.354  -8.402
  697   1HE   MET  92          1HE       MET  92  16.472   2.090  -9.475
  698   2HE   MET  92          2HE       MET  92  17.970   1.173  -9.759
  699   3HE   MET  92          3HE       MET  92  17.255   2.138 -11.072
  700    H    GLY  93           H        GLY  93  13.735  -5.010  -9.282
  701   1HA   GLY  93          1HA       GLY  93  12.741  -6.370  -7.795
  702   2HA   GLY  93          2HA       GLY  93  13.712  -5.612  -6.549
  703    H    GLY  94           H        GLY  94  11.833  -3.326  -8.352
  704   1HA   GLY  94          1HA       GLY  94   9.456  -2.925  -7.919
  705   2HA   GLY  94          2HA       GLY  94   9.755  -3.340  -6.243
  706    H    GLY  95           H        GLY  95  10.382  -0.936  -8.822
  707   1HA   GLY  95          1HA       GLY  95  11.647   0.905  -6.953
  708   2HA   GLY  95          2HA       GLY  95  11.405   1.122  -8.675
  709    H    PHE  96           H        PHE  96  10.332   2.028  -5.574
  710    HA   PHE  96           HA       PHE  96   7.588   2.435  -6.157
  711   1HB   PHE  96          1HB       PHE  96   7.936   3.972  -4.052
  712   2HB   PHE  96          2HB       PHE  96   8.275   2.265  -3.846
  713    HD1  PHE  96           1HD      PHE  96   9.931   5.511  -4.586
  714    HD2  PHE  96           2HD      PHE  96  10.369   1.566  -3.085
  715    HE1  PHE  96           1HE      PHE  96  12.251   6.065  -3.806
  716    HE2  PHE  96           2HE      PHE  96  12.689   2.121  -2.305
  717    HZ   PHE  96           HZ       PHE  96  13.603   4.364  -2.675
  718    H    THR  97           H        THR  97   6.501   4.263  -6.893
  719    HA   THR  97           HA       THR  97   7.857   6.774  -7.139
  720    HB   THR  97           HB       THR  97   7.438   4.934  -9.527
  721    HG1  THR  97           1HG      THR  97   9.639   5.308  -9.543
  722   1HG2  THR  97          1HG2      THR  97   7.692   7.988  -9.521
  723   2HG2  THR  97          2HG2      THR  97   7.927   6.958 -10.954
  724   3HG2  THR  97          3HG2      THR  97   6.328   7.053 -10.178
  725    H    ILE  98           H        ILE  98   6.428   8.504  -7.788
  726    HA   ILE  98           HA       ILE  98   3.617   7.715  -7.898
  727    HB   ILE  98           HB       ILE  98   3.831   8.118  -5.615
  728   1HG1  ILE  98          1HG1      ILE  98   3.045  10.889  -6.039
  729   2HG1  ILE  98          2HG1      ILE  98   2.306   9.828  -7.222
  730   1HG2  ILE  98          1HG2      ILE  98   5.352  10.683  -6.120
  731   2HG2  ILE  98          2HG2      ILE  98   5.075   9.852  -4.570
  732   3HG2  ILE  98          3HG2      ILE  98   6.137   9.118  -5.796
  733   1HD1  ILE  98          1HD1      ILE  98   0.966   8.830  -5.669
  734   2HD1  ILE  98          2HD1      ILE  98   2.287   8.702  -4.483
  735   3HD1  ILE  98          3HD1      ILE  98   1.378  10.224  -4.641
  736    H    ARG  99           H        ARG  99   2.425   8.910  -9.340
  737    HA   ARG  99           HA       ARG  99   3.931  11.023 -10.645
  738   1HB   ARG  99          1HB       ARG  99   2.037   8.920 -11.581
  739   2HB   ARG  99          2HB       ARG  99   1.760  10.494 -12.301
  740   1HG   ARG  99          1HG       ARG  99   3.764  10.482 -13.455
  741   2HG   ARG  99          2HG       ARG  99   4.624   9.649 -12.175
  742   1HD   ARG  99          1HD       ARG  99   4.508   8.058 -13.956
  743   2HD   ARG  99          2HD       ARG  99   3.278   7.537 -12.822
  744    HE   ARG  99           HE       ARG  99   1.594   8.167 -14.355
  745   1HH1  ARG  99          2HH2      ARG  99   4.731   9.332 -15.443
  746   2HH1  ARG  99          1HH2      ARG  99   4.164   9.771 -17.020
  747   1HH2  ARG  99          2HH1      ARG  99   0.845   8.745 -16.435
  748   2HH2  ARG  99          1HH1      ARG  99   1.939   9.435 -17.588
  749    H    ASN 100           H        ASN 100   3.310  13.073 -10.035
  750    HA   ASN 100           HA       ASN 100   0.550  13.382  -9.174
  751   1HB   ASN 100          1HB       ASN 100   3.121  14.425  -8.230
  752   2HB   ASN 100          2HB       ASN 100   2.045  15.755  -8.610
  753   1HD2  ASN 100          1HD2      ASN 100   3.027  13.735  -6.245
  754   2HD2  ASN 100          2HD2      ASN 100   1.657  13.743  -5.186
  755    HA   PRO 101           HA       PRO 101  -0.007  15.931 -12.705
  756   1HB   PRO 101          1HB       PRO 101  -2.283  17.274 -12.006
  757   2HB   PRO 101          2HB       PRO 101  -2.291  15.644 -12.651
  758   1HG   PRO 101          1HG       PRO 101  -2.717  16.538  -9.866
  759   2HG   PRO 101          2HG       PRO 101  -3.133  15.002 -10.602
  760   1HD   PRO 101          1HD       PRO 101  -0.918  15.525  -8.856
  761   2HD   PRO 101          2HD       PRO 101  -1.268  14.021  -9.684
  Start of MODEL   12
    1    H    MET   1           H        MET   1 -14.423   5.203  20.315
    2    HA   MET   1           HA       MET   1 -12.476   5.825  21.911
    3   1HB   MET   1          1HB       MET   1 -14.360   4.048  23.395
    4   2HB   MET   1          2HB       MET   1 -12.696   3.501  23.463
    5   1HG   MET   1          1HG       MET   1 -11.972   5.735  24.293
    6   2HG   MET   1          2HG       MET   1 -13.616   6.330  24.171
    7   1HE   MET   1          1HE       MET   1 -11.918   6.013  27.426
    8   2HE   MET   1          2HE       MET   1 -11.534   4.275  27.407
    9   3HE   MET   1          3HE       MET   1 -11.047   5.309  26.042
   10    H    GLN   2           H        GLN   2 -12.666   4.982  19.333
   11    HA   GLN   2           HA       GLN   2 -11.124   2.522  19.430
   12   1HB   GLN   2          1HB       GLN   2 -13.430   3.124  17.532
   13   2HB   GLN   2          2HB       GLN   2 -12.267   1.844  17.246
   14   1HG   GLN   2          1HG       GLN   2 -13.905   2.065  19.813
   15   2HG   GLN   2          2HG       GLN   2 -14.422   1.126  18.426
   16   1HE2  GLN   2          1HE2      GLN   2 -13.056   0.887  21.334
   17   2HE2  GLN   2          2HE2      GLN   2 -12.044  -0.507  21.152
   18    H    GLU   3           H        GLU   3 -10.429   2.259  16.763
   19    HA   GLU   3           HA       GLU   3  -8.580   4.349  16.508
   20   1HB   GLU   3          1HB       GLU   3  -7.888   3.178  14.445
   21   2HB   GLU   3          2HB       GLU   3  -8.101   2.046  15.766
   22   1HG   GLU   3          1HG       GLU   3 -10.568   1.811  14.830
   23   2HG   GLU   3          2HG       GLU   3  -9.898   2.505  13.367
   24    H    GLN   4           H        GLN   4  -8.326   5.782  14.566
   25    HA   GLN   4           HA       GLN   4 -10.813   7.029  14.032
   26   1HB   GLN   4          1HB       GLN   4  -8.702   8.304  14.378
   27   2HB   GLN   4          2HB       GLN   4  -8.026   7.595  12.926
   28   1HG   GLN   4          1HG       GLN   4  -9.407   8.833  11.498
   29   2HG   GLN   4          2HG       GLN   4 -10.694   8.970  12.678
   30   1HE2  GLN   4          1HE2      GLN   4 -10.925  10.800  13.721
   31   2HE2  GLN   4          2HE2      GLN   4  -9.758  12.072  13.870
   32    H    ALA   5           H        ALA   5 -12.145   5.693  12.769
   33    HA   ALA   5           HA       ALA   5 -11.106   4.348  10.477
   34   1HB   ALA   5          1HB       ALA   5 -12.889   3.207  11.409
   35   2HB   ALA   5          2HB       ALA   5 -13.758   4.699  11.843
   36   3HB   ALA   5          3HB       ALA   5 -13.743   4.136  10.154
   37    H    GLN   6           H        GLN   6 -10.969   5.065   8.393
   38    HA   GLN   6           HA       GLN   6 -12.699   6.901   7.289
   39   1HB   GLN   6          1HB       GLN   6 -11.513   8.485   8.866
   40   2HB   GLN   6          2HB       GLN   6 -10.015   8.154   8.018
   41   1HG   GLN   6          1HG       GLN   6 -10.697   9.273   6.072
   42   2HG   GLN   6          2HG       GLN   6 -12.400   8.993   6.374
   43   1HE2  GLN   6          1HE2      GLN   6 -12.296  11.339   5.732
   44   2HE2  GLN   6          2HE2      GLN   6 -12.162  12.515   6.996
   45    H    GLN   7           H        GLN   7 -12.504   6.763   5.056
   46    HA   GLN   7           HA       GLN   7 -10.096   5.397   4.146
   47   1HB   GLN   7          1HB       GLN   7 -12.133   4.077   3.811
   48   2HB   GLN   7          2HB       GLN   7 -12.922   5.418   3.004
   49   1HG   GLN   7          1HG       GLN   7 -10.672   5.228   1.461
   50   2HG   GLN   7          2HG       GLN   7 -10.810   3.558   1.976
   51   1HE2  GLN   7          1HE2      GLN   7 -12.722   6.260   0.689
   52   2HE2  GLN   7          2HE2      GLN   7 -13.770   5.329  -0.329
   53    H    PHE   8           H        PHE   8  -8.705   7.052   3.539
   54    HA   PHE   8           HA       PHE   8  -9.688   9.406   2.284
   55   1HB   PHE   8          1HB       PHE   8  -6.850   8.231   2.359
   56   2HB   PHE   8          2HB       PHE   8  -7.265   9.928   2.220
   57    HD1  PHE   8           1HD      PHE   8  -5.579   8.181   4.321
   58    HD2  PHE   8           2HD      PHE   8  -9.358  10.110   4.355
   59    HE1  PHE   8           1HE      PHE   8  -5.434   8.420   6.815
   60    HE2  PHE   8           2HE      PHE   8  -9.214  10.349   6.850
   61    HZ   PHE   8           HZ       PHE   8  -7.253   9.501   8.050
   62    H    ILE   9           H        ILE   9  -8.899  10.181   0.118
   63    HA   ILE   9           HA       ILE   9  -9.416   8.158  -1.826
   64    HB   ILE   9           HB       ILE   9  -8.537  11.015  -2.242
   65   1HG1  ILE   9          1HG1      ILE   9 -10.462  10.947  -0.722
   66   2HG1  ILE   9          2HG1      ILE   9 -10.882  11.633  -2.279
   67   1HG2  ILE   9          1HG2      ILE   9 -10.404  10.021  -4.175
   68   2HG2  ILE   9          2HG2      ILE   9  -8.737  10.601  -4.409
   69   3HG2  ILE   9          3HG2      ILE   9  -9.039   8.886  -4.041
   70   1HD1  ILE   9          1HD1      ILE   9 -12.622  10.154  -2.222
   71   2HD1  ILE   9          2HD1      ILE   9 -11.405   8.956  -2.724
   72   3HD1  ILE   9          3HD1      ILE   9 -11.828   9.128  -1.004
   73    H    PHE  10           H        PHE  10  -7.951   6.742  -2.593
   74    HA   PHE  10           HA       PHE  10  -5.344   7.677  -3.310
   75   1HB   PHE  10          1HB       PHE  10  -5.489   7.004  -0.727
   76   2HB   PHE  10          2HB       PHE  10  -5.591   5.360  -1.325
   77    HD1  PHE  10           1HD      PHE  10  -3.697   4.765  -3.125
   78    HD2  PHE  10           2HD      PHE  10  -3.400   7.804  -0.179
   79    HE1  PHE  10           1HE      PHE  10  -1.193   4.661  -3.269
   80    HE2  PHE  10           2HE      PHE  10  -0.897   7.700  -0.322
   81    HZ   PHE  10           HZ       PHE  10   0.177   6.129  -1.866
   82    H    LYS  11           H        LYS  11  -4.685   6.578  -5.111
   83    HA   LYS  11           HA       LYS  11  -5.775   3.889  -5.499
   84   1HB   LYS  11          1HB       LYS  11  -5.885   6.177  -7.481
   85   2HB   LYS  11          2HB       LYS  11  -6.107   4.499  -7.930
   86   1HG   LYS  11          1HG       LYS  11  -8.209   4.398  -7.021
   87   2HG   LYS  11          2HG       LYS  11  -7.741   5.296  -5.590
   88   1HD   LYS  11          1HD       LYS  11  -8.012   6.704  -8.269
   89   2HD   LYS  11          2HD       LYS  11  -9.427   6.393  -7.283
   90   1HE   LYS  11          1HE       LYS  11  -8.267   7.567  -5.349
   91   2HE   LYS  11          2HE       LYS  11  -6.955   7.977  -6.436
   92   1HZ   LYS  11          1HZ       LYS  11  -9.297   8.699  -7.691
   93   2HZ   LYS  11          2HZ       LYS  11  -9.422   9.239  -6.155
   94   3HZ   LYS  11          3HZ       LYS  11  -8.152   9.689  -7.078
   95    H    VAL  12           H        VAL  12  -4.160   2.461  -5.823
   96    HA   VAL  12           HA       VAL  12  -1.619   3.565  -6.800
   97    HB   VAL  12           HB       VAL  12  -1.899   2.537  -4.435
   98   1HG1  VAL  12          1HG1      VAL  12  -1.765   0.178  -4.224
   99   2HG1  VAL  12          2HG1      VAL  12  -3.086   0.488  -5.376
  100   3HG1  VAL  12          3HG1      VAL  12  -1.494  -0.042  -5.970
  101   1HG2  VAL  12          1HG2      VAL  12   0.269   3.109  -5.060
  102   2HG2  VAL  12          2HG2      VAL  12   0.404   1.360  -4.759
  103   3HG2  VAL  12          3HG2      VAL  12   0.288   1.970  -6.427
  104    H    THR  13           H        THR  13  -0.513   2.473  -8.478
  105    HA   THR  13           HA       THR  13  -2.138   1.267 -10.403
  106    HB   THR  13           HB       THR  13   0.180   0.745 -11.417
  107    HG1  THR  13           1HG      THR  13   1.837   0.972  -9.958
  108   1HG2  THR  13          1HG2      THR  13  -0.824   2.962 -11.885
  109   2HG2  THR  13          2HG2      THR  13  -0.306   3.553 -10.288
  110   3HG2  THR  13          3HG2      THR  13   0.908   3.161 -11.529
  111    H    ASP  14           H        ASP  14  -2.647  -0.801 -10.965
  112    HA   ASP  14           HA       ASP  14  -2.872  -2.683  -9.093
  113   1HB   ASP  14          1HB       ASP  14  -3.229  -2.508 -11.890
  114   2HB   ASP  14          2HB       ASP  14  -2.184  -3.900 -11.685
  115    H    LYS  15           H        LYS  15  -0.024  -1.854 -11.083
  116    HA   LYS  15           HA       LYS  15   1.448  -4.203 -10.609
  117   1HB   LYS  15          1HB       LYS  15   1.708  -1.937 -12.182
  118   2HB   LYS  15          2HB       LYS  15   3.011  -1.756 -11.026
  119   1HG   LYS  15          1HG       LYS  15   3.875  -3.043 -12.891
  120   2HG   LYS  15          2HG       LYS  15   3.727  -4.135 -11.528
  121   1HD   LYS  15          1HD       LYS  15   2.077  -5.380 -12.532
  122   2HD   LYS  15          2HD       LYS  15   1.271  -3.972 -13.193
  123   1HE   LYS  15          1HE       LYS  15   3.924  -4.949 -14.325
  124   2HE   LYS  15          2HE       LYS  15   2.400  -5.625 -14.866
  125   1HZ   LYS  15          1HZ       LYS  15   2.932  -2.740 -14.872
  126   2HZ   LYS  15          2HZ       LYS  15   3.243  -3.701 -16.156
  127   3HZ   LYS  15          3HZ       LYS  15   1.711  -3.528 -15.617
  128    H    ALA  16           H        ALA  16   1.208  -1.028  -8.915
  129    HA   ALA  16           HA       ALA  16   3.253  -1.425  -7.098
  130   1HB   ALA  16          1HB       ALA  16   2.366   0.733  -7.182
  131   2HB   ALA  16          2HB       ALA  16   0.683   0.155  -7.144
  132   3HB   ALA  16          3HB       ALA  16   1.672   0.115  -5.664
  133    H    VAL  17           H        VAL  17  -0.234  -2.385  -6.960
  134    HA   VAL  17           HA       VAL  17  -0.022  -3.509  -4.378
  135    HB   VAL  17           HB       VAL  17  -1.994  -3.434  -6.602
  136   1HG1  VAL  17          1HG1      VAL  17  -3.479  -5.046  -5.489
  137   2HG1  VAL  17          2HG1      VAL  17  -1.972  -5.821  -6.034
  138   3HG1  VAL  17          3HG1      VAL  17  -2.195  -5.422  -4.314
  139   1HG2  VAL  17          1HG2      VAL  17  -1.606  -2.069  -4.208
  140   2HG2  VAL  17          2HG2      VAL  17  -3.068  -2.037  -5.222
  141   3HG2  VAL  17          3HG2      VAL  17  -2.958  -3.174  -3.858
  142    H    GLU  18           H        GLU  18   0.197  -4.820  -7.736
  143    HA   GLU  18           HA       GLU  18   0.328  -7.471  -7.030
  144   1HB   GLU  18          1HB       GLU  18   0.493  -5.964  -9.385
  145   2HB   GLU  18          2HB       GLU  18   2.051  -6.764  -9.315
  146   1HG   GLU  18          1HG       GLU  18   0.682  -8.937  -8.779
  147   2HG   GLU  18          2HG       GLU  18  -0.709  -8.038  -9.351
  148    H    GLU  19           H        GLU  19   2.796  -4.899  -6.974
  149    HA   GLU  19           HA       GLU  19   5.041  -6.473  -6.875
  150   1HB   GLU  19          1HB       GLU  19   5.259  -4.097  -7.163
  151   2HB   GLU  19          2HB       GLU  19   4.395  -3.756  -5.677
  152   1HG   GLU  19          1HG       GLU  19   6.728  -3.431  -5.182
  153   2HG   GLU  19          2HG       GLU  19   6.272  -4.935  -4.407
  154    H    ILE  20           H        ILE  20   2.594  -5.740  -4.402
  155    HA   ILE  20           HA       ILE  20   4.178  -6.648  -2.218
  156    HB   ILE  20           HB       ILE  20   1.281  -5.960  -2.617
  157   1HG1  ILE  20          1HG1      ILE  20   2.031  -4.291  -0.750
  158   2HG1  ILE  20          2HG1      ILE  20   3.655  -4.689  -1.273
  159   1HG2  ILE  20          1HG2      ILE  20   1.170  -6.207  -0.053
  160   2HG2  ILE  20          2HG2      ILE  20   1.034  -7.671  -1.056
  161   3HG2  ILE  20          3HG2      ILE  20   2.570  -7.289  -0.242
  162   1HD1  ILE  20          1HD1      ILE  20   3.409  -3.651  -3.324
  163   2HD1  ILE  20          2HD1      ILE  20   1.682  -4.064  -3.443
  164   3HD1  ILE  20          3HD1      ILE  20   2.204  -2.709  -2.413
  165    H    LYS  21           H        LYS  21   1.793  -8.084  -4.481
  166    HA   LYS  21           HA       LYS  21   1.296 -10.443  -3.183
  167   1HB   LYS  21          1HB       LYS  21   1.268  -9.500  -6.000
  168   2HB   LYS  21          2HB       LYS  21   1.297 -11.236  -5.773
  169   1HG   LYS  21          1HG       LYS  21  -0.993 -10.907  -5.646
  170   2HG   LYS  21          2HG       LYS  21  -0.601 -10.693  -3.951
  171   1HD   LYS  21          1HD       LYS  21  -1.391  -8.571  -4.017
  172   2HD   LYS  21          2HD       LYS  21  -0.200  -8.150  -5.232
  173   1HE   LYS  21          1HE       LYS  21  -2.534  -7.726  -6.023
  174   2HE   LYS  21          2HE       LYS  21  -1.698  -8.883  -7.040
  175   1HZ   LYS  21          1HZ       LYS  21  -4.029  -9.421  -6.208
  176   2HZ   LYS  21          2HZ       LYS  21  -2.909 -10.609  -6.175
  177   3HZ   LYS  21          3HZ       LYS  21  -3.310  -9.825  -4.799
  178    H    LYS  22           H        LYS  22   4.139  -9.476  -5.163
  179    HA   LYS  22           HA       LYS  22   5.306 -12.076  -5.001
  180   1HB   LYS  22          1HB       LYS  22   5.690  -9.718  -6.511
  181   2HB   LYS  22          2HB       LYS  22   7.184  -9.971  -5.632
  182   1HG   LYS  22          1HG       LYS  22   6.832 -12.513  -6.408
  183   2HG   LYS  22          2HG       LYS  22   5.841 -11.774  -7.650
  184   1HD   LYS  22          1HD       LYS  22   7.956 -11.797  -8.677
  185   2HD   LYS  22          2HD       LYS  22   7.892 -10.171  -8.027
  186   1HE   LYS  22          1HE       LYS  22   9.255 -10.792  -6.106
  187   2HE   LYS  22          2HE       LYS  22   9.126 -12.498  -6.486
  188   1HZ   LYS  22          1HZ       LYS  22  11.183 -11.179  -7.213
  189   2HZ   LYS  22          2HZ       LYS  22  10.548 -12.279  -8.239
  190   3HZ   LYS  22          3HZ       LYS  22  10.257 -10.688  -8.466
  191    H    VAL  23           H        VAL  23   5.914  -8.864  -3.430
  192    HA   VAL  23           HA       VAL  23   8.019  -9.652  -1.841
  193    HB   VAL  23           HB       VAL  23   5.912  -7.548  -1.747
  194   1HG1  VAL  23          1HG1      VAL  23   7.340  -6.726   0.359
  195   2HG1  VAL  23          2HG1      VAL  23   5.879  -7.728   0.531
  196   3HG1  VAL  23          3HG1      VAL  23   7.490  -8.482   0.610
  197   1HG2  VAL  23          1HG2      VAL  23   7.601  -6.137  -2.343
  198   2HG2  VAL  23          2HG2      VAL  23   8.820  -7.006  -1.381
  199   3HG2  VAL  23          3HG2      VAL  23   8.304  -7.652  -2.957
  200    H    ALA  24           H        ALA  24   4.480 -10.070  -1.406
  201    HA   ALA  24           HA       ALA  24   4.768 -11.091   1.247
  202   1HB   ALA  24          1HB       ALA  24   2.324 -11.712   0.830
  203   2HB   ALA  24          2HB       ALA  24   2.725  -9.983   0.685
  204   3HB   ALA  24          3HB       ALA  24   2.508 -10.972  -0.779
  205    H    GLN  25           H        GLN  25   4.376 -12.439  -2.076
  206    HA   GLN  25           HA       GLN  25   3.958 -15.039  -1.412
  207   1HB   GLN  25          1HB       GLN  25   4.808 -13.534  -3.749
  208   2HB   GLN  25          2HB       GLN  25   5.697 -15.042  -3.673
  209   1HG   GLN  25          1HG       GLN  25   3.568 -16.311  -3.452
  210   2HG   GLN  25          2HG       GLN  25   2.657 -14.814  -3.456
  211   1HE2  GLN  25          1HE2      GLN  25   4.106 -17.254  -5.300
  212   2HE2  GLN  25          2HE2      GLN  25   3.867 -16.606  -6.889
  213    H    GLU  26           H        GLU  26   7.073 -13.231  -1.657
  214    HA   GLU  26           HA       GLU  26   8.634 -15.523  -1.179
  215   1HB   GLU  26          1HB       GLU  26   9.183 -13.076  -2.176
  216   2HB   GLU  26          2HB       GLU  26   9.671 -12.779  -0.520
  217   1HG   GLU  26          1HG       GLU  26  10.645 -15.364  -1.634
  218   2HG   GLU  26          2HG       GLU  26  11.273 -13.947  -2.452
  219    H    ASN  27           H        ASN  27   6.506 -13.826   0.808
  220    HA   ASN  27           HA       ASN  27   8.076 -14.544   3.158
  221   1HB   ASN  27          1HB       ASN  27   6.183 -12.244   2.593
  222   2HB   ASN  27          2HB       ASN  27   6.305 -12.834   4.239
  223   1HD2  ASN  27          1HD2      ASN  27   7.789 -11.083   1.693
  224   2HD2  ASN  27          2HD2      ASN  27   9.232 -10.579   2.508
  225    H    ASN  28           H        ASN  28   5.698 -15.634   1.173
  226    HA   ASN  28           HA       ASN  28   3.913 -16.862   1.327
  227   1HB   ASN  28          1HB       ASN  28   5.629 -18.225   2.712
  228   2HB   ASN  28          2HB       ASN  28   4.835 -17.608   4.147
  229   1HD2  ASN  28          1HD2      ASN  28   3.568 -19.056   5.001
  230   2HD2  ASN  28          2HD2      ASN  28   2.498 -20.141   4.178
  231    H    ILE  29           H        ILE  29   3.463 -14.151   2.062
  232    HA   ILE  29           HA       ILE  29   1.776 -14.296   4.445
  233    HB   ILE  29           HB       ILE  29   3.016 -12.027   2.907
  234   1HG1  ILE  29          1HG1      ILE  29   3.234 -12.849   5.818
  235   2HG1  ILE  29          2HG1      ILE  29   4.396 -13.264   4.573
  236   1HG2  ILE  29          1HG2      ILE  29   0.802 -11.262   3.368
  237   2HG2  ILE  29          2HG2      ILE  29   0.864 -11.894   5.031
  238   3HG2  ILE  29          3HG2      ILE  29   1.892 -10.519   4.563
  239   1HD1  ILE  29          1HD1      ILE  29   5.298 -11.310   5.583
  240   2HD1  ILE  29          2HD1      ILE  29   4.534 -10.709   4.092
  241   3HD1  ILE  29          3HD1      ILE  29   3.709 -10.511   5.656
  242    H    GLU  30           H        GLU  30  -0.445 -13.949   4.371
  243    HA   GLU  30           HA       GLU  30  -1.505 -13.839   1.656
  244   1HB   GLU  30          1HB       GLU  30  -1.958 -15.713   3.757
  245   2HB   GLU  30          2HB       GLU  30  -3.438 -14.785   3.612
  246   1HG   GLU  30          1HG       GLU  30  -3.674 -15.333   1.269
  247   2HG   GLU  30          2HG       GLU  30  -2.036 -15.947   1.170
  248    H    ASN  31           H        ASN  31  -0.853 -11.854   4.156
  249    HA   ASN  31           HA       ASN  31  -3.087 -10.177   3.489
  250   1HB   ASN  31          1HB       ASN  31  -3.475 -11.631   5.712
  251   2HB   ASN  31          2HB       ASN  31  -2.406 -10.445   6.434
  252   1HD2  ASN  31          1HD2      ASN  31  -5.521 -11.209   5.951
  253   2HD2  ASN  31          2HD2      ASN  31  -6.282  -9.654   5.993
  254    HA   PRO  32           HA       PRO  32   1.034  -8.219   4.132
  255   1HB   PRO  32          1HB       PRO  32   1.461  -7.304   1.593
  256   2HB   PRO  32          2HB       PRO  32   2.105  -8.822   2.185
  257   1HG   PRO  32          1HG       PRO  32  -0.165  -8.363   0.348
  258   2HG   PRO  32          2HG       PRO  32   0.751  -9.833   0.615
  259   1HD   PRO  32          1HD       PRO  32  -1.871  -9.240   1.615
  260   2HD   PRO  32          2HD       PRO  32  -0.907 -10.658   1.976
  261    H    ILE  33           H        ILE  33   0.825  -6.442   5.326
  262    HA   ILE  33           HA       ILE  33  -1.001  -4.444   4.197
  263    HB   ILE  33           HB       ILE  33  -0.130  -5.023   7.026
  264   1HG1  ILE  33          1HG1      ILE  33  -2.937  -4.972   5.915
  265   2HG1  ILE  33          2HG1      ILE  33  -1.944  -6.413   5.828
  266   1HG2  ILE  33          1HG2      ILE  33  -1.827  -2.725   6.012
  267   2HG2  ILE  33          2HG2      ILE  33  -1.555  -3.153   7.718
  268   3HG2  ILE  33          3HG2      ILE  33  -0.194  -2.606   6.710
  269   1HD1  ILE  33          1HD1      ILE  33  -2.059  -6.804   8.093
  270   2HD1  ILE  33          2HD1      ILE  33  -2.011  -5.072   8.497
  271   3HD1  ILE  33          3HD1      ILE  33  -3.535  -5.818   7.960
  272    H    LEU  34           H        LEU  34   0.322  -3.293   2.798
  273    HA   LEU  34           HA       LEU  34   2.891  -2.401   3.827
  274   1HB   LEU  34          1HB       LEU  34   1.585  -2.349   1.113
  275   2HB   LEU  34          2HB       LEU  34   3.062  -1.471   1.459
  276    HG   LEU  34           HG       LEU  34   3.521  -3.604   0.370
  277   1HD1  LEU  34          1HD1      LEU  34   5.159  -4.513   1.999
  278   2HD1  LEU  34          2HD1      LEU  34   5.227  -2.742   1.836
  279   3HD1  LEU  34          3HD1      LEU  34   4.441  -3.476   3.254
  280   1HD2  LEU  34          1HD2      LEU  34   2.952  -5.716   1.235
  281   2HD2  LEU  34          2HD2      LEU  34   2.463  -5.039   2.807
  282   3HD2  LEU  34          3HD2      LEU  34   1.467  -4.742   1.361
  283    H    ARG  35           H        ARG  35   3.419  -0.236   4.220
  284    HA   ARG  35           HA       ARG  35   1.071   1.470   4.365
  285   1HB   ARG  35          1HB       ARG  35   2.155   2.634   6.191
  286   2HB   ARG  35          2HB       ARG  35   2.358   0.922   6.506
  287   1HG   ARG  35          1HG       ARG  35   4.636   1.172   5.220
  288   2HG   ARG  35          2HG       ARG  35   4.420   2.894   5.460
  289   1HD   ARG  35          1HD       ARG  35   4.074   2.349   7.976
  290   2HD   ARG  35          2HD       ARG  35   4.663   0.741   7.605
  291    HE   ARG  35           HE       ARG  35   6.260   3.157   7.799
  292   1HH1  ARG  35          2HH2      ARG  35   6.056   0.054   6.151
  293   2HH1  ARG  35          1HH2      ARG  35   7.759  -0.040   5.847
  294   1HH2  ARG  35          2HH1      ARG  35   8.506   3.033   7.398
  295   2HH2  ARG  35          1HH1      ARG  35   9.162   1.665   6.561
  296    H    ILE  36           H        ILE  36   1.203   3.666   3.568
  297    HA   ILE  36           HA       ILE  36   3.438   4.055   1.713
  298    HB   ILE  36           HB       ILE  36   0.546   4.624   1.641
  299   1HG1  ILE  36          1HG1      ILE  36   0.808   4.099  -0.691
  300   2HG1  ILE  36          2HG1      ILE  36   2.552   4.238  -0.594
  301   1HG2  ILE  36          1HG2      ILE  36   1.477   6.908   1.772
  302   2HG2  ILE  36          2HG2      ILE  36   2.502   6.553   0.361
  303   3HG2  ILE  36          3HG2      ILE  36   0.730   6.557   0.196
  304   1HD1  ILE  36          1HD1      ILE  36   0.948   2.219   1.036
  305   2HD1  ILE  36          2HD1      ILE  36   1.684   1.854  -0.544
  306   3HD1  ILE  36          3HD1      ILE  36   2.717   2.283   0.841
  307    H    ARG  37           H        ARG  37   5.005   5.424   2.353
  308    HA   ARG  37           HA       ARG  37   4.163   7.767   3.808
  309   1HB   ARG  37          1HB       ARG  37   5.451   5.554   5.078
  310   2HB   ARG  37          2HB       ARG  37   6.687   6.785   4.914
  311   1HG   ARG  37          1HG       ARG  37   4.815   8.421   5.834
  312   2HG   ARG  37          2HG       ARG  37   4.044   6.950   6.391
  313   1HD   ARG  37          1HD       ARG  37   6.960   7.142   7.010
  314   2HD   ARG  37          2HD       ARG  37   5.958   8.332   7.817
  315    HE   ARG  37           HE       ARG  37   4.836   5.639   7.974
  316   1HH1  ARG  37          2HH2      ARG  37   7.125   7.872   9.442
  317   2HH1  ARG  37          1HH2      ARG  37   7.088   7.093  10.989
  318   1HH2  ARG  37          2HH1      ARG  37   4.787   4.611  10.014
  319   2HH2  ARG  37          1HH1      ARG  37   5.750   5.226  11.317
  320    H    VAL  38           H        VAL  38   6.218   9.315   4.049
  321    HA   VAL  38           HA       VAL  38   7.349   9.500   1.416
  322    HB   VAL  38           HB       VAL  38   7.806  11.213   3.865
  323   1HG1  VAL  38          1HG1      VAL  38   9.254  11.272   1.609
  324   2HG1  VAL  38          2HG1      VAL  38   7.894  12.296   1.087
  325   3HG1  VAL  38          3HG1      VAL  38   8.843  12.742   2.526
  326   1HG2  VAL  38          1HG2      VAL  38   5.360  10.778   2.714
  327   2HG2  VAL  38          2HG2      VAL  38   5.836  12.266   3.567
  328   3HG2  VAL  38          3HG2      VAL  38   5.944  12.184   1.792
  329    H    VAL  39           H        VAL  39   9.603   9.464   0.896
  330    HA   VAL  39           HA       VAL  39  11.166   7.953   2.871
  331    HB   VAL  39           HB       VAL  39  11.361   8.053  -0.146
  332   1HG1  VAL  39          1HG1      VAL  39  13.034   6.296   0.053
  333   2HG1  VAL  39          2HG1      VAL  39  13.553   7.735   0.964
  334   3HG1  VAL  39          3HG1      VAL  39  12.892   6.325   1.827
  335   1HG2  VAL  39          1HG2      VAL  39  10.373   5.920  -0.216
  336   2HG2  VAL  39          2HG2      VAL  39  10.589   5.661   1.531
  337   3HG2  VAL  39          3HG2      VAL  39   9.378   6.828   0.948
  338    HA   PRO  40           HA       PRO  40  13.325  11.813   2.868
  339   1HB   PRO  40          1HB       PRO  40  14.432  11.544   5.352
  340   2HB   PRO  40          2HB       PRO  40  12.864  12.277   5.076
  341   1HG   PRO  40          1HG       PRO  40  13.494   9.600   6.162
  342   2HG   PRO  40          2HG       PRO  40  11.997  10.505   6.271
  343   1HD   PRO  40          1HD       PRO  40  12.541   8.289   4.533
  344   2HD   PRO  40          2HD       PRO  40  11.087   9.266   4.561
  345    H    GLY  41           H        GLY  41  14.321  10.245   1.099
  346   1HA   GLY  41          1HA       GLY  41  17.162  10.306   1.738
  347   2HA   GLY  41          2HA       GLY  41  16.479   8.727   1.409
  348    H    GLY  42           H        GLY  42  16.318  12.097   0.037
  349   1HA   GLY  42          1HA       GLY  42  17.326  11.272  -2.491
  350   2HA   GLY  42          2HA       GLY  42  15.581  11.424  -2.540
  351    H    CYS  43           H        CYS  43  18.651  13.119  -2.355
  352    HA   CYS  43           HA       CYS  43  17.729  15.614  -1.539
  353   1HB   CYS  43          1HB       CYS  43  20.179  14.487  -2.635
  354   2HB   CYS  43          2HB       CYS  43  19.867  16.077  -3.301
  355    HG   CYS  43           HG       CYS  43  19.604  15.268  -0.101
  356    H    SER  44           H        SER  44  18.110  14.053  -4.788
  357    HA   SER  44           HA       SER  44  16.714  16.324  -5.934
  358   1HB   SER  44          1HB       SER  44  18.546  14.191  -7.016
  359   2HB   SER  44          2HB       SER  44  17.376  14.900  -8.112
  360    HG   SER  44           HG       SER  44  18.505  16.945  -6.754
  361    H    GLY  45           H        GLY  45  16.673  12.712  -5.705
  362   1HA   GLY  45          1HA       GLY  45  14.163  12.487  -7.100
  363   2HA   GLY  45          2HA       GLY  45  15.073  11.214  -6.310
  364    H    PHE  46           H        PHE  46  12.265  11.366  -6.063
  365    HA   PHE  46           HA       PHE  46  12.037  11.418  -3.238
  366   1HB   PHE  46          1HB       PHE  46  10.314  13.244  -3.198
  367   2HB   PHE  46          2HB       PHE  46  11.839  13.866  -3.796
  368    HD1  PHE  46           1HD      PHE  46   8.377  13.158  -4.602
  369    HD2  PHE  46           2HD      PHE  46  12.123  14.334  -6.212
  370    HE1  PHE  46           1HE      PHE  46   7.227  13.987  -6.673
  371    HE2  PHE  46           2HE      PHE  46  10.973  15.163  -8.283
  372    HZ   PHE  46           HZ       PHE  46   8.538  14.979  -8.489
  373    H    GLN  47           H        GLN  47  10.981   9.492  -3.050
  374    HA   GLN  47           HA       GLN  47   8.403   9.311  -4.269
  375   1HB   GLN  47          1HB       GLN  47   9.047   6.903  -5.112
  376   2HB   GLN  47          2HB       GLN  47   9.418   8.295  -6.110
  377   1HG   GLN  47          1HG       GLN  47  11.435   7.219  -4.103
  378   2HG   GLN  47          2HG       GLN  47  11.304   6.533  -5.710
  379   1HE2  GLN  47          1HE2      GLN  47  12.982   8.631  -3.915
  380   2HE2  GLN  47          2HE2      GLN  47  13.520   9.775  -5.099
  381    H    TYR  48           H        TYR  48   7.034   7.745  -3.200
  382    HA   TYR  48           HA       TYR  48   7.895   7.198  -0.521
  383   1HB   TYR  48          1HB       TYR  48   5.436   6.743  -2.301
  384   2HB   TYR  48          2HB       TYR  48   5.475   6.081  -0.679
  385    HD1  TYR  48           1HD      TYR  48   6.333   9.387  -2.260
  386    HD2  TYR  48           2HD      TYR  48   4.279   7.313   0.867
  387    HE1  TYR  48           1HE      TYR  48   5.498  11.601  -1.331
  388    HE2  TYR  48           2HE      TYR  48   3.450   9.534   1.786
  389    HH   TYR  48           HH       TYR  48   4.515  12.589   0.349
  390    H    ALA  49           H        ALA  49   8.053   5.128   0.492
  391    HA   ALA  49           HA       ALA  49   8.324   2.904  -1.412
  392   1HB   ALA  49          1HB       ALA  49  10.544   3.660  -0.769
  393   2HB   ALA  49          2HB       ALA  49  10.093   3.643   0.953
  394   3HB   ALA  49          3HB       ALA  49  10.204   2.115   0.047
  395    H    MET  50           H        MET  50   7.704   0.816  -0.600
  396    HA   MET  50           HA       MET  50   5.903   1.076   1.667
  397   1HB   MET  50          1HB       MET  50   4.840  -0.987   0.719
  398   2HB   MET  50          2HB       MET  50   4.932   0.277  -0.492
  399   1HG   MET  50          1HG       MET  50   7.391  -1.092  -0.749
  400   2HG   MET  50          2HG       MET  50   6.224  -2.368  -0.463
  401   1HE   MET  50          1HE       MET  50   6.661  -3.334  -2.961
  402   2HE   MET  50          2HE       MET  50   5.055  -3.445  -2.201
  403   3HE   MET  50          3HE       MET  50   5.198  -3.002  -3.919
  404    H    GLY  51           H        GLY  51   5.641  -1.114   2.956
  405   1HA   GLY  51          1HA       GLY  51   7.739  -2.959   3.093
  406   2HA   GLY  51          2HA       GLY  51   8.098  -1.660   4.214
  407    H    PHE  52           H        PHE  52   6.700  -4.662   4.017
  408    HA   PHE  52           HA       PHE  52   4.318  -4.297   5.475
  409   1HB   PHE  52          1HB       PHE  52   4.747  -6.834   5.859
  410   2HB   PHE  52          2HB       PHE  52   4.703  -6.328   4.182
  411    HD1  PHE  52           1HD      PHE  52   6.911  -7.359   6.938
  412    HD2  PHE  52           2HD      PHE  52   6.659  -6.442   2.802
  413    HE1  PHE  52           1HE      PHE  52   9.191  -8.347   6.579
  414    HE2  PHE  52           2HE      PHE  52   8.938  -7.430   2.444
  415    HZ   PHE  52           HZ       PHE  52  10.177  -8.371   4.337
  416    H    ASP  53           H        ASP  53   4.101  -3.675   7.567
  417    HA   ASP  53           HA       ASP  53   6.398  -4.094   9.286
  418   1HB   ASP  53          1HB       ASP  53   4.628  -1.926   8.900
  419   2HB   ASP  53          2HB       ASP  53   4.132  -2.608  10.436
  420    H    ASP  54           H        ASP  54   5.526  -4.388  11.777
  421    HA   ASP  54           HA       ASP  54   4.587  -6.870  12.037
  422   1HB   ASP  54          1HB       ASP  54   4.728  -4.463  13.752
  423   2HB   ASP  54          2HB       ASP  54   3.473  -5.575  14.261
  424    H    THR  55           H        THR  55   2.655  -3.784  12.192
  425    HA   THR  55           HA       THR  55   0.414  -4.978  10.918
  426    HB   THR  55           HB       THR  55   0.481  -5.800  13.461
  427    HG1  THR  55           1HG      THR  55  -1.415  -6.252  12.366
  428   1HG2  THR  55          1HG2      THR  55  -1.225  -3.340  13.828
  429   2HG2  THR  55          2HG2      THR  55  -0.402  -4.332  15.056
  430   3HG2  THR  55          3HG2      THR  55   0.527  -3.166  14.085
  431    H    VAL  56           H        VAL  56  -1.601  -3.312  11.394
  432    HA   VAL  56           HA       VAL  56  -0.564  -0.855  10.357
  433    HB   VAL  56           HB       VAL  56  -2.652  -2.060   9.622
  434   1HG1  VAL  56          1HG1      VAL  56  -3.490  -1.228  12.375
  435   2HG1  VAL  56          2HG1      VAL  56  -4.698  -1.193  11.069
  436   3HG1  VAL  56          3HG1      VAL  56  -3.860  -2.712  11.466
  437   1HG2  VAL  56          1HG2      VAL  56  -2.015   0.443   9.277
  438   2HG2  VAL  56          2HG2      VAL  56  -3.673  -0.092   8.914
  439   3HG2  VAL  56          3HG2      VAL  56  -3.326   0.760  10.438
  440    H    GLU  57           H        GLU  57  -1.057   1.291  11.292
  441    HA   GLU  57           HA       GLU  57  -0.383   1.290  14.027
  442   1HB   GLU  57          1HB       GLU  57  -1.329   3.667  12.376
  443   2HB   GLU  57          2HB       GLU  57  -0.318   3.704  13.807
  444   1HG   GLU  57          1HG       GLU  57   1.439   2.385  12.548
  445   2HG   GLU  57          2HG       GLU  57   0.438   2.478  11.112
  446    H    GLU  58           H        GLU  58  -1.691   2.900  15.563
  447    HA   GLU  58           HA       GLU  58  -4.314   1.774  15.673
  448   1HB   GLU  58          1HB       GLU  58  -2.508   2.439  17.596
  449   2HB   GLU  58          2HB       GLU  58  -3.475   3.900  17.609
  450   1HG   GLU  58          1HG       GLU  58  -5.546   2.533  17.919
  451   2HG   GLU  58          2HG       GLU  58  -4.586   1.067  17.892
  452    H    GLY  59           H        GLY  59  -3.420   3.833  13.544
  453   1HA   GLY  59          1HA       GLY  59  -5.856   5.240  13.376
  454   2HA   GLY  59          2HA       GLY  59  -4.625   6.308  14.019
  455    H    ASP  60           H        ASP  60  -4.736   3.694  11.483
  456    HA   ASP  60           HA       ASP  60  -3.336   5.582   9.759
  457   1HB   ASP  60          1HB       ASP  60  -2.545   3.048  10.510
  458   2HB   ASP  60          2HB       ASP  60  -3.408   2.687   9.028
  459    H    HIS  61           H        HIS  61  -3.871   5.146   7.308
  460    HA   HIS  61           HA       HIS  61  -6.710   5.129   7.057
  461   1HB   HIS  61          1HB       HIS  61  -5.470   6.701   5.758
  462   2HB   HIS  61          2HB       HIS  61  -4.429   5.454   5.100
  463    HD1  HIS  61           1HD      HIS  61  -7.822   4.178   5.057
  464    HD2  HIS  61           2HD      HIS  61  -5.562   6.745   2.628
  465    HE1  HIS  61           1HE      HIS  61  -9.025   4.278   2.809
  466    H    VAL  62           H        VAL  62  -7.638   3.131   7.423
  467    HA   VAL  62           HA       VAL  62  -6.404   0.756   6.418
  468    HB   VAL  62           HB       VAL  62  -8.429   1.506   8.292
  469   1HG1  VAL  62          1HG1      VAL  62 -10.187   0.964   6.829
  470   2HG1  VAL  62          2HG1      VAL  62  -9.311  -0.422   6.139
  471   3HG1  VAL  62          3HG1      VAL  62  -9.954  -0.512   7.796
  472   1HG2  VAL  62          1HG2      VAL  62  -6.876  -1.001   7.642
  473   2HG2  VAL  62          2HG2      VAL  62  -6.688   0.113   9.018
  474   3HG2  VAL  62          3HG2      VAL  62  -8.096  -0.973   8.937
  475    H    PHE  63           H        PHE  63  -6.274   0.629   4.204
  476    HA   PHE  63           HA       PHE  63  -8.803   1.041   2.770
  477   1HB   PHE  63          1HB       PHE  63  -6.266   2.256   2.491
  478   2HB   PHE  63          2HB       PHE  63  -6.214   0.993   1.277
  479    HD1  PHE  63           1HD      PHE  63  -6.185   4.021   0.841
  480    HD2  PHE  63           2HD      PHE  63  -9.320   1.161   0.787
  481    HE1  PHE  63           1HE      PHE  63  -7.489   5.480  -0.732
  482    HE2  PHE  63           2HE      PHE  63 -10.624   2.620  -0.786
  483    HZ   PHE  63           HZ       PHE  63  -9.693   4.761  -1.526
  484    H    GLU  64           H        GLU  64  -9.715  -0.895   2.265
  485    HA   GLU  64           HA       GLU  64  -8.067  -3.209   2.109
  486   1HB   GLU  64          1HB       GLU  64 -11.046  -2.817   1.580
  487   2HB   GLU  64          2HB       GLU  64 -10.247  -4.375   1.645
  488   1HG   GLU  64          1HG       GLU  64  -9.463  -3.780   4.006
  489   2HG   GLU  64          2HG       GLU  64 -10.470  -2.349   3.918
  490    H    TYR  65           H        TYR  65  -7.177  -4.114   0.290
  491    HA   TYR  65           HA       TYR  65  -8.048  -2.979  -2.280
  492   1HB   TYR  65          1HB       TYR  65  -5.465  -3.789  -0.938
  493   2HB   TYR  65          2HB       TYR  65  -5.572  -4.212  -2.635
  494    HD1  TYR  65           1HD      TYR  65  -6.274  -2.265  -4.265
  495    HD2  TYR  65           2HD      TYR  65  -4.717  -1.662  -0.326
  496    HE1  TYR  65           1HE      TYR  65  -5.587   0.102  -4.891
  497    HE2  TYR  65           2HE      TYR  65  -4.035   0.703  -0.965
  498    HH   TYR  65           HH       TYR  65  -3.638   1.727  -3.911
  499    H    ASP  66           H        ASP  66  -6.701  -4.868  -3.929
  500    HA   ASP  66           HA       ASP  66  -8.653  -6.823  -4.057
  501   1HB   ASP  66          1HB       ASP  66  -6.948  -5.916  -5.847
  502   2HB   ASP  66          2HB       ASP  66  -5.865  -7.143  -5.222
  503    H    GLY  67           H        GLY  67  -8.419  -7.497  -1.643
  504   1HA   GLY  67          1HA       GLY  67  -8.029  -9.398  -0.405
  505   2HA   GLY  67          2HA       GLY  67  -6.750  -9.879  -1.503
  506    H    VAL  68           H        VAL  68  -5.485  -7.120  -1.446
  507    HA   VAL  68           HA       VAL  68  -4.081  -7.517   1.078
  508    HB   VAL  68           HB       VAL  68  -3.254  -5.592  -1.059
  509   1HG1  VAL  68          1HG1      VAL  68  -1.916  -7.246   1.071
  510   2HG1  VAL  68          2HG1      VAL  68  -0.987  -6.668  -0.333
  511   3HG1  VAL  68          3HG1      VAL  68  -1.791  -5.501   0.745
  512   1HG2  VAL  68          1HG2      VAL  68  -3.369  -7.224  -2.609
  513   2HG2  VAL  68          2HG2      VAL  68  -1.927  -7.874  -1.792
  514   3HG2  VAL  68          3HG2      VAL  68  -3.540  -8.510  -1.390
  515    H    LYS  69           H        LYS  69  -3.220  -5.279   2.021
  516    HA   LYS  69           HA       LYS  69  -5.304  -3.255   1.839
  517   1HB   LYS  69          1HB       LYS  69  -5.922  -4.874   3.670
  518   2HB   LYS  69          2HB       LYS  69  -4.449  -4.419   4.503
  519   1HG   LYS  69          1HG       LYS  69  -5.579  -1.941   3.859
  520   2HG   LYS  69          2HG       LYS  69  -6.986  -2.922   4.220
  521   1HD   LYS  69          1HD       LYS  69  -4.616  -3.050   6.094
  522   2HD   LYS  69          2HD       LYS  69  -5.663  -1.646   6.163
  523   1HE   LYS  69          1HE       LYS  69  -6.768  -3.021   7.681
  524   2HE   LYS  69          2HE       LYS  69  -7.609  -3.481   6.213
  525   1HZ   LYS  69          1HZ       LYS  69  -6.586  -5.465   6.173
  526   2HZ   LYS  69          2HZ       LYS  69  -5.183  -4.925   6.811
  527   3HZ   LYS  69          3HZ       LYS  69  -6.461  -5.221   7.783
  528    H    VAL  70           H        VAL  70  -4.574  -1.143   2.426
  529    HA   VAL  70           HA       VAL  70  -1.671  -0.999   2.855
  530    HB   VAL  70           HB       VAL  70  -3.425   0.603   0.989
  531   1HG1  VAL  70          1HG1      VAL  70  -1.919   2.139   2.139
  532   2HG1  VAL  70          2HG1      VAL  70  -0.529   1.092   1.765
  533   3HG1  VAL  70          3HG1      VAL  70  -1.401   1.917   0.451
  534   1HG2  VAL  70          1HG2      VAL  70  -0.879  -0.626   0.085
  535   2HG2  VAL  70          2HG2      VAL  70  -2.189  -1.757   0.500
  536   3HG2  VAL  70          3HG2      VAL  70  -2.454  -0.504  -0.736
  537    H    VAL  71           H        VAL  71  -0.983   1.104   3.873
  538    HA   VAL  71           HA       VAL  71  -3.110   2.465   5.305
  539    HB   VAL  71           HB       VAL  71  -2.384   1.968   7.437
  540   1HG1  VAL  71          1HG1      VAL  71  -2.106  -0.543   7.544
  541   2HG1  VAL  71          2HG1      VAL  71  -3.505   0.030   6.606
  542   3HG1  VAL  71          3HG1      VAL  71  -2.042  -0.538   5.765
  543   1HG2  VAL  71          1HG2      VAL  71  -0.191   0.666   7.824
  544   2HG2  VAL  71          2HG2      VAL  71   0.226   1.143   6.160
  545   3HG2  VAL  71          3HG2      VAL  71  -0.075   2.389   7.394
  546    H    ILE  72           H        ILE  72  -2.743   4.546   4.736
  547    HA   ILE  72           HA       ILE  72   0.021   5.364   4.306
  548    HB   ILE  72           HB       ILE  72  -2.453   6.985   3.766
  549   1HG1  ILE  72          1HG1      ILE  72  -1.511   5.734   1.377
  550   2HG1  ILE  72          2HG1      ILE  72  -1.791   4.475   2.563
  551   1HG2  ILE  72          1HG2      ILE  72  -0.460   7.377   1.822
  552   2HG2  ILE  72          2HG2      ILE  72  -0.954   8.488   3.122
  553   3HG2  ILE  72          3HG2      ILE  72   0.383   7.344   3.389
  554   1HD1  ILE  72          1HD1      ILE  72  -3.861   4.914   1.310
  555   2HD1  ILE  72          2HD1      ILE  72  -4.075   5.410   3.006
  556   3HD1  ILE  72          3HD1      ILE  72  -3.787   6.638   1.749
  557    H    ASP  73           H        ASP  73   0.863   7.325   5.304
  558    HA   ASP  73           HA       ASP  73   0.161   7.406   8.027
  559   1HB   ASP  73          1HB       ASP  73   2.243   8.475   6.258
  560   2HB   ASP  73          2HB       ASP  73   1.736   9.689   7.416
  561    HA   PRO  74           HA       PRO  74  -2.577  10.828   7.868
  562   1HB   PRO  74          1HB       PRO  74  -2.206  12.019  10.299
  563   2HB   PRO  74          2HB       PRO  74  -3.180  10.580  10.076
  564   1HG   PRO  74          1HG       PRO  74  -0.472  10.822  11.236
  565   2HG   PRO  74          2HG       PRO  74  -1.617   9.504  11.387
  566   1HD   PRO  74          1HD       PRO  74   0.713   9.571   9.715
  567   2HD   PRO  74          2HD       PRO  74  -0.495   8.303   9.780
  568    H    PHE  75           H        PHE  75   0.758  11.450   8.395
  569    HA   PHE  75           HA       PHE  75   0.383  14.263   7.807
  570   1HB   PHE  75          1HB       PHE  75   2.117  12.775   9.380
  571   2HB   PHE  75          2HB       PHE  75   3.078  12.902   7.920
  572    HD1  PHE  75           1HD      PHE  75   1.830  14.640  10.831
  573    HD2  PHE  75           2HD      PHE  75   3.738  15.156   7.076
  574    HE1  PHE  75           1HE      PHE  75   2.589  16.928  11.531
  575    HE2  PHE  75           2HE      PHE  75   4.498  17.443   7.776
  576    HZ   PHE  75           HZ       PHE  75   3.914  18.302   9.995
  577    H    SER  76           H        SER  76   1.415  11.227   6.266
  578    HA   SER  76           HA       SER  76   2.485  12.669   4.022
  579   1HB   SER  76          1HB       SER  76   3.487  10.683   3.414
  580   2HB   SER  76          2HB       SER  76   3.261  10.349   5.119
  581    HG   SER  76           HG       SER  76   1.031   9.484   4.278
  582    H    MET  77           H        MET  77  -0.521  11.304   5.128
  583    HA   MET  77           HA       MET  77  -1.637  10.473   2.759
  584   1HB   MET  77          1HB       MET  77  -2.484  11.203   5.482
  585   2HB   MET  77          2HB       MET  77  -3.694  11.705   4.318
  586   1HG   MET  77          1HG       MET  77  -2.558   8.888   4.651
  587   2HG   MET  77          2HG       MET  77  -4.181   9.411   5.054
  588   1HE   MET  77          1HE       MET  77  -5.611  10.781   3.223
  589   2HE   MET  77          2HE       MET  77  -4.288  11.552   2.315
  590   3HE   MET  77          3HE       MET  77  -5.466  10.521   1.468
  591    HA   PRO  78           HA       PRO  78  -3.099  14.958   2.217
  592   1HB   PRO  78          1HB       PRO  78  -2.022  16.935   3.764
  593   2HB   PRO  78          2HB       PRO  78  -3.546  16.153   4.133
  594   1HG   PRO  78          1HG       PRO  78  -0.914  15.787   5.428
  595   2HG   PRO  78          2HG       PRO  78  -2.503  15.358   6.030
  596   1HD   PRO  78          1HD       PRO  78  -0.545  13.573   4.932
  597   2HD   PRO  78          2HD       PRO  78  -2.176  13.164   5.425
  598    H    TYR  79           H        TYR  79  -0.121  13.710   2.219
  599    HA   TYR  79           HA       TYR  79   1.027  15.946   0.725
  600   1HB   TYR  79          1HB       TYR  79   1.937  14.116   2.664
  601   2HB   TYR  79          2HB       TYR  79   2.487  13.360   1.181
  602    HD1  TYR  79           1HD      TYR  79   4.137  14.505  -0.278
  603    HD2  TYR  79           2HD      TYR  79   2.944  16.159   3.483
  604    HE1  TYR  79           1HE      TYR  79   6.155  16.051  -0.310
  605    HE2  TYR  79           2HE      TYR  79   4.966  17.699   3.438
  606    HH   TYR  79           HH       TYR  79   6.540  18.532   0.936
  607    H    VAL  80           H        VAL  80  -0.567  12.882   0.305
  608    HA   VAL  80           HA       VAL  80   0.137  12.987  -2.532
  609    HB   VAL  80           HB       VAL  80   0.750  10.787  -2.665
  610   1HG1  VAL  80          1HG1      VAL  80   2.579  10.553  -1.289
  611   2HG1  VAL  80          2HG1      VAL  80   2.208  12.275  -1.028
  612   3HG1  VAL  80          3HG1      VAL  80   1.690  11.061   0.167
  613   1HG2  VAL  80          1HG2      VAL  80  -1.027  10.418  -0.300
  614   2HG2  VAL  80          2HG2      VAL  80  -0.880   9.455  -1.790
  615   3HG2  VAL  80          3HG2      VAL  80   0.323   9.274  -0.491
  616    H    ASN  81           H        ASN  81  -2.150  14.054  -1.074
  617    HA   ASN  81           HA       ASN  81  -4.290  12.493  -0.817
  618   1HB   ASN  81          1HB       ASN  81  -4.501  14.858  -0.383
  619   2HB   ASN  81          2HB       ASN  81  -4.010  15.285  -2.011
  620   1HD2  ASN  81          1HD2      ASN  81  -6.558  14.032   0.016
  621   2HD2  ASN  81          2HD2      ASN  81  -7.878  14.230  -1.089
  622    H    GLY  82           H        GLY  82  -5.594  11.247  -2.203
  623   1HA   GLY  82          1HA       GLY  82  -6.110  10.114  -4.091
  624   2HA   GLY  82          2HA       GLY  82  -6.397  11.719  -4.732
  625    H    ALA  83           H        ALA  83  -3.138  10.769  -3.680
  626    HA   ALA  83           HA       ALA  83  -2.130  11.285  -6.301
  627   1HB   ALA  83          1HB       ALA  83  -0.993  11.895  -4.142
  628   2HB   ALA  83          2HB       ALA  83  -0.722  10.161  -3.847
  629   3HB   ALA  83          3HB       ALA  83   0.032  10.953  -5.251
  630    H    GLU  84           H        GLU  84  -0.841   9.743  -7.578
  631    HA   GLU  84           HA       GLU  84  -1.849   7.035  -7.174
  632   1HB   GLU  84          1HB       GLU  84  -1.310   8.649  -9.677
  633   2HB   GLU  84          2HB       GLU  84  -1.256   6.899  -9.747
  634   1HG   GLU  84          1HG       GLU  84  -3.533   6.673  -9.447
  635   2HG   GLU  84          2HG       GLU  84  -3.628   8.012  -8.320
  636    H    LEU  85           H        LEU  85  -0.262   5.820  -6.223
  637    HA   LEU  85           HA       LEU  85   2.503   6.459  -6.763
  638   1HB   LEU  85          1HB       LEU  85   2.365   5.992  -4.571
  639   2HB   LEU  85          2HB       LEU  85   0.971   4.946  -4.754
  640    HG   LEU  85           HG       LEU  85   2.537   3.182  -5.684
  641   1HD1  LEU  85          1HD1      LEU  85   4.938   3.978  -4.444
  642   2HD1  LEU  85          2HD1      LEU  85   4.623   3.746  -6.181
  643   3HD1  LEU  85          3HD1      LEU  85   4.412   5.353  -5.445
  644   1HD2  LEU  85          1HD2      LEU  85   2.498   2.285  -3.648
  645   2HD2  LEU  85          2HD2      LEU  85   3.590   3.528  -2.993
  646   3HD2  LEU  85          3HD2      LEU  85   1.839   3.835  -3.074
  647    H    ASP  86           H        ASP  86   3.310   5.793  -8.690
  648    HA   ASP  86           HA       ASP  86   2.342   3.268  -9.715
  649   1HB   ASP  86          1HB       ASP  86   2.616   5.526 -11.053
  650   2HB   ASP  86          2HB       ASP  86   4.319   5.116 -11.094
  651    H    TYR  87           H        TYR  87   3.544   1.537  -8.876
  652    HA   TYR  87           HA       TYR  87   6.332   1.932  -8.218
  653   1HB   TYR  87          1HB       TYR  87   4.347   0.567  -7.038
  654   2HB   TYR  87          2HB       TYR  87   4.680  -0.650  -8.255
  655    HD1  TYR  87           1HD      TYR  87   5.853   0.931  -5.178
  656    HD2  TYR  87           2HD      TYR  87   6.846  -1.863  -8.262
  657    HE1  TYR  87           1HE      TYR  87   7.708  -0.025  -3.725
  658    HE2  TYR  87           2HE      TYR  87   8.698  -2.809  -6.800
  659    HH   TYR  87           HH       TYR  87   9.315  -2.951  -4.549
  660    H    VAL  88           H        VAL  88   7.849   1.803  -9.799
  661    HA   VAL  88           HA       VAL  88   7.328   0.541 -12.268
  662    HB   VAL  88           HB       VAL  88   9.867   1.535 -10.962
  663   1HG1  VAL  88          1HG1      VAL  88   9.343   0.433 -13.722
  664   2HG1  VAL  88          2HG1      VAL  88  10.637   1.621 -13.432
  665   3HG1  VAL  88          3HG1      VAL  88  10.662   0.053 -12.590
  666   1HG2  VAL  88          1HG2      VAL  88   7.787   3.057 -11.654
  667   2HG2  VAL  88          2HG2      VAL  88   9.470   3.587 -11.891
  668   3HG2  VAL  88          3HG2      VAL  88   8.547   2.918 -13.258
  669    H    VAL  89           H        VAL  89   8.246  -1.398 -13.152
  670    HA   VAL  89           HA       VAL  89   9.285  -3.237 -11.115
  671    HB   VAL  89           HB       VAL  89   7.339  -3.957 -13.311
  672   1HG1  VAL  89          1HG1      VAL  89   7.157  -5.889 -11.380
  673   2HG1  VAL  89          2HG1      VAL  89   8.169  -6.000 -12.840
  674   3HG1  VAL  89          3HG1      VAL  89   8.884  -5.468 -11.299
  675   1HG2  VAL  89          1HG2      VAL  89   6.115  -4.289 -10.787
  676   2HG2  VAL  89          2HG2      VAL  89   6.835  -2.662 -10.780
  677   3HG2  VAL  89          3HG2      VAL  89   5.690  -3.122 -12.062
  678    H    ASP  90           H        ASP  90  11.292  -3.913 -11.646
  679    HA   ASP  90           HA       ASP  90  11.835  -4.721 -14.295
  680   1HB   ASP  90          1HB       ASP  90  13.263  -2.263 -13.177
  681   2HB   ASP  90          2HB       ASP  90  13.804  -3.148 -14.590
  682    H    PHE  91           H        PHE  91  14.573  -4.960 -14.284
  683    HA   PHE  91           HA       PHE  91  16.029  -6.464 -13.467
  684   1HB   PHE  91          1HB       PHE  91  16.268  -3.955 -12.451
  685   2HB   PHE  91          2HB       PHE  91  15.920  -4.769 -10.938
  686    HD1  PHE  91           1HD      PHE  91  17.850  -4.991  -9.706
  687    HD2  PHE  91           2HD      PHE  91  18.027  -5.687 -13.889
  688    HE1  PHE  91           1HE      PHE  91  20.267  -5.634  -9.497
  689    HE2  PHE  91           2HE      PHE  91  20.444  -6.330 -13.679
  690    HZ   PHE  91           HZ       PHE  91  21.536  -6.295 -11.486
  691    H    MET  92           H        MET  92  16.447  -6.537 -10.356
  692    HA   MET  92           HA       MET  92  14.684  -8.794 -10.028
  693   1HB   MET  92          1HB       MET  92  17.324  -7.925  -9.068
  694   2HB   MET  92          2HB       MET  92  16.322  -8.405  -7.712
  695   1HG   MET  92          1HG       MET  92  15.778 -10.454  -9.468
  696   2HG   MET  92          2HG       MET  92  17.421 -10.069  -9.940
  697   1HE   MET  92          1HE       MET  92  19.008 -12.525  -7.742
  698   2HE   MET  92          2HE       MET  92  18.389 -12.150  -9.368
  699   3HE   MET  92          3HE       MET  92  19.521 -11.033  -8.568
  700    H    GLY  93           H        GLY  93  13.729  -5.905  -9.910
  701   1HA   GLY  93          1HA       GLY  93  12.035  -6.197  -7.633
  702   2HA   GLY  93          2HA       GLY  93  13.272  -4.987  -7.354
  703    H    GLY  94           H        GLY  94  13.226  -2.989  -8.467
  704   1HA   GLY  94          1HA       GLY  94  11.948  -2.311 -10.761
  705   2HA   GLY  94          2HA       GLY  94  10.660  -2.283  -9.573
  706    H    GLY  95           H        GLY  95  10.270  -0.153  -9.096
  707   1HA   GLY  95          1HA       GLY  95  12.215   1.344  -7.662
  708   2HA   GLY  95          2HA       GLY  95  12.067   1.939  -9.303
  709    H    PHE  96           H        PHE  96  11.204   3.002  -6.518
  710    HA   PHE  96           HA       PHE  96   8.344   3.049  -6.701
  711   1HB   PHE  96          1HB       PHE  96  10.138   4.915  -5.078
  712   2HB   PHE  96          2HB       PHE  96   8.577   4.264  -4.617
  713    HD1  PHE  96           1HD      PHE  96  12.151   3.738  -4.602
  714    HD2  PHE  96           2HD      PHE  96   8.400   1.874  -3.919
  715    HE1  PHE  96           1HE      PHE  96  13.293   1.908  -3.318
  716    HE2  PHE  96           2HE      PHE  96   9.542   0.045  -2.636
  717    HZ   PHE  96           HZ       PHE  96  11.975   0.083  -2.350
  718    H    THR  97           H        THR  97   7.014   4.790  -7.310
  719    HA   THR  97           HA       THR  97   8.264   7.267  -8.142
  720    HB   THR  97           HB       THR  97   7.317   5.121 -10.015
  721    HG1  THR  97           1HG      THR  97   9.535   6.063  -9.730
  722   1HG2  THR  97          1HG2      THR  97   7.053   7.227 -11.669
  723   2HG2  THR  97          2HG2      THR  97   5.645   6.578 -10.795
  724   3HG2  THR  97          3HG2      THR  97   6.484   8.024 -10.183
  725    H    ILE  98           H        ILE  98   7.002   8.962  -7.652
  726    HA   ILE  98           HA       ILE  98   4.134   8.429  -7.384
  727    HB   ILE  98           HB       ILE  98   5.358   8.338  -5.181
  728   1HG1  ILE  98          1HG1      ILE  98   3.629  10.369  -4.398
  729   2HG1  ILE  98          2HG1      ILE  98   2.940   9.816  -5.912
  730   1HG2  ILE  98          1HG2      ILE  98   6.902  10.270  -5.831
  731   2HG2  ILE  98          2HG2      ILE  98   5.541  11.340  -5.417
  732   3HG2  ILE  98          3HG2      ILE  98   6.238  10.267  -4.180
  733   1HD1  ILE  98          1HD1      ILE  98   2.945   8.496  -3.321
  734   2HD1  ILE  98          2HD1      ILE  98   2.066   8.048  -4.802
  735   3HD1  ILE  98          3HD1      ILE  98   3.722   7.453  -4.536
  736    H    ARG  99           H        ARG  99   2.917   9.860  -8.507
  737    HA   ARG  99           HA       ARG  99   4.300  12.287  -9.325
  738   1HB   ARG  99          1HB       ARG  99   2.928  10.280 -10.859
  739   2HB   ARG  99          2HB       ARG  99   1.948  11.730 -10.944
  740   1HG   ARG  99          1HG       ARG  99   4.068  13.023 -11.561
  741   2HG   ARG  99          2HG       ARG  99   4.904  11.487 -11.665
  742   1HD   ARG  99          1HD       ARG  99   2.940  10.798 -13.295
  743   2HD   ARG  99          2HD       ARG  99   2.645  12.521 -13.412
  744    HE   ARG  99           HE       ARG  99   4.649  12.779 -14.621
  745   1HH1  ARG  99          2HH2      ARG  99   4.524   9.568 -13.187
  746   2HH1  ARG  99          1HH2      ARG  99   5.898   8.983 -14.066
  747   1HH2  ARG  99          2HH1      ARG  99   6.461  12.008 -15.781
  748   2HH2  ARG  99          1HH1      ARG  99   7.006  10.380 -15.551
  749    H    ASN 100           H        ASN 100   3.361  14.255  -8.759
  750    HA   ASN 100           HA       ASN 100   0.581  14.165  -7.929
  751   1HB   ASN 100          1HB       ASN 100   1.088  15.559  -5.945
  752   2HB   ASN 100          2HB       ASN 100   2.012  14.071  -5.869
  753   1HD2  ASN 100          1HD2      ASN 100   4.177  14.103  -5.886
  754   2HD2  ASN 100          2HD2      ASN 100   5.162  15.526  -5.962
  755    HA   PRO 101           HA       PRO 101   0.660  17.844 -10.331
  756   1HB   PRO 101          1HB       PRO 101  -1.814  18.848  -9.746
  757   2HB   PRO 101          2HB       PRO 101  -1.548  17.589 -10.935
  758   1HG   PRO 101          1HG       PRO 101  -2.660  17.356  -8.206
  759   2HG   PRO 101          2HG       PRO 101  -2.776  16.224  -9.539
  760   1HD   PRO 101          1HD       PRO 101  -1.060  16.011  -7.251
  761   2HD   PRO 101          2HD       PRO 101  -1.094  14.942  -8.639
  Start of MODEL   13
    1    H    MET   1           H        MET   1 -22.167   8.266  12.605
    2    HA   MET   1           HA       MET   1 -22.548   8.324  14.744
    3   1HB   MET   1          1HB       MET   1 -22.783   5.462  13.994
    4   2HB   MET   1          2HB       MET   1 -22.411   5.663  15.695
    5   1HG   MET   1          1HG       MET   1 -24.368   7.075  16.044
    6   2HG   MET   1          2HG       MET   1 -24.662   7.200  14.321
    7   1HE   MET   1          1HE       MET   1 -26.546   4.856  17.180
    8   2HE   MET   1          2HE       MET   1 -26.271   6.557  16.735
    9   3HE   MET   1          3HE       MET   1 -27.501   5.600  15.875
   10    H    GLN   2           H        GLN   2 -20.343   9.358  14.890
   11    HA   GLN   2           HA       GLN   2 -18.382   9.614  15.793
   12   1HB   GLN   2          1HB       GLN   2 -20.015   8.425  17.759
   13   2HB   GLN   2          2HB       GLN   2 -18.501   7.552  17.877
   14   1HG   GLN   2          1HG       GLN   2 -17.374   9.364  18.706
   15   2HG   GLN   2          2HG       GLN   2 -18.114  10.469  17.565
   16   1HE2  GLN   2          1HE2      GLN   2 -17.990   9.397  20.742
   17   2HE2  GLN   2          2HE2      GLN   2 -19.385  10.194  21.390
   18    H    GLU   3           H        GLU   3 -17.357   8.711  13.839
   19    HA   GLU   3           HA       GLU   3 -15.840   6.357  14.551
   20   1HB   GLU   3          1HB       GLU   3 -17.936   6.393  12.537
   21   2HB   GLU   3          2HB       GLU   3 -16.392   6.089  11.766
   22   1HG   GLU   3          1HG       GLU   3 -15.941   4.262  13.441
   23   2HG   GLU   3          2HG       GLU   3 -17.517   4.547  14.153
   24    H    GLN   4           H        GLN   4 -13.832   6.133  13.218
   25    HA   GLN   4           HA       GLN   4 -12.979   8.780  12.393
   26   1HB   GLN   4          1HB       GLN   4 -11.776   6.745  13.960
   27   2HB   GLN   4          2HB       GLN   4 -10.863   6.769  12.465
   28   1HG   GLN   4          1HG       GLN   4 -11.503   9.463  13.575
   29   2HG   GLN   4          2HG       GLN   4 -10.442   8.493  14.578
   30   1HE2  GLN   4          1HE2      GLN   4 -10.211  10.895  12.662
   31   2HE2  GLN   4          2HE2      GLN   4  -8.806  10.557  11.707
   32    H    ALA   5           H        ALA   5 -12.619   9.262  10.259
   33    HA   ALA   5           HA       ALA   5 -13.400   7.555   8.241
   34   1HB   ALA   5          1HB       ALA   5 -12.345  10.202   8.553
   35   2HB   ALA   5          2HB       ALA   5 -11.437   9.396   7.251
   36   3HB   ALA   5          3HB       ALA   5 -13.211   9.513   7.159
   37    H    GLN   6           H        GLN   6 -12.518   5.721   7.437
   38    HA   GLN   6           HA       GLN   6  -9.619   5.492   7.667
   39   1HB   GLN   6          1HB       GLN   6 -11.529   3.894   8.974
   40   2HB   GLN   6          2HB       GLN   6 -11.035   2.916   7.606
   41   1HG   GLN   6          1HG       GLN   6  -9.107   2.392   8.672
   42   2HG   GLN   6          2HG       GLN   6  -8.644   4.082   8.673
   43   1HE2  GLN   6          1HE2      GLN   6 -11.120   2.096  10.300
   44   2HE2  GLN   6          2HE2      GLN   6 -10.788   2.615  11.919
   45    H    GLN   7           H        GLN   7 -10.965   6.642   5.430
   46    HA   GLN   7           HA       GLN   7 -10.558   4.506   3.486
   47   1HB   GLN   7          1HB       GLN   7 -12.270   5.612   2.047
   48   2HB   GLN   7          2HB       GLN   7 -12.941   5.043   3.563
   49   1HG   GLN   7          1HG       GLN   7 -12.386   7.486   4.428
   50   2HG   GLN   7          2HG       GLN   7 -12.319   7.890   2.724
   51   1HE2  GLN   7          1HE2      GLN   7 -14.327   6.149   5.088
   52   2HE2  GLN   7          2HE2      GLN   7 -15.870   6.618   4.459
   53    H    PHE   8           H        PHE   8  -8.481   4.953   2.780
   54    HA   PHE   8           HA       PHE   8  -7.712   7.708   2.379
   55   1HB   PHE   8          1HB       PHE   8  -6.321   5.702   3.349
   56   2HB   PHE   8          2HB       PHE   8  -6.253   5.089   1.709
   57    HD1  PHE   8           1HD      PHE   8  -5.190   6.582  -0.076
   58    HD2  PHE   8           2HD      PHE   8  -4.779   7.305   4.085
   59    HE1  PHE   8           1HE      PHE   8  -3.170   8.002  -0.523
   60    HE2  PHE   8           2HE      PHE   8  -2.758   8.725   3.638
   61    HZ   PHE   8           HZ       PHE   8  -1.977   9.057   1.339
   62    H    ILE   9           H        ILE   9  -7.844   8.780   0.464
   63    HA   ILE   9           HA       ILE   9  -8.724   7.288  -1.847
   64    HB   ILE   9           HB       ILE   9  -8.306  10.238  -1.354
   65   1HG1  ILE   9          1HG1      ILE   9 -10.102   9.319  -0.003
   66   2HG1  ILE   9          2HG1      ILE   9 -10.753  10.337  -1.272
   67   1HG2  ILE   9          1HG2      ILE   9  -8.837   8.720  -3.815
   68   2HG2  ILE   9          2HG2      ILE   9  -9.989  10.041  -3.503
   69   3HG2  ILE   9          3HG2      ILE   9  -8.244  10.383  -3.587
   70   1HD1  ILE   9          1HD1      ILE   9 -11.019   8.159  -2.663
   71   2HD1  ILE   9          2HD1      ILE   9 -10.741   7.302  -1.128
   72   3HD1  ILE   9          3HD1      ILE   9 -12.134   8.398  -1.296
   73    H    PHE  10           H        PHE  10  -7.238   6.229  -3.046
   74    HA   PHE  10           HA       PHE  10  -5.020   7.717  -4.071
   75   1HB   PHE  10          1HB       PHE  10  -4.136   6.921  -1.875
   76   2HB   PHE  10          2HB       PHE  10  -4.735   5.304  -2.186
   77    HD1  PHE  10           1HD      PHE  10  -2.862   7.568  -4.472
   78    HD2  PHE  10           2HD      PHE  10  -2.822   3.979  -2.209
   79    HE1  PHE  10           1HE      PHE  10  -0.656   6.947  -5.495
   80    HE2  PHE  10           2HE      PHE  10  -0.616   3.358  -3.232
   81    HZ   PHE  10           HZ       PHE  10   0.441   4.850  -4.863
   82    H    LYS  11           H        LYS  11  -4.067   6.698  -5.929
   83    HA   LYS  11           HA       LYS  11  -5.361   4.191  -6.721
   84   1HB   LYS  11          1HB       LYS  11  -5.004   6.573  -8.561
   85   2HB   LYS  11          2HB       LYS  11  -5.751   5.038  -8.953
   86   1HG   LYS  11          1HG       LYS  11  -6.829   6.627  -6.615
   87   2HG   LYS  11          2HG       LYS  11  -7.239   7.135  -8.241
   88   1HD   LYS  11          1HD       LYS  11  -8.768   5.471  -8.439
   89   2HD   LYS  11          2HD       LYS  11  -7.564   4.257  -8.056
   90   1HE   LYS  11          1HE       LYS  11  -8.230   4.094  -5.864
   91   2HE   LYS  11          2HE       LYS  11  -8.443   5.825  -5.694
   92   1HZ   LYS  11          1HZ       LYS  11 -10.353   3.838  -6.435
   93   2HZ   LYS  11          2HZ       LYS  11 -10.586   5.301  -5.748
   94   3HZ   LYS  11          3HZ       LYS  11 -10.414   5.178  -7.367
   95    H    VAL  12           H        VAL  12  -3.731   2.735  -6.759
   96    HA   VAL  12           HA       VAL  12  -1.174   3.667  -7.871
   97    HB   VAL  12           HB       VAL  12  -1.404   2.918  -5.404
   98   1HG1  VAL  12          1HG1      VAL  12  -2.496   0.654  -6.556
   99   2HG1  VAL  12          2HG1      VAL  12  -0.829   0.150  -6.187
  100   3HG1  VAL  12          3HG1      VAL  12  -1.875   0.784  -4.893
  101   1HG2  VAL  12          1HG2      VAL  12   0.691   2.038  -7.382
  102   2HG2  VAL  12          2HG2      VAL  12   0.761   3.325  -6.154
  103   3HG2  VAL  12          3HG2      VAL  12   0.841   1.617  -5.659
  104    H    THR  13           H        THR  13  -0.086   2.287  -9.376
  105    HA   THR  13           HA       THR  13  -1.825   0.929 -11.128
  106    HB   THR  13           HB       THR  13   0.466   0.274 -12.152
  107    HG1  THR  13           1HG      THR  13   2.211   0.847 -10.871
  108   1HG2  THR  13          1HG2      THR  13  -0.289   2.304 -13.097
  109   2HG2  THR  13          2HG2      THR  13  -0.379   3.117 -11.516
  110   3HG2  THR  13          3HG2      THR  13   1.202   2.836 -12.284
  111    H    ASP  14           H        ASP  14  -2.163  -1.246 -11.577
  112    HA   ASP  14           HA       ASP  14  -2.420  -2.898  -9.475
  113   1HB   ASP  14          1HB       ASP  14  -2.356  -3.162 -12.416
  114   2HB   ASP  14          2HB       ASP  14  -1.862  -4.639 -11.613
  115    H    LYS  15           H        LYS  15   0.460  -2.112 -11.382
  116    HA   LYS  15           HA       LYS  15   1.985  -4.395 -10.777
  117   1HB   LYS  15          1HB       LYS  15   2.259  -2.354 -12.501
  118   2HB   LYS  15          2HB       LYS  15   3.314  -1.764 -11.233
  119   1HG   LYS  15          1HG       LYS  15   4.284  -4.241 -11.271
  120   2HG   LYS  15          2HG       LYS  15   3.556  -4.304 -12.864
  121   1HD   LYS  15          1HD       LYS  15   4.812  -1.913 -13.103
  122   2HD   LYS  15          2HD       LYS  15   5.855  -2.627 -11.889
  123   1HE   LYS  15          1HE       LYS  15   6.927  -3.504 -13.730
  124   2HE   LYS  15          2HE       LYS  15   5.696  -4.744 -13.592
  125   1HZ   LYS  15          1HZ       LYS  15   6.103  -3.110 -15.719
  126   2HZ   LYS  15          2HZ       LYS  15   4.811  -4.081 -15.484
  127   3HZ   LYS  15          3HZ       LYS  15   4.747  -2.512 -15.033
  128    H    ALA  16           H        ALA  16   1.408  -1.269  -9.112
  129    HA   ALA  16           HA       ALA  16   3.416  -1.650  -7.166
  130   1HB   ALA  16          1HB       ALA  16   2.521   0.552  -7.691
  131   2HB   ALA  16          2HB       ALA  16   0.883   0.038  -7.221
  132   3HB   ALA  16          3HB       ALA  16   2.162   0.172  -5.990
  133    H    VAL  17           H        VAL  17  -0.167  -2.222  -7.207
  134    HA   VAL  17           HA       VAL  17  -0.245  -3.253  -4.595
  135    HB   VAL  17           HB       VAL  17  -2.016  -2.897  -6.888
  136   1HG1  VAL  17          1HG1      VAL  17  -2.229  -5.302  -6.844
  137   2HG1  VAL  17          2HG1      VAL  17  -2.441  -5.295  -5.076
  138   3HG1  VAL  17          3HG1      VAL  17  -3.692  -4.586  -6.126
  139   1HG2  VAL  17          1HG2      VAL  17  -3.443  -2.993  -4.447
  140   2HG2  VAL  17          2HG2      VAL  17  -1.864  -2.258  -4.081
  141   3HG2  VAL  17          3HG2      VAL  17  -2.902  -1.554  -5.344
  142    H    GLU  18           H        GLU  18  -0.223  -4.877  -7.846
  143    HA   GLU  18           HA       GLU  18  -0.246  -7.436  -6.935
  144   1HB   GLU  18          1HB       GLU  18  -0.451  -6.715  -9.322
  145   2HB   GLU  18          2HB       GLU  18   1.264  -6.357  -9.357
  146   1HG   GLU  18          1HG       GLU  18   0.514  -9.098  -8.400
  147   2HG   GLU  18          2HG       GLU  18   0.218  -8.770 -10.096
  148    H    GLU  19           H        GLU  19   2.400  -5.071  -6.961
  149    HA   GLU  19           HA       GLU  19   4.475  -6.914  -6.663
  150   1HB   GLU  19          1HB       GLU  19   5.028  -4.700  -7.382
  151   2HB   GLU  19          2HB       GLU  19   4.182  -3.957  -6.039
  152   1HG   GLU  19          1HG       GLU  19   6.584  -3.861  -5.596
  153   2HG   GLU  19          2HG       GLU  19   5.848  -4.964  -4.450
  154    H    ILE  20           H        ILE  20   2.188  -5.372  -4.405
  155    HA   ILE  20           HA       ILE  20   3.638  -6.041  -2.063
  156    HB   ILE  20           HB       ILE  20   0.678  -5.551  -2.217
  157   1HG1  ILE  20          1HG1      ILE  20   1.363  -3.797  -3.570
  158   2HG1  ILE  20          2HG1      ILE  20   1.373  -3.076  -1.972
  159   1HG2  ILE  20          1HG2      ILE  20   0.840  -4.830  -0.028
  160   2HG2  ILE  20          2HG2      ILE  20   2.018  -6.164  -0.070
  161   3HG2  ILE  20          3HG2      ILE  20   2.580  -4.478  -0.156
  162   1HD1  ILE  20          1HD1      ILE  20   3.913  -3.950  -1.965
  163   2HD1  ILE  20          2HD1      ILE  20   3.692  -3.845  -3.728
  164   3HD1  ILE  20          3HD1      ILE  20   3.467  -2.398  -2.716
  165    H    LYS  21           H        LYS  21   1.390  -7.723  -4.220
  166    HA   LYS  21           HA       LYS  21   0.819  -9.787  -2.319
  167   1HB   LYS  21          1HB       LYS  21   0.263  -9.483  -5.281
  168   2HB   LYS  21          2HB       LYS  21  -0.235 -10.874  -4.340
  169   1HG   LYS  21          1HG       LYS  21  -1.327  -9.129  -2.714
  170   2HG   LYS  21          2HG       LYS  21  -1.125  -7.984  -4.025
  171   1HD   LYS  21          1HD       LYS  21  -2.595 -10.651  -4.279
  172   2HD   LYS  21          2HD       LYS  21  -3.385  -9.110  -4.011
  173   1HE   LYS  21          1HE       LYS  21  -3.510  -9.108  -6.314
  174   2HE   LYS  21          2HE       LYS  21  -1.903  -8.423  -6.178
  175   1HZ   LYS  21          1HZ       LYS  21  -2.689 -11.038  -7.043
  176   2HZ   LYS  21          2HZ       LYS  21  -1.383 -10.151  -7.460
  177   3HZ   LYS  21          3HZ       LYS  21  -1.374 -11.016  -6.075
  178    H    LYS  22           H        LYS  22   3.160  -9.166  -4.943
  179    HA   LYS  22           HA       LYS  22   4.098 -11.845  -5.030
  180   1HB   LYS  22          1HB       LYS  22   4.532 -10.766  -6.999
  181   2HB   LYS  22          2HB       LYS  22   4.847  -9.224  -6.231
  182   1HG   LYS  22          1HG       LYS  22   7.077  -9.709  -5.834
  183   2HG   LYS  22          2HG       LYS  22   6.773 -11.412  -5.554
  184   1HD   LYS  22          1HD       LYS  22   6.241 -11.541  -8.114
  185   2HD   LYS  22          2HD       LYS  22   7.010  -9.970  -8.221
  186   1HE   LYS  22          1HE       LYS  22   8.744 -11.576  -8.664
  187   2HE   LYS  22          2HE       LYS  22   9.046 -10.988  -7.041
  188   1HZ   LYS  22          1HZ       LYS  22   7.839 -12.931  -6.218
  189   2HZ   LYS  22          2HZ       LYS  22   7.682 -13.493  -7.743
  190   3HZ   LYS  22          3HZ       LYS  22   9.165 -13.346  -7.076
  191    H    VAL  23           H        VAL  23   5.304  -8.775  -3.523
  192    HA   VAL  23           HA       VAL  23   7.579  -9.845  -2.382
  193    HB   VAL  23           HB       VAL  23   5.750  -7.560  -1.703
  194   1HG1  VAL  23          1HG1      VAL  23   7.267  -6.797   0.018
  195   2HG1  VAL  23          2HG1      VAL  23   6.717  -8.441   0.423
  196   3HG1  VAL  23          3HG1      VAL  23   8.344  -8.188  -0.254
  197   1HG2  VAL  23          1HG2      VAL  23   7.704  -6.220  -2.414
  198   2HG2  VAL  23          2HG2      VAL  23   8.598  -7.723  -2.748
  199   3HG2  VAL  23          3HG2      VAL  23   7.141  -7.325  -3.691
  200    H    ALA  24           H        ALA  24   4.156  -9.924  -1.329
  201    HA   ALA  24           HA       ALA  24   4.788 -11.013   1.233
  202   1HB   ALA  24          1HB       ALA  24   2.724  -9.630   0.462
  203   2HB   ALA  24          2HB       ALA  24   2.111 -11.177  -0.170
  204   3HB   ALA  24          3HB       ALA  24   2.456 -11.000   1.567
  205    H    GLN  25           H        GLN  25   3.640 -12.283  -1.951
  206    HA   GLN  25           HA       GLN  25   3.226 -14.867  -1.150
  207   1HB   GLN  25          1HB       GLN  25   3.826 -13.493  -3.743
  208   2HB   GLN  25          2HB       GLN  25   4.039 -15.232  -3.720
  209   1HG   GLN  25          1HG       GLN  25   1.678 -15.349  -2.640
  210   2HG   GLN  25          2HG       GLN  25   1.506 -13.664  -3.087
  211   1HE2  GLN  25          1HE2      GLN  25   1.412 -13.051  -5.236
  212   2HE2  GLN  25          2HE2      GLN  25   1.088 -14.159  -6.527
  213    H    GLU  26           H        GLU  26   6.238 -13.112  -1.853
  214    HA   GLU  26           HA       GLU  26   7.769 -15.517  -1.955
  215   1HB   GLU  26          1HB       GLU  26   8.140 -12.992  -2.957
  216   2HB   GLU  26          2HB       GLU  26   9.145 -12.905  -1.525
  217   1HG   GLU  26          1HG       GLU  26   9.815 -15.407  -2.558
  218   2HG   GLU  26          2HG       GLU  26   9.542 -14.469  -4.013
  219    H    ASN  27           H        ASN  27   6.234 -13.878   0.518
  220    HA   ASN  27           HA       ASN  27   8.307 -14.700   2.398
  221   1HB   ASN  27          1HB       ASN  27   6.483 -12.272   2.366
  222   2HB   ASN  27          2HB       ASN  27   7.019 -12.906   3.909
  223   1HD2  ASN  27          1HD2      ASN  27   7.741 -10.930   1.302
  224   2HD2  ASN  27          2HD2      ASN  27   9.417 -10.614   1.606
  225    H    ASN  28           H        ASN  28   5.574 -15.746   1.054
  226    HA   ASN  28           HA       ASN  28   3.860 -16.950   1.614
  227   1HB   ASN  28          1HB       ASN  28   5.909 -17.948   3.123
  228   2HB   ASN  28          2HB       ASN  28   4.825 -17.485   4.419
  229   1HD2  ASN  28          1HD2      ASN  28   4.203 -19.449   5.089
  230   2HD2  ASN  28          2HD2      ASN  28   3.293 -20.588   4.154
  231    H    ILE  29           H        ILE  29   3.764 -14.078   2.228
  232    HA   ILE  29           HA       ILE  29   2.263 -13.998   4.734
  233    HB   ILE  29           HB       ILE  29   3.527 -11.869   3.016
  234   1HG1  ILE  29          1HG1      ILE  29   4.069 -12.865   5.827
  235   2HG1  ILE  29          2HG1      ILE  29   5.090 -13.082   4.419
  236   1HG2  ILE  29          1HG2      ILE  29   1.527 -10.846   3.715
  237   2HG2  ILE  29          2HG2      ILE  29   1.606 -11.592   5.329
  238   3HG2  ILE  29          3HG2      ILE  29   2.759 -10.312   4.882
  239   1HD1  ILE  29          1HD1      ILE  29   4.538 -10.562   5.992
  240   2HD1  ILE  29          2HD1      ILE  29   6.094 -11.228   5.442
  241   3HD1  ILE  29          3HD1      ILE  29   5.005 -10.436   4.279
  242    H    GLU  30           H        GLU  30   0.076 -13.932   4.738
  243    HA   GLU  30           HA       GLU  30  -1.165 -13.533   2.137
  244   1HB   GLU  30          1HB       GLU  30  -1.526 -15.506   4.163
  245   2HB   GLU  30          2HB       GLU  30  -2.986 -14.536   4.170
  246   1HG   GLU  30          1HG       GLU  30  -3.374 -14.935   1.807
  247   2HG   GLU  30          2HG       GLU  30  -1.779 -15.627   1.593
  248    H    ASN  31           H        ASN  31  -0.248 -11.629   4.557
  249    HA   ASN  31           HA       ASN  31  -2.558  -9.947   4.231
  250   1HB   ASN  31          1HB       ASN  31  -2.652 -11.401   6.459
  251   2HB   ASN  31          2HB       ASN  31  -1.423 -10.291   7.033
  252   1HD2  ASN  31          1HD2      ASN  31  -2.018  -8.441   7.889
  253   2HD2  ASN  31          2HD2      ASN  31  -3.585  -7.708   7.796
  254    HA   PRO  32           HA       PRO  32   1.596  -7.964   4.238
  255   1HB   PRO  32          1HB       PRO  32   1.588  -6.987   1.686
  256   2HB   PRO  32          2HB       PRO  32   2.327  -8.514   2.125
  257   1HG   PRO  32          1HG       PRO  32  -0.221  -8.028   0.707
  258   2HG   PRO  32          2HG       PRO  32   0.732  -9.497   0.780
  259   1HD   PRO  32          1HD       PRO  32  -1.687  -8.946   2.220
  260   2HD   PRO  32          2HD       PRO  32  -0.672 -10.366   2.380
  261    H    ILE  33           H        ILE  33   1.551  -6.235   5.519
  262    HA   ILE  33           HA       ILE  33  -0.560  -4.322   4.970
  263    HB   ILE  33           HB       ILE  33   1.233  -4.969   7.254
  264   1HG1  ILE  33          1HG1      ILE  33  -1.469  -4.052   7.820
  265   2HG1  ILE  33          2HG1      ILE  33  -1.474  -5.329   6.620
  266   1HG2  ILE  33          1HG2      ILE  33   0.084  -2.228   6.713
  267   2HG2  ILE  33          2HG2      ILE  33   0.486  -2.804   8.349
  268   3HG2  ILE  33          3HG2      ILE  33   1.761  -2.672   7.113
  269   1HD1  ILE  33          1HD1      ILE  33  -0.008  -5.469   9.296
  270   2HD1  ILE  33          2HD1      ILE  33  -1.580  -6.228   8.947
  271   3HD1  ILE  33          3HD1      ILE  33  -0.117  -6.776   8.093
  272    H    LEU  34           H        LEU  34  -0.118  -2.969   3.292
  273    HA   LEU  34           HA       LEU  34   2.617  -2.047   2.964
  274   1HB   LEU  34          1HB       LEU  34   1.143  -2.922   1.093
  275   2HB   LEU  34          2HB       LEU  34   0.217  -1.442   1.242
  276    HG   LEU  34           HG       LEU  34   2.430  -0.198   0.858
  277   1HD1  LEU  34          1HD1      LEU  34   3.386  -2.914   0.813
  278   2HD1  LEU  34          2HD1      LEU  34   3.701  -2.129  -0.753
  279   3HD1  LEU  34          3HD1      LEU  34   4.299  -1.387   0.750
  280   1HD2  LEU  34          1HD2      LEU  34   1.357   0.157  -1.052
  281   2HD2  LEU  34          2HD2      LEU  34   2.183  -1.271  -1.720
  282   3HD2  LEU  34          3HD2      LEU  34   0.574  -1.440  -0.978
  283    H    ARG  35           H        ARG  35   3.272  -0.325   4.130
  284    HA   ARG  35           HA       ARG  35   1.224   1.632   4.772
  285   1HB   ARG  35          1HB       ARG  35   2.209   0.875   6.808
  286   2HB   ARG  35          2HB       ARG  35   3.817   0.801   6.116
  287   1HG   ARG  35          1HG       ARG  35   4.216   3.056   6.435
  288   2HG   ARG  35          2HG       ARG  35   2.559   3.511   6.095
  289   1HD   ARG  35          1HD       ARG  35   1.824   2.894   8.317
  290   2HD   ARG  35          2HD       ARG  35   3.317   2.041   8.655
  291    HE   ARG  35           HE       ARG  35   2.895   4.947   8.771
  292   1HH1  ARG  35          2HH2      ARG  35   5.275   2.363   8.561
  293   2HH1  ARG  35          1HH2      ARG  35   6.569   3.331   9.185
  294   1HH2  ARG  35          2HH1      ARG  35   4.601   6.224   9.594
  295   2HH2  ARG  35          1HH1      ARG  35   6.183   5.542   9.777
  296    H    ILE  36           H        ILE  36   1.468   3.790   4.092
  297    HA   ILE  36           HA       ILE  36   3.629   4.243   2.209
  298    HB   ILE  36           HB       ILE  36   0.948   5.409   2.745
  299   1HG1  ILE  36          1HG1      ILE  36   0.807   5.274   0.282
  300   2HG1  ILE  36          2HG1      ILE  36   2.461   4.699   0.214
  301   1HG2  ILE  36          1HG2      ILE  36   3.299   6.965   1.696
  302   2HG2  ILE  36          2HG2      ILE  36   1.646   7.308   1.132
  303   3HG2  ILE  36          3HG2      ILE  36   2.045   7.453   2.861
  304   1HD1  ILE  36          1HD1      ILE  36   0.593   3.228   2.052
  305   2HD1  ILE  36          2HD1      ILE  36   0.363   3.009   0.300
  306   3HD1  ILE  36          3HD1      ILE  36   1.926   2.604   1.050
  307    H    ARG  37           H        ARG  37   5.524   5.002   2.977
  308    HA   ARG  37           HA       ARG  37   5.311   6.988   5.094
  309   1HB   ARG  37          1HB       ARG  37   6.269   4.679   5.779
  310   2HB   ARG  37          2HB       ARG  37   7.647   5.049   4.763
  311   1HG   ARG  37          1HG       ARG  37   6.793   7.112   6.794
  312   2HG   ARG  37          2HG       ARG  37   7.617   5.679   7.376
  313   1HD   ARG  37          1HD       ARG  37   9.132   6.487   5.126
  314   2HD   ARG  37          2HD       ARG  37   8.714   7.989   5.926
  315    HE   ARG  37           HE       ARG  37   9.573   6.101   7.907
  316   1HH1  ARG  37          2HH2      ARG  37  10.865   8.044   5.273
  317   2HH1  ARG  37          1HH2      ARG  37  12.450   8.158   5.964
  318   1HH2  ARG  37          2HH1      ARG  37  11.663   6.251   8.820
  319   2HH2  ARG  37          1HH1      ARG  37  12.906   7.131   7.995
  320    H    VAL  38           H        VAL  38   6.325   8.937   4.627
  321    HA   VAL  38           HA       VAL  38   7.404   9.335   2.060
  322    HB   VAL  38           HB       VAL  38   7.776  11.150   4.433
  323   1HG1  VAL  38          1HG1      VAL  38   7.361  11.619   1.462
  324   2HG1  VAL  38          2HG1      VAL  38   7.404  12.906   2.691
  325   3HG1  VAL  38          3HG1      VAL  38   8.845  11.901   2.403
  326   1HG2  VAL  38          1HG2      VAL  38   5.271  10.123   3.410
  327   2HG2  VAL  38          2HG2      VAL  38   5.573  11.215   4.782
  328   3HG2  VAL  38          3HG2      VAL  38   5.381  11.879   3.142
  329    H    VAL  39           H        VAL  39   9.300   8.459   1.395
  330    HA   VAL  39           HA       VAL  39  11.474   8.366   3.362
  331    HB   VAL  39           HB       VAL  39  10.584   6.257   2.269
  332   1HG1  VAL  39          1HG1      VAL  39  10.339   7.279  -0.011
  333   2HG1  VAL  39          2HG1      VAL  39  12.114   7.277  -0.145
  334   3HG1  VAL  39          3HG1      VAL  39  11.232   5.739   0.011
  335   1HG2  VAL  39          1HG2      VAL  39  12.948   5.407   1.778
  336   2HG2  VAL  39          2HG2      VAL  39  13.497   7.063   2.131
  337   3HG2  VAL  39          3HG2      VAL  39  12.662   6.116   3.386
  338    HA   PRO  40           HA       PRO  40  13.098  11.620   0.919
  339   1HB   PRO  40          1HB       PRO  40  15.127  12.317   2.613
  340   2HB   PRO  40          2HB       PRO  40  13.499  12.948   2.757
  341   1HG   PRO  40          1HG       PRO  40  14.847  10.905   4.413
  342   2HG   PRO  40          2HG       PRO  40  13.415  11.844   4.780
  343   1HD   PRO  40          1HD       PRO  40  13.502   9.096   3.965
  344   2HD   PRO  40          2HD       PRO  40  12.067  10.068   4.220
  345    H    GLY  41           H        GLY  41  13.669  10.358  -0.873
  346   1HA   GLY  41          1HA       GLY  41  16.452   9.369  -0.672
  347   2HA   GLY  41          2HA       GLY  41  15.199   8.630  -1.650
  348    H    GLY  42           H        GLY  42  13.973  10.549  -3.070
  349   1HA   GLY  42          1HA       GLY  42  15.914  11.322  -4.986
  350   2HA   GLY  42          2HA       GLY  42  14.213  11.743  -4.965
  351    H    CYS  43           H        CYS  43  16.255  13.575  -5.766
  352    HA   CYS  43           HA       CYS  43  16.856  15.265  -3.545
  353   1HB   CYS  43          1HB       CYS  43  17.540  15.150  -6.417
  354   2HB   CYS  43          2HB       CYS  43  17.387  16.774  -5.776
  355    HG   CYS  43           HG       CYS  43  18.953  16.453  -3.719
  356    H    SER  44           H        SER  44  14.729  15.368  -6.491
  357    HA   SER  44           HA       SER  44  13.226  17.464  -5.129
  358   1HB   SER  44          1HB       SER  44  14.010  17.048  -7.985
  359   2HB   SER  44          2HB       SER  44  12.387  17.656  -7.724
  360    HG   SER  44           HG       SER  44  14.828  18.949  -7.430
  361    H    GLY  45           H        GLY  45  13.031  14.549  -7.270
  362   1HA   GLY  45          1HA       GLY  45  10.168  14.322  -6.892
  363   2HA   GLY  45          2HA       GLY  45  11.216  13.271  -7.822
  364    H    PHE  46           H        PHE  46  10.105  14.105  -4.513
  365    HA   PHE  46           HA       PHE  46  11.450  11.844  -3.365
  366   1HB   PHE  46          1HB       PHE  46   9.189  13.606  -2.260
  367   2HB   PHE  46          2HB       PHE  46  10.368  12.717  -1.315
  368    HD1  PHE  46           1HD      PHE  46  12.860  13.416  -1.647
  369    HD2  PHE  46           2HD      PHE  46   9.556  15.851  -2.722
  370    HE1  PHE  46           1HE      PHE  46  14.332  15.447  -1.571
  371    HE2  PHE  46           2HE      PHE  46  11.028  17.883  -2.646
  372    HZ   PHE  46           HZ       PHE  46  13.399  17.657  -2.072
  373    H    GLN  47           H        GLN  47  10.706   9.818  -3.834
  374    HA   GLN  47           HA       GLN  47   7.842   9.511  -4.136
  375   1HB   GLN  47          1HB       GLN  47   8.622   7.122  -4.874
  376   2HB   GLN  47          2HB       GLN  47   8.899   8.475  -5.953
  377   1HG   GLN  47          1HG       GLN  47  11.049   7.855  -3.937
  378   2HG   GLN  47          2HG       GLN  47  10.863   6.744  -5.279
  379   1HE2  GLN  47          1HE2      GLN  47  13.081   8.450  -4.720
  380   2HE2  GLN  47          2HE2      GLN  47  13.287   9.542  -6.048
  381    H    TYR  48           H        TYR  48   7.048   7.194  -3.268
  382    HA   TYR  48           HA       TYR  48   8.063   6.983  -0.513
  383   1HB   TYR  48          1HB       TYR  48   5.313   6.352  -1.751
  384   2HB   TYR  48          2HB       TYR  48   5.677   6.323  -0.038
  385    HD1  TYR  48           1HD      TYR  48   5.302   8.556  -2.982
  386    HD2  TYR  48           2HD      TYR  48   5.608   8.316   1.279
  387    HE1  TYR  48           1HE      TYR  48   4.611  10.995  -2.788
  388    HE2  TYR  48           2HE      TYR  48   4.916  10.756   1.459
  389    HH   TYR  48           HH       TYR  48   5.178  12.855  -0.570
  390    H    ALA  49           H        ALA  49   9.002   5.078   0.022
  391    HA   ALA  49           HA       ALA  49   8.899   2.920  -1.874
  392   1HB   ALA  49          1HB       ALA  49  10.274   3.283   0.818
  393   2HB   ALA  49          2HB       ALA  49  10.496   1.876  -0.250
  394   3HB   ALA  49          3HB       ALA  49  11.003   3.494  -0.792
  395    H    MET  50           H        MET  50   8.347   0.666  -1.194
  396    HA   MET  50           HA       MET  50   6.172   0.755   0.753
  397   1HB   MET  50          1HB       MET  50   6.482  -0.519  -1.970
  398   2HB   MET  50          2HB       MET  50   5.562  -1.424  -0.784
  399   1HG   MET  50          1HG       MET  50   3.760  -0.110  -1.203
  400   2HG   MET  50          2HG       MET  50   4.641   1.276  -0.592
  401   1HE   MET  50          1HE       MET  50   4.839  -1.081  -3.822
  402   2HE   MET  50          2HE       MET  50   3.170  -0.545  -3.516
  403   3HE   MET  50          3HE       MET  50   4.041   0.036  -4.955
  404    H    GLY  51           H        GLY  51   5.806  -1.239   2.022
  405   1HA   GLY  51          1HA       GLY  51   7.495  -3.469   1.935
  406   2HA   GLY  51          2HA       GLY  51   8.190  -2.315   3.055
  407    H    PHE  52           H        PHE  52   7.521  -4.538   4.306
  408    HA   PHE  52           HA       PHE  52   4.812  -4.118   5.347
  409   1HB   PHE  52          1HB       PHE  52   6.749  -6.509   5.463
  410   2HB   PHE  52          2HB       PHE  52   5.107  -6.530   6.074
  411    HD1  PHE  52           1HD      PHE  52   4.113  -4.808   3.594
  412    HD2  PHE  52           2HD      PHE  52   6.287  -8.426   4.029
  413    HE1  PHE  52           1HE      PHE  52   3.288  -5.574   1.351
  414    HE2  PHE  52           2HE      PHE  52   5.462  -9.192   1.786
  415    HZ   PHE  52           HZ       PHE  52   3.972  -7.757   0.473
  416    H    ASP  53           H        ASP  53   5.142  -2.594   6.985
  417    HA   ASP  53           HA       ASP  53   6.362  -3.632   9.316
  418   1HB   ASP  53          1HB       ASP  53   7.809  -1.698   7.603
  419   2HB   ASP  53          2HB       ASP  53   7.622  -1.130   9.251
  420    H    ASP  54           H        ASP  54   5.822  -2.205  11.212
  421    HA   ASP  54           HA       ASP  54   4.654  -0.746  12.326
  422   1HB   ASP  54          1HB       ASP  54   5.085   0.635   9.831
  423   2HB   ASP  54          2HB       ASP  54   3.426   0.932  10.312
  424    H    THR  55           H        THR  55   3.048  -2.386  12.828
  425    HA   THR  55           HA       THR  55   1.055  -3.275  11.133
  426    HB   THR  55           HB       THR  55   1.918  -3.911  13.615
  427    HG1  THR  55           1HG      THR  55  -0.250  -5.058  13.661
  428   1HG2  THR  55          1HG2      THR  55  -0.833  -2.842  14.256
  429   2HG2  THR  55          2HG2      THR  55   0.515  -3.212  15.358
  430   3HG2  THR  55          3HG2      THR  55   0.542  -1.720  14.388
  431    H    VAL  56           H        VAL  56  -1.433  -2.881  12.156
  432    HA   VAL  56           HA       VAL  56  -2.014  -0.293  11.093
  433    HB   VAL  56           HB       VAL  56  -3.374  -2.780  11.669
  434   1HG1  VAL  56          1HG1      VAL  56  -4.437  -1.614  13.505
  435   2HG1  VAL  56          2HG1      VAL  56  -4.810  -0.223  12.458
  436   3HG1  VAL  56          3HG1      VAL  56  -5.605  -1.791  12.173
  437   1HG2  VAL  56          1HG2      VAL  56  -4.076  -0.393   9.926
  438   2HG2  VAL  56          2HG2      VAL  56  -3.132  -1.820   9.435
  439   3HG2  VAL  56          3HG2      VAL  56  -4.853  -1.993   9.857
  440    H    GLU  57           H        GLU  57  -3.210   1.404  12.228
  441    HA   GLU  57           HA       GLU  57  -2.605   1.335  15.082
  442   1HB   GLU  57          1HB       GLU  57  -2.927   3.914  13.535
  443   2HB   GLU  57          2HB       GLU  57  -2.057   3.632  15.029
  444   1HG   GLU  57          1HG       GLU  57  -0.349   2.296  13.806
  445   2HG   GLU  57          2HG       GLU  57  -1.233   2.511  12.308
  446    H    GLU  58           H        GLU  58  -4.090   3.051  16.312
  447    HA   GLU  58           HA       GLU  58  -6.758   2.235  15.678
  448   1HB   GLU  58          1HB       GLU  58  -5.502   2.540  18.039
  449   2HB   GLU  58          2HB       GLU  58  -6.155   4.161  17.909
  450   1HG   GLU  58          1HG       GLU  58  -8.348   3.456  18.136
  451   2HG   GLU  58          2HG       GLU  58  -8.073   1.958  17.268
  452    H    GLY  59           H        GLY  59  -5.166   4.208  13.949
  453   1HA   GLY  59          1HA       GLY  59  -7.323   5.988  13.409
  454   2HA   GLY  59          2HA       GLY  59  -6.014   6.818  14.226
  455    H    ASP  60           H        ASP  60  -5.924   4.069  11.858
  456    HA   ASP  60           HA       ASP  60  -4.289   5.814  10.189
  457   1HB   ASP  60          1HB       ASP  60  -3.867   3.127  11.208
  458   2HB   ASP  60          2HB       ASP  60  -3.949   3.056   9.459
  459    H    HIS  61           H        HIS  61  -5.025   6.096   8.048
  460    HA   HIS  61           HA       HIS  61  -7.606   5.220   7.403
  461   1HB   HIS  61          1HB       HIS  61  -5.407   6.488   5.753
  462   2HB   HIS  61          2HB       HIS  61  -7.012   6.164   5.128
  463    HD1  HIS  61           1HD      HIS  61  -6.262   7.529   8.613
  464    HD2  HIS  61           2HD      HIS  61  -7.942   8.761   4.972
  465    HE1  HIS  61           1HE      HIS  61  -7.277   9.831   9.037
  466    H    VAL  62           H        VAL  62  -7.508   2.891   7.724
  467    HA   VAL  62           HA       VAL  62  -5.741   1.355   6.083
  468    HB   VAL  62           HB       VAL  62  -6.879   0.902   8.428
  469   1HG1  VAL  62          1HG1      VAL  62  -9.182   0.960   7.289
  470   2HG1  VAL  62          2HG1      VAL  62  -8.762  -0.642   6.637
  471   3HG1  VAL  62          3HG1      VAL  62  -8.847  -0.392   8.397
  472   1HG2  VAL  62          1HG2      VAL  62  -6.779  -1.680   7.586
  473   2HG2  VAL  62          2HG2      VAL  62  -5.875  -0.876   6.280
  474   3HG2  VAL  62          3HG2      VAL  62  -5.345  -0.698   7.970
  475    H    PHE  63           H        PHE  63  -6.039   0.794   3.990
  476    HA   PHE  63           HA       PHE  63  -8.783   1.007   2.965
  477   1HB   PHE  63          1HB       PHE  63  -6.396   2.379   2.275
  478   2HB   PHE  63          2HB       PHE  63  -6.492   1.119   1.061
  479    HD1  PHE  63           1HD      PHE  63  -7.049   2.293  -0.877
  480    HD2  PHE  63           2HD      PHE  63  -9.296   2.965   2.659
  481    HE1  PHE  63           1HE      PHE  63  -8.689   3.675  -2.182
  482    HE2  PHE  63           2HE      PHE  63 -10.936   4.347   1.354
  483    HZ   PHE  63           HZ       PHE  63 -10.613   4.685  -1.050
  484    H    GLU  64           H        GLU  64  -9.596  -0.701   1.749
  485    HA   GLU  64           HA       GLU  64  -8.032  -3.100   1.899
  486   1HB   GLU  64          1HB       GLU  64 -10.880  -2.589   0.932
  487   2HB   GLU  64          2HB       GLU  64 -10.150  -4.177   1.051
  488   1HG   GLU  64          1HG       GLU  64  -9.919  -3.997   3.458
  489   2HG   GLU  64          2HG       GLU  64 -10.296  -2.285   3.436
  490    H    TYR  65           H        TYR  65  -7.430  -4.416   0.075
  491    HA   TYR  65           HA       TYR  65  -7.749  -3.136  -2.540
  492   1HB   TYR  65          1HB       TYR  65  -5.377  -3.389  -0.842
  493   2HB   TYR  65          2HB       TYR  65  -5.155  -4.432  -2.232
  494    HD1  TYR  65           1HD      TYR  65  -4.143  -1.445  -1.113
  495    HD2  TYR  65           2HD      TYR  65  -6.285  -3.010  -4.469
  496    HE1  TYR  65           1HE      TYR  65  -3.433   0.558  -2.509
  497    HE2  TYR  65           2HE      TYR  65  -5.568  -1.002  -5.854
  498    HH   TYR  65           HH       TYR  65  -4.377   0.798  -5.926
  499    H    ASP  66           H        ASP  66  -5.961  -5.048  -3.835
  500    HA   ASP  66           HA       ASP  66  -7.805  -7.061  -4.280
  501   1HB   ASP  66          1HB       ASP  66  -5.656  -6.148  -5.622
  502   2HB   ASP  66          2HB       ASP  66  -4.870  -7.499  -4.830
  503    H    GLY  67           H        GLY  67  -8.123  -7.712  -1.902
  504   1HA   GLY  67          1HA       GLY  67  -7.849  -9.163  -0.211
  505   2HA   GLY  67          2HA       GLY  67  -6.908 -10.150  -1.312
  506    H    VAL  68           H        VAL  68  -6.275  -6.807  -0.049
  507    HA   VAL  68           HA       VAL  68  -4.130  -7.816   1.600
  508    HB   VAL  68           HB       VAL  68  -3.657  -6.081  -0.827
  509   1HG1  VAL  68          1HG1      VAL  68  -1.899  -6.587   1.586
  510   2HG1  VAL  68          2HG1      VAL  68  -1.251  -6.060   0.014
  511   3HG1  VAL  68          3HG1      VAL  68  -2.406  -5.029   0.891
  512   1HG2  VAL  68          1HG2      VAL  68  -1.961  -7.833  -1.356
  513   2HG2  VAL  68          2HG2      VAL  68  -2.552  -8.774   0.034
  514   3HG2  VAL  68          3HG2      VAL  68  -3.633  -8.443  -1.341
  515    H    LYS  69           H        LYS  69  -3.418  -6.233   3.163
  516    HA   LYS  69           HA       LYS  69  -5.414  -4.129   3.499
  517   1HB   LYS  69          1HB       LYS  69  -4.104  -5.985   5.263
  518   2HB   LYS  69          2HB       LYS  69  -3.719  -4.353   5.770
  519   1HG   LYS  69          1HG       LYS  69  -6.358  -3.988   5.309
  520   2HG   LYS  69          2HG       LYS  69  -6.402  -5.713   5.614
  521   1HD   LYS  69          1HD       LYS  69  -4.873  -5.035   7.719
  522   2HD   LYS  69          2HD       LYS  69  -5.631  -3.472   7.484
  523   1HE   LYS  69          1HE       LYS  69  -7.418  -4.255   8.645
  524   2HE   LYS  69          2HE       LYS  69  -7.775  -5.291   7.278
  525   1HZ   LYS  69          1HZ       LYS  69  -6.508  -5.951   9.775
  526   2HZ   LYS  69          2HZ       LYS  69  -7.483  -6.857   8.829
  527   3HZ   LYS  69          3HZ       LYS  69  -5.901  -6.702   8.458
  528    H    VAL  70           H        VAL  70  -4.876  -1.947   3.632
  529    HA   VAL  70           HA       VAL  70  -2.044  -1.285   3.402
  530    HB   VAL  70           HB       VAL  70  -4.216  -0.660   1.423
  531   1HG1  VAL  70          1HG1      VAL  70  -3.563   1.506   1.503
  532   2HG1  VAL  70          2HG1      VAL  70  -2.025   1.125   2.315
  533   3HG1  VAL  70          3HG1      VAL  70  -2.178   0.916   0.554
  534   1HG2  VAL  70          1HG2      VAL  70  -1.654  -2.109   1.454
  535   2HG2  VAL  70          2HG2      VAL  70  -3.060  -2.281   0.376
  536   3HG2  VAL  70          3HG2      VAL  70  -1.851  -1.012   0.066
  537    H    VAL  71           H        VAL  71  -1.503   0.708   4.352
  538    HA   VAL  71           HA       VAL  71  -3.691   2.355   5.317
  539    HB   VAL  71           HB       VAL  71  -3.293   2.115   7.548
  540   1HG1  VAL  71          1HG1      VAL  71  -3.288  -0.208   8.114
  541   2HG1  VAL  71          2HG1      VAL  71  -4.070  -0.059   6.521
  542   3HG1  VAL  71          3HG1      VAL  71  -2.389  -0.632   6.638
  543   1HG2  VAL  71          1HG2      VAL  71  -0.957   2.676   7.602
  544   2HG2  VAL  71          2HG2      VAL  71  -1.179   1.163   8.513
  545   3HG2  VAL  71          3HG2      VAL  71  -0.509   1.120   6.864
  546    H    ILE  72           H        ILE  72  -2.915   4.498   6.053
  547    HA   ILE  72           HA       ILE  72  -0.162   5.081   5.311
  548    HB   ILE  72           HB       ILE  72  -2.558   6.456   4.089
  549   1HG1  ILE  72          1HG1      ILE  72  -0.983   5.642   2.020
  550   2HG1  ILE  72          2HG1      ILE  72  -0.712   4.337   3.157
  551   1HG2  ILE  72          1HG2      ILE  72   0.383   7.133   4.069
  552   2HG2  ILE  72          2HG2      ILE  72  -0.734   7.690   2.800
  553   3HG2  ILE  72          3HG2      ILE  72  -1.001   8.168   4.493
  554   1HD1  ILE  72          1HD1      ILE  72  -2.647   3.494   2.263
  555   2HD1  ILE  72          2HD1      ILE  72  -3.433   4.623   3.393
  556   3HD1  ILE  72          3HD1      ILE  72  -3.192   5.090   1.693
  557    H    ASP  73           H        ASP  73   0.750   6.716   6.549
  558    HA   ASP  73           HA       ASP  73  -0.437   7.233   8.969
  559   1HB   ASP  73          1HB       ASP  73   1.813   8.556   7.416
  560   2HB   ASP  73          2HB       ASP  73   1.330   9.192   8.976
  561    HA   PRO  74           HA       PRO  74  -2.849  10.800   8.136
  562   1HB   PRO  74          1HB       PRO  74  -2.662  12.255  10.442
  563   2HB   PRO  74          2HB       PRO  74  -3.708  10.860  10.272
  564   1HG   PRO  74          1HG       PRO  74  -1.134  11.083  11.707
  565   2HG   PRO  74          2HG       PRO  74  -2.380   9.862  11.872
  566   1HD   PRO  74          1HD       PRO  74   0.118   9.588  10.490
  567   2HD   PRO  74          2HD       PRO  74  -1.177   8.410  10.557
  568    H    PHE  75           H        PHE  75   0.452  11.253   8.918
  569    HA   PHE  75           HA       PHE  75   0.398  14.023   8.141
  570   1HB   PHE  75          1HB       PHE  75   2.160  12.016   9.402
  571   2HB   PHE  75          2HB       PHE  75   3.046  12.900   8.175
  572    HD1  PHE  75           1HD      PHE  75   2.702  12.817  11.489
  573    HD2  PHE  75           2HD      PHE  75   2.129  15.601   8.338
  574    HE1  PHE  75           1HE      PHE  75   3.045  14.712  13.100
  575    HE2  PHE  75           2HE      PHE  75   2.472  17.495   9.949
  576    HZ   PHE  75           HZ       PHE  75   2.926  17.028  12.311
  577    H    SER  76           H        SER  76   0.796  10.884   6.623
  578    HA   SER  76           HA       SER  76   2.202  12.024   4.391
  579   1HB   SER  76          1HB       SER  76   1.961   9.621   3.496
  580   2HB   SER  76          2HB       SER  76   2.941   9.833   4.934
  581    HG   SER  76           HG       SER  76   1.579   8.100   5.368
  582    H    MET  77           H        MET  77  -1.047  11.496   5.481
  583    HA   MET  77           HA       MET  77  -2.353  10.903   3.150
  584   1HB   MET  77          1HB       MET  77  -3.010  11.552   5.796
  585   2HB   MET  77          2HB       MET  77  -3.699  12.900   4.914
  586   1HG   MET  77          1HG       MET  77  -4.199  10.013   4.071
  587   2HG   MET  77          2HG       MET  77  -5.210  10.815   5.257
  588   1HE   MET  77          1HE       MET  77  -4.102  10.410   1.700
  589   2HE   MET  77          2HE       MET  77  -5.713   9.698   1.955
  590   3HE   MET  77          3HE       MET  77  -5.509  11.054   0.820
  591    HA   PRO  78           HA       PRO  78  -2.505  15.582   2.344
  592   1HB   PRO  78          1HB       PRO  78  -0.886  17.256   3.774
  593   2HB   PRO  78          2HB       PRO  78  -2.564  16.962   4.186
  594   1HG   PRO  78          1HG       PRO  78  -0.125  15.936   5.504
  595   2HG   PRO  78          2HG       PRO  78  -1.760  16.011   6.128
  596   1HD   PRO  78          1HD       PRO  78  -0.407  13.684   5.138
  597   2HD   PRO  78          2HD       PRO  78  -2.079  13.784   5.654
  598    H    TYR  79           H        TYR  79  -0.032  13.525   2.386
  599    HA   TYR  79           HA       TYR  79   1.684  15.259   0.768
  600   1HB   TYR  79          1HB       TYR  79   1.985  13.203   2.770
  601   2HB   TYR  79          2HB       TYR  79   2.521  12.470   1.271
  602    HD1  TYR  79           1HD      TYR  79   3.807  13.835   4.054
  603    HD2  TYR  79           2HD      TYR  79   3.931  14.517  -0.167
  604    HE1  TYR  79           1HE      TYR  79   6.066  14.976   4.297
  605    HE2  TYR  79           2HE      TYR  79   6.189  15.655   0.090
  606    HH   TYR  79           HH       TYR  79   7.870  15.648   3.169
  607    H    VAL  80           H        VAL  80  -0.137  12.144   0.736
  608    HA   VAL  80           HA       VAL  80   0.155  12.182  -2.187
  609    HB   VAL  80           HB       VAL  80   0.256   9.791  -2.189
  610   1HG1  VAL  80          1HG1      VAL  80   2.218  10.484  -0.019
  611   2HG1  VAL  80          2HG1      VAL  80   2.451   9.528  -1.503
  612   3HG1  VAL  80          3HG1      VAL  80   2.323  11.300  -1.597
  613   1HG2  VAL  80          1HG2      VAL  80  -1.066   8.966  -0.484
  614   2HG2  VAL  80          2HG2      VAL  80   0.561   8.670   0.174
  615   3HG2  VAL  80          3HG2      VAL  80  -0.384  10.072   0.732
  616    H    ASN  81           H        ASN  81  -1.865  13.654  -1.146
  617    HA   ASN  81           HA       ASN  81  -4.146  11.926  -0.856
  618   1HB   ASN  81          1HB       ASN  81  -5.324  14.269  -0.675
  619   2HB   ASN  81          2HB       ASN  81  -4.263  13.779   0.631
  620   1HD2  ASN  81          1HD2      ASN  81  -4.815  15.950  -1.975
  621   2HD2  ASN  81          2HD2      ASN  81  -3.449  16.992  -1.757
  622    H    GLY  82           H        GLY  82  -5.667  11.603  -2.529
  623   1HA   GLY  82          1HA       GLY  82  -6.465  11.568  -4.634
  624   2HA   GLY  82          2HA       GLY  82  -6.368  13.316  -4.545
  625    H    ALA  83           H        ALA  83  -4.085  10.502  -4.923
  626    HA   ALA  83           HA       ALA  83  -3.125  11.645  -7.390
  627   1HB   ALA  83          1HB       ALA  83  -0.734  11.143  -6.017
  628   2HB   ALA  83          2HB       ALA  83  -1.399  12.739  -6.443
  629   3HB   ALA  83          3HB       ALA  83  -1.739  12.031  -4.846
  630    H    GLU  84           H        GLU  84  -1.054  10.086  -8.021
  631    HA   GLU  84           HA       GLU  84  -1.782   7.396  -7.210
  632   1HB   GLU  84          1HB       GLU  84  -1.713   6.618  -9.558
  633   2HB   GLU  84          2HB       GLU  84  -2.974   7.812  -9.325
  634   1HG   GLU  84          1HG       GLU  84  -0.838   9.434  -9.993
  635   2HG   GLU  84          2HG       GLU  84  -0.464   7.995 -10.921
  636    H    LEU  85           H        LEU  85  -0.038   5.798  -7.563
  637    HA   LEU  85           HA       LEU  85   2.553   7.007  -8.167
  638   1HB   LEU  85          1HB       LEU  85   3.153   7.009  -6.050
  639   2HB   LEU  85          2HB       LEU  85   1.632   6.290  -5.561
  640    HG   LEU  85           HG       LEU  85   2.639   4.028  -6.131
  641   1HD1  LEU  85          1HD1      LEU  85   5.104   5.746  -6.420
  642   2HD1  LEU  85          2HD1      LEU  85   5.188   4.015  -6.013
  643   3HD1  LEU  85          3HD1      LEU  85   4.446   4.534  -7.546
  644   1HD2  LEU  85          1HD2      LEU  85   3.051   3.799  -3.952
  645   2HD2  LEU  85          2HD2      LEU  85   4.384   4.977  -3.988
  646   3HD2  LEU  85          3HD2      LEU  85   2.704   5.539  -3.819
  647    H    ASP  86           H        ASP  86   3.485   5.856  -9.762
  648    HA   ASP  86           HA       ASP  86   2.493   3.178 -10.180
  649   1HB   ASP  86          1HB       ASP  86   4.571   4.416 -11.967
  650   2HB   ASP  86          2HB       ASP  86   3.202   3.410 -12.396
  651    H    TYR  87           H        TYR  87   3.668   1.543  -9.166
  652    HA   TYR  87           HA       TYR  87   6.405   2.044  -8.388
  653   1HB   TYR  87          1HB       TYR  87   4.495   0.858  -7.065
  654   2HB   TYR  87          2HB       TYR  87   4.604  -0.450  -8.227
  655    HD1  TYR  87           1HD      TYR  87   6.018   1.018  -5.238
  656    HD2  TYR  87           2HD      TYR  87   6.746  -1.792  -8.381
  657    HE1  TYR  87           1HE      TYR  87   7.844  -0.075  -3.847
  658    HE2  TYR  87           2HE      TYR  87   8.569  -2.876  -6.980
  659    HH   TYR  87           HH       TYR  87   9.789  -1.395  -4.152
  660    H    VAL  88           H        VAL  88   8.177   1.456  -9.538
  661    HA   VAL  88           HA       VAL  88   7.733  -0.260 -11.855
  662    HB   VAL  88           HB       VAL  88   9.938   1.629 -11.032
  663   1HG1  VAL  88          1HG1      VAL  88  11.171  -0.025 -12.116
  664   2HG1  VAL  88          2HG1      VAL  88   9.851  -0.416 -13.244
  665   3HG1  VAL  88          3HG1      VAL  88  10.770   1.096 -13.440
  666   1HG2  VAL  88          1HG2      VAL  88   8.927   3.157 -12.318
  667   2HG2  VAL  88          2HG2      VAL  88   8.704   1.999 -13.651
  668   3HG2  VAL  88          3HG2      VAL  88   7.514   2.074 -12.330
  669    H    VAL  89           H        VAL  89   8.984  -2.157 -12.229
  670    HA   VAL  89           HA       VAL  89  10.489  -3.078  -9.883
  671    HB   VAL  89           HB       VAL  89   8.642  -4.781 -11.561
  672   1HG1  VAL  89          1HG1      VAL  89  10.542  -5.281  -9.345
  673   2HG1  VAL  89          2HG1      VAL  89   8.952  -6.065  -9.181
  674   3HG1  VAL  89          3HG1      VAL  89   9.951  -6.369 -10.623
  675   1HG2  VAL  89          1HG2      VAL  89   8.142  -3.351  -8.940
  676   2HG2  VAL  89          2HG2      VAL  89   7.183  -3.291 -10.438
  677   3HG2  VAL  89          3HG2      VAL  89   7.202  -4.773  -9.453
  678    H    ASP  90           H        ASP  90  12.580  -3.214 -10.507
  679    HA   ASP  90           HA       ASP  90  13.213  -4.821 -12.738
  680   1HB   ASP  90          1HB       ASP  90  12.735  -2.263 -13.493
  681   2HB   ASP  90          2HB       ASP  90  14.391  -2.058 -12.958
  682    H    PHE  91           H        PHE  91  15.888  -3.303 -13.007
  683    HA   PHE  91           HA       PHE  91  17.326  -4.663 -11.084
  684   1HB   PHE  91          1HB       PHE  91  17.836  -3.259 -13.366
  685   2HB   PHE  91          2HB       PHE  91  18.232  -1.992 -12.222
  686    HD1  PHE  91           1HD      PHE  91  20.511  -1.765 -12.029
  687    HD2  PHE  91           2HD      PHE  91  18.881  -5.675 -12.284
  688    HE1  PHE  91           1HE      PHE  91  22.806  -2.741 -11.743
  689    HE2  PHE  91           2HE      PHE  91  21.176  -6.650 -11.997
  690    HZ   PHE  91           HZ       PHE  91  23.111  -5.172 -11.730
  691    H    MET  92           H        MET  92  15.374  -1.835 -10.741
  692    HA   MET  92           HA       MET  92  16.943  -0.686  -8.659
  693   1HB   MET  92          1HB       MET  92  14.895   0.165 -10.384
  694   2HB   MET  92          2HB       MET  92  14.060   0.049  -8.848
  695   1HG   MET  92          1HG       MET  92  15.673   1.556  -7.778
  696   2HG   MET  92          2HG       MET  92  16.702   1.543  -9.197
  697   1HE   MET  92          1HE       MET  92  14.296   4.892  -8.400
  698   2HE   MET  92          2HE       MET  92  14.912   3.630  -7.306
  699   3HE   MET  92          3HE       MET  92  16.029   4.487  -8.395
  700    H    GLY  93           H        GLY  93  15.305  -3.525  -8.751
  701   1HA   GLY  93          1HA       GLY  93  14.395  -4.882  -7.209
  702   2HA   GLY  93          2HA       GLY  93  15.183  -3.892  -5.997
  703    H    GLY  94           H        GLY  94  13.036  -2.136  -8.110
  704   1HA   GLY  94          1HA       GLY  94  10.599  -2.122  -7.733
  705   2HA   GLY  94          2HA       GLY  94  10.943  -2.194  -6.017
  706    H    GLY  95           H        GLY  95  11.183  -0.182  -8.970
  707   1HA   GLY  95          1HA       GLY  95  12.186   2.122  -7.553
  708   2HA   GLY  95          2HA       GLY  95  11.693   2.022  -9.231
  709    H    PHE  96           H        PHE  96  10.961   3.533  -6.392
  710    HA   PHE  96           HA       PHE  96   8.076   3.355  -6.672
  711   1HB   PHE  96          1HB       PHE  96   9.442   5.281  -4.801
  712   2HB   PHE  96          2HB       PHE  96   8.120   4.182  -4.461
  713    HD1  PHE  96           1HD      PHE  96   8.648   1.725  -4.128
  714    HD2  PHE  96           2HD      PHE  96  11.658   4.714  -4.238
  715    HE1  PHE  96           1HE      PHE  96  10.243   0.161  -2.984
  716    HE2  PHE  96           2HE      PHE  96  13.253   3.150  -3.094
  717    HZ   PHE  96           HZ       PHE  96  12.527   0.892  -2.481
  718    H    THR  97           H        THR  97   7.071   4.671  -8.113
  719    HA   THR  97           HA       THR  97   8.174   7.386  -8.422
  720    HB   THR  97           HB       THR  97   7.160   5.375 -10.484
  721    HG1  THR  97           1HG      THR  97   9.357   5.385 -10.730
  722   1HG2  THR  97          1HG2      THR  97   6.635   7.046 -11.960
  723   2HG2  THR  97          2HG2      THR  97   6.574   8.137 -10.555
  724   3HG2  THR  97          3HG2      THR  97   8.075   7.985 -11.499
  725    H    ILE  98           H        ILE  98   6.832   9.006  -7.933
  726    HA   ILE  98           HA       ILE  98   3.996   8.290  -7.678
  727    HB   ILE  98           HB       ILE  98   4.962   8.806  -5.558
  728   1HG1  ILE  98          1HG1      ILE  98   3.714  11.255  -5.366
  729   2HG1  ILE  98          2HG1      ILE  98   2.959  10.573  -6.793
  730   1HG2  ILE  98          1HG2      ILE  98   6.942   9.982  -6.079
  731   2HG2  ILE  98          2HG2      ILE  98   6.052  11.274  -6.919
  732   3HG2  ILE  98          3HG2      ILE  98   5.932  11.114  -5.150
  733   1HD1  ILE  98          1HD1      ILE  98   3.292   8.755  -4.421
  734   2HD1  ILE  98          2HD1      ILE  98   2.055  10.031  -4.321
  735   3HD1  ILE  98          3HD1      ILE  98   1.982   8.820  -5.624
  736    H    ARG  99           H        ARG  99   2.528   9.316  -8.954
  737    HA   ARG  99           HA       ARG  99   3.631  11.412 -10.631
  738   1HB   ARG  99          1HB       ARG  99   1.578   9.262 -11.009
  739   2HB   ARG  99          2HB       ARG  99   1.210  10.789 -11.786
  740   1HG   ARG  99          1HG       ARG  99   3.190  10.732 -13.123
  741   2HG   ARG  99          2HG       ARG  99   3.961   9.539 -12.097
  742   1HD   ARG  99          1HD       ARG  99   3.022   7.808 -13.246
  743   2HD   ARG  99          2HD       ARG  99   1.420   8.511 -13.141
  744    HE   ARG  99           HE       ARG  99   1.688   9.148 -15.361
  745   1HH1  ARG  99          2HH2      ARG  99   4.852   9.168 -13.822
  746   2HH1  ARG  99          1HH2      ARG  99   5.687   9.673 -15.253
  747   1HH2  ARG  99          2HH1      ARG  99   2.789   9.813 -17.250
  748   2HH2  ARG  99          1HH1      ARG  99   4.505  10.042 -17.216
  749    H    ASN 100           H        ASN 100   2.666  13.481 -10.688
  750    HA   ASN 100           HA       ASN 100   0.312  13.780  -8.997
  751   1HB   ASN 100          1HB       ASN 100   2.437  14.639  -7.891
  752   2HB   ASN 100          2HB       ASN 100   2.646  15.754  -9.227
  753   1HD2  ASN 100          1HD2      ASN 100   1.354  15.292  -6.193
  754   2HD2  ASN 100          2HD2      ASN 100   0.268  16.639  -6.100
  755    HA   PRO 101           HA       PRO 101  -1.002  15.786 -12.701
  756   1HB   PRO 101          1HB       PRO 101  -3.510  16.515 -11.896
  757   2HB   PRO 101          2HB       PRO 101  -3.128  14.920 -12.515
  758   1HG   PRO 101          1HG       PRO 101  -3.632  15.753  -9.724
  759   2HG   PRO 101          2HG       PRO 101  -3.671  14.142 -10.413
  760   1HD   PRO 101          1HD       PRO 101  -1.583  15.268  -8.801
  761   2HD   PRO 101          2HD       PRO 101  -1.572  13.702  -9.587
  Start of MODEL   14
    1    H    MET   1           H        MET   1 -16.444   2.390  21.423
    2    HA   MET   1           HA       MET   1 -18.066   1.874  19.574
    3   1HB   MET   1          1HB       MET   1 -19.656   3.521  21.573
    4   2HB   MET   1          2HB       MET   1 -20.020   3.704  19.869
    5   1HG   MET   1          1HG       MET   1 -20.375   1.223  19.688
    6   2HG   MET   1          2HG       MET   1 -20.036   1.056  21.399
    7   1HE   MET   1          1HE       MET   1 -23.393   0.314  21.928
    8   2HE   MET   1          2HE       MET   1 -21.653   0.153  22.267
    9   3HE   MET   1          3HE       MET   1 -22.639   1.304  23.201
   10    H    GLN   2           H        GLN   2 -16.275   2.788  18.471
   11    HA   GLN   2           HA       GLN   2 -16.469   5.676  18.240
   12   1HB   GLN   2          1HB       GLN   2 -14.090   4.073  19.090
   13   2HB   GLN   2          2HB       GLN   2 -13.778   5.353  17.935
   14   1HG   GLN   2          1HG       GLN   2 -14.939   6.988  19.439
   15   2HG   GLN   2          2HG       GLN   2 -15.235   5.707  20.598
   16   1HE2  GLN   2          1HE2      GLN   2 -13.123   8.097  19.539
   17   2HE2  GLN   2          2HE2      GLN   2 -11.722   7.707  20.481
   18    H    GLU   3           H        GLU   3 -15.799   6.516  16.146
   19    HA   GLU   3           HA       GLU   3 -15.481   4.394  14.168
   20   1HB   GLU   3          1HB       GLU   3 -17.617   6.294  14.424
   21   2HB   GLU   3          2HB       GLU   3 -16.705   6.736  12.995
   22   1HG   GLU   3          1HG       GLU   3 -16.802   4.187  12.389
   23   2HG   GLU   3          2HG       GLU   3 -18.062   4.084  13.603
   24    H    GLN   4           H        GLN   4 -13.245   4.567  13.876
   25    HA   GLN   4           HA       GLN   4 -12.121   7.188  13.588
   26   1HB   GLN   4          1HB       GLN   4 -11.082   4.395  13.889
   27   2HB   GLN   4          2HB       GLN   4 -10.048   5.519  13.029
   28   1HG   GLN   4          1HG       GLN   4  -9.455   5.652  15.374
   29   2HG   GLN   4          2HG       GLN   4 -10.285   7.140  14.965
   30   1HE2  GLN   4          1HE2      GLN   4 -11.060   3.815  15.990
   31   2HE2  GLN   4          2HE2      GLN   4 -12.251   4.224  17.179
   32    H    ALA   5           H        ALA   5 -12.187   8.249  11.659
   33    HA   ALA   5           HA       ALA   5 -12.981   7.026   9.283
   34   1HB   ALA   5          1HB       ALA   5 -11.574   9.644   9.919
   35   2HB   ALA   5          2HB       ALA   5 -12.134   9.211   8.286
   36   3HB   ALA   5          3HB       ALA   5 -13.308   9.379   9.613
   37    H    GLN   6           H        GLN   6 -11.665   5.105   9.062
   38    HA   GLN   6           HA       GLN   6  -8.882   5.688   8.453
   39   1HB   GLN   6          1HB       GLN   6  -8.402   3.382   8.913
   40   2HB   GLN   6          2HB       GLN   6  -9.464   3.927  10.196
   41   1HG   GLN   6          1HG       GLN   6 -11.251   3.033   8.222
   42   2HG   GLN   6          2HG       GLN   6  -9.933   1.883   8.118
   43   1HE2  GLN   6          1HE2      GLN   6  -9.041   1.245  10.372
   44   2HE2  GLN   6          2HE2      GLN   6 -10.219   0.760  11.545
   45    H    GLN   7           H        GLN   7 -10.498   6.629   6.486
   46    HA   GLN   7           HA       GLN   7 -10.310   4.535   4.462
   47   1HB   GLN   7          1HB       GLN   7 -12.623   5.936   5.294
   48   2HB   GLN   7          2HB       GLN   7 -12.182   6.672   3.767
   49   1HG   GLN   7          1HG       GLN   7 -13.116   4.901   2.704
   50   2HG   GLN   7          2HG       GLN   7 -11.831   3.894   3.341
   51   1HE2  GLN   7          1HE2      GLN   7 -14.006   2.585   2.927
   52   2HE2  GLN   7          2HE2      GLN   7 -14.924   2.249   4.357
   53    H    PHE   8           H        PHE   8  -8.350   5.035   3.495
   54    HA   PHE   8           HA       PHE   8  -7.800   7.833   2.928
   55   1HB   PHE   8          1HB       PHE   8  -6.158   6.088   3.950
   56   2HB   PHE   8          2HB       PHE   8  -6.185   5.268   2.402
   57    HD1  PHE   8           1HD      PHE   8  -4.336   7.433   4.325
   58    HD2  PHE   8           2HD      PHE   8  -5.758   7.020   0.348
   59    HE1  PHE   8           1HE      PHE   8  -2.481   8.914   3.508
   60    HE2  PHE   8           2HE      PHE   8  -3.903   8.501  -0.469
   61    HZ   PHE   8           HZ       PHE   8  -2.287   9.430   1.120
   62    H    ILE   9           H        ILE   9  -8.119   8.734   0.945
   63    HA   ILE   9           HA       ILE   9  -9.023   6.990  -1.176
   64    HB   ILE   9           HB       ILE   9  -8.860   9.991  -0.898
   65   1HG1  ILE   9          1HG1      ILE   9 -10.539   8.514   0.460
   66   2HG1  ILE   9          2HG1      ILE   9 -11.082   9.987  -0.320
   67   1HG2  ILE   9          1HG2      ILE   9 -10.344   9.957  -2.956
   68   2HG2  ILE   9          2HG2      ILE   9  -8.622   9.589  -3.212
   69   3HG2  ILE   9          3HG2      ILE   9  -9.819   8.272  -3.191
   70   1HD1  ILE   9          1HD1      ILE   9 -11.252   7.253  -1.659
   71   2HD1  ILE   9          2HD1      ILE   9 -12.574   7.955  -0.696
   72   3HD1  ILE   9          3HD1      ILE   9 -12.030   8.766  -2.184
   73    H    PHE  10           H        PHE  10  -7.532   5.971  -2.402
   74    HA   PHE  10           HA       PHE  10  -5.486   7.572  -3.631
   75   1HB   PHE  10          1HB       PHE  10  -4.446   6.861  -1.468
   76   2HB   PHE  10          2HB       PHE  10  -4.959   5.207  -1.736
   77    HD1  PHE  10           1HD      PHE  10  -3.116   3.871  -2.072
   78    HD2  PHE  10           2HD      PHE  10  -3.212   7.692  -3.915
   79    HE1  PHE  10           1HE      PHE  10  -0.933   3.377  -3.208
   80    HE2  PHE  10           2HE      PHE  10  -1.029   7.198  -5.052
   81    HZ   PHE  10           HZ       PHE  10   0.085   5.047  -4.685
   82    H    LYS  11           H        LYS  11  -4.526   6.514  -5.490
   83    HA   LYS  11           HA       LYS  11  -5.777   3.957  -6.175
   84   1HB   LYS  11          1HB       LYS  11  -5.628   6.373  -8.004
   85   2HB   LYS  11          2HB       LYS  11  -6.188   4.777  -8.460
   86   1HG   LYS  11          1HG       LYS  11  -7.467   6.073  -6.057
   87   2HG   LYS  11          2HG       LYS  11  -7.888   6.699  -7.638
   88   1HD   LYS  11          1HD       LYS  11  -9.061   4.809  -8.230
   89   2HD   LYS  11          2HD       LYS  11  -7.912   3.728  -7.467
   90   1HE   LYS  11          1HE       LYS  11  -8.881   4.044  -5.290
   91   2HE   LYS  11          2HE       LYS  11  -9.759   5.474  -5.795
   92   1HZ   LYS  11          1HZ       LYS  11 -11.415   4.201  -6.446
   93   2HZ   LYS  11          2HZ       LYS  11 -10.460   3.295  -7.412
   94   3HZ   LYS  11          3HZ       LYS  11 -10.652   2.890  -5.842
   95    H    VAL  12           H        VAL  12  -4.110   2.549  -6.265
   96    HA   VAL  12           HA       VAL  12  -1.613   3.547  -7.448
   97    HB   VAL  12           HB       VAL  12  -1.844   2.680  -4.980
   98   1HG1  VAL  12          1HG1      VAL  12  -1.300   0.263  -4.800
   99   2HG1  VAL  12          2HG1      VAL  12  -2.919   0.561  -5.477
  100   3HG1  VAL  12          3HG1      VAL  12  -1.578   0.094  -6.550
  101   1HG2  VAL  12          1HG2      VAL  12   0.358   2.042  -6.952
  102   2HG2  VAL  12          2HG2      VAL  12   0.268   3.368  -5.767
  103   3HG2  VAL  12          3HG2      VAL  12   0.516   1.694  -5.213
  104    H    THR  13           H        THR  13  -0.534   2.224  -9.009
  105    HA   THR  13           HA       THR  13  -2.288   0.865 -10.747
  106    HB   THR  13           HB       THR  13  -0.012   0.286 -11.845
  107    HG1  THR  13           1HG      THR  13   0.925   0.490  -9.528
  108   1HG2  THR  13          1HG2      THR  13  -1.376   2.689 -11.847
  109   2HG2  THR  13          2HG2      THR  13   0.190   3.189 -11.164
  110   3HG2  THR  13          3HG2      THR  13   0.125   2.406 -12.761
  111    H    ASP  14           H        ASP  14  -1.441  -1.433 -11.630
  112    HA   ASP  14           HA       ASP  14  -2.081  -3.162  -9.489
  113   1HB   ASP  14          1HB       ASP  14  -1.728  -3.316 -12.430
  114   2HB   ASP  14          2HB       ASP  14  -1.217  -4.773 -11.603
  115    H    LYS  15           H        LYS  15   0.821  -1.892 -11.000
  116    HA   LYS  15           HA       LYS  15   2.566  -4.036 -10.482
  117   1HB   LYS  15          1HB       LYS  15   2.685  -1.622 -11.825
  118   2HB   LYS  15          2HB       LYS  15   3.749  -1.348 -10.461
  119   1HG   LYS  15          1HG       LYS  15   3.929  -3.860 -12.179
  120   2HG   LYS  15          2HG       LYS  15   4.811  -2.398 -12.571
  121   1HD   LYS  15          1HD       LYS  15   6.384  -2.816 -10.984
  122   2HD   LYS  15          2HD       LYS  15   5.168  -3.062  -9.746
  123   1HE   LYS  15          1HE       LYS  15   5.366  -5.276 -11.734
  124   2HE   LYS  15          2HE       LYS  15   6.801  -5.052 -10.753
  125   1HZ   LYS  15          1HZ       LYS  15   4.267  -4.996  -9.371
  126   2HZ   LYS  15          2HZ       LYS  15   4.755  -6.446  -9.942
  127   3HZ   LYS  15          3HZ       LYS  15   5.699  -5.621  -8.895
  128    H    ALA  16           H        ALA  16   1.678  -1.056  -8.633
  129    HA   ALA  16           HA       ALA  16   3.449  -1.470  -6.528
  130   1HB   ALA  16          1HB       ALA  16   0.919  -0.262  -5.720
  131   2HB   ALA  16          2HB       ALA  16   2.533   0.475  -5.862
  132   3HB   ALA  16          3HB       ALA  16   1.471   0.377  -7.287
  133    H    VAL  17           H        VAL  17  -0.077  -2.323  -6.805
  134    HA   VAL  17           HA       VAL  17  -0.259  -3.638  -4.385
  135    HB   VAL  17           HB       VAL  17  -1.735  -3.609  -6.962
  136   1HG1  VAL  17          1HG1      VAL  17  -3.362  -5.315  -5.974
  137   2HG1  VAL  17          2HG1      VAL  17  -1.841  -5.952  -6.645
  138   3HG1  VAL  17          3HG1      VAL  17  -2.038  -5.787  -4.883
  139   1HG2  VAL  17          1HG2      VAL  17  -3.167  -2.339  -5.798
  140   2HG2  VAL  17          2HG2      VAL  17  -3.250  -3.516  -4.465
  141   3HG2  VAL  17          3HG2      VAL  17  -1.938  -2.313  -4.510
  142    H    GLU  18           H        GLU  18   0.718  -4.851  -7.643
  143    HA   GLU  18           HA       GLU  18   0.881  -7.506  -6.934
  144   1HB   GLU  18          1HB       GLU  18   2.014  -5.773  -9.096
  145   2HB   GLU  18          2HB       GLU  18   2.800  -7.321  -8.858
  146   1HG   GLU  18          1HG       GLU  18   0.172  -8.107  -8.769
  147   2HG   GLU  18          2HG       GLU  18   0.036  -6.723  -9.835
  148    H    GLU  19           H        GLU  19   3.233  -4.807  -6.610
  149    HA   GLU  19           HA       GLU  19   5.448  -6.297  -5.999
  150   1HB   GLU  19          1HB       GLU  19   5.583  -3.907  -6.443
  151   2HB   GLU  19          2HB       GLU  19   4.585  -3.534  -5.051
  152   1HG   GLU  19          1HG       GLU  19   6.559  -3.265  -3.937
  153   2HG   GLU  19          2HG       GLU  19   6.598  -5.015  -3.869
  154    H    ILE  20           H        ILE  20   2.836  -5.025  -3.841
  155    HA   ILE  20           HA       ILE  20   3.939  -5.803  -1.431
  156    HB   ILE  20           HB       ILE  20   0.994  -5.884  -2.026
  157   1HG1  ILE  20          1HG1      ILE  20   1.424  -3.902  -3.107
  158   2HG1  ILE  20          2HG1      ILE  20   1.182  -3.340  -1.466
  159   1HG2  ILE  20          1HG2      ILE  20   0.894  -6.112   0.180
  160   2HG2  ILE  20          2HG2      ILE  20   2.651  -5.875   0.343
  161   3HG2  ILE  20          3HG2      ILE  20   1.561  -4.468   0.327
  162   1HD1  ILE  20          1HD1      ILE  20   3.183  -2.271  -1.856
  163   2HD1  ILE  20          2HD1      ILE  20   3.858  -3.840  -1.356
  164   3HD1  ILE  20          3HD1      ILE  20   3.692  -3.453  -3.086
  165    H    LYS  21           H        LYS  21   2.110  -7.664  -3.893
  166    HA   LYS  21           HA       LYS  21   1.756  -9.950  -2.296
  167   1HB   LYS  21          1HB       LYS  21   1.760  -9.518  -5.294
  168   2HB   LYS  21          2HB       LYS  21   1.378 -11.054  -4.544
  169   1HG   LYS  21          1HG       LYS  21  -0.609 -10.253  -3.572
  170   2HG   LYS  21          2HG       LYS  21  -0.055  -8.590  -3.548
  171   1HD   LYS  21          1HD       LYS  21  -0.726  -8.183  -5.719
  172   2HD   LYS  21          2HD       LYS  21  -0.288  -9.788  -6.272
  173   1HE   LYS  21          1HE       LYS  21  -2.329 -10.634  -4.884
  174   2HE   LYS  21          2HE       LYS  21  -2.815  -8.953  -4.792
  175   1HZ   LYS  21          1HZ       LYS  21  -3.404 -10.591  -6.805
  176   2HZ   LYS  21          2HZ       LYS  21  -3.407  -8.962  -6.919
  177   3HZ   LYS  21          3HZ       LYS  21  -2.108  -9.814  -7.422
  178    H    LYS  22           H        LYS  22   4.366  -8.833  -4.504
  179    HA   LYS  22           HA       LYS  22   5.814 -11.170  -4.635
  180   1HB   LYS  22          1HB       LYS  22   6.688  -8.271  -4.667
  181   2HB   LYS  22          2HB       LYS  22   7.776  -9.604  -4.997
  182   1HG   LYS  22          1HG       LYS  22   5.846 -10.339  -6.704
  183   2HG   LYS  22          2HG       LYS  22   5.407  -8.645  -6.610
  184   1HD   LYS  22          1HD       LYS  22   8.242  -8.683  -6.908
  185   2HD   LYS  22          2HD       LYS  22   7.636  -9.886  -8.029
  186   1HE   LYS  22          1HE       LYS  22   5.903  -7.584  -8.199
  187   2HE   LYS  22          2HE       LYS  22   7.557  -7.009  -8.276
  188   1HZ   LYS  22          1HZ       LYS  22   6.214  -8.892 -10.050
  189   2HZ   LYS  22          2HZ       LYS  22   7.071  -7.555 -10.432
  190   3HZ   LYS  22          3HZ       LYS  22   7.843  -8.906  -9.936
  191    H    VAL  23           H        VAL  23   5.985  -8.509  -2.178
  192    HA   VAL  23           HA       VAL  23   7.945  -9.857  -0.640
  193    HB   VAL  23           HB       VAL  23   6.282  -7.417  -0.472
  194   1HG1  VAL  23          1HG1      VAL  23   5.680  -8.220   1.673
  195   2HG1  VAL  23          2HG1      VAL  23   7.316  -8.847   1.987
  196   3HG1  VAL  23          3HG1      VAL  23   7.029  -7.091   1.946
  197   1HG2  VAL  23          1HG2      VAL  23   8.335  -6.761  -1.143
  198   2HG2  VAL  23          2HG2      VAL  23   8.733  -6.841   0.590
  199   3HG2  VAL  23          3HG2      VAL  23   9.128  -8.209  -0.478
  200    H    ALA  24           H        ALA  24   4.459 -10.083  -0.983
  201    HA   ALA  24           HA       ALA  24   4.011 -11.222   1.596
  202   1HB   ALA  24          1HB       ALA  24   2.113 -11.739  -0.637
  203   2HB   ALA  24          2HB       ALA  24   1.812 -11.095   0.995
  204   3HB   ALA  24          3HB       ALA  24   2.444 -10.027  -0.280
  205    H    GLN  25           H        GLN  25   4.222 -12.496  -1.798
  206    HA   GLN  25           HA       GLN  25   3.812 -15.118  -1.190
  207   1HB   GLN  25          1HB       GLN  25   4.822 -13.567  -3.426
  208   2HB   GLN  25          2HB       GLN  25   5.771 -15.032  -3.267
  209   1HG   GLN  25          1HG       GLN  25   2.966 -15.677  -2.869
  210   2HG   GLN  25          2HG       GLN  25   3.132 -14.756  -4.351
  211   1HE2  GLN  25          1HE2      GLN  25   3.525 -17.745  -2.814
  212   2HE2  GLN  25          2HE2      GLN  25   4.312 -18.627  -4.080
  213    H    GLU  26           H        GLU  26   6.763 -13.122  -0.868
  214    HA   GLU  26           HA       GLU  26   8.480 -15.300  -0.447
  215   1HB   GLU  26          1HB       GLU  26   8.621 -12.363  -0.406
  216   2HB   GLU  26          2HB       GLU  26   9.626 -13.080   0.838
  217   1HG   GLU  26          1HG       GLU  26   9.737 -14.308  -1.911
  218   2HG   GLU  26          2HG       GLU  26  10.498 -12.744  -1.696
  219    H    ASN  27           H        ASN  27   5.907 -14.141   1.391
  220    HA   ASN  27           HA       ASN  27   7.067 -15.367   3.752
  221   1HB   ASN  27          1HB       ASN  27   5.774 -12.636   3.509
  222   2HB   ASN  27          2HB       ASN  27   5.521 -13.541   4.989
  223   1HD2  ASN  27          1HD2      ASN  27   7.458 -11.369   3.432
  224   2HD2  ASN  27          2HD2      ASN  27   8.913 -11.494   4.362
  225    H    ASN  28           H        ASN  28   5.010 -15.863   1.401
  226    HA   ASN  28           HA       ASN  28   2.974 -16.594   1.083
  227   1HB   ASN  28          1HB       ASN  28   4.276 -18.368   2.642
  228   2HB   ASN  28          2HB       ASN  28   3.017 -17.956   3.789
  229   1HD2  ASN  28          1HD2      ASN  28   1.667 -19.596   3.799
  230   2HD2  ASN  28          2HD2      ASN  28   0.892 -20.314   2.426
  231    H    ILE  29           H        ILE  29   2.835 -14.000   2.157
  232    HA   ILE  29           HA       ILE  29   0.884 -14.132   4.323
  233    HB   ILE  29           HB       ILE  29   2.766 -12.084   3.267
  234   1HG1  ILE  29          1HG1      ILE  29   1.973 -13.171   5.968
  235   2HG1  ILE  29          2HG1      ILE  29   3.528 -13.262   5.165
  236   1HG2  ILE  29          1HG2      ILE  29   0.227 -11.369   4.760
  237   2HG2  ILE  29          2HG2      ILE  29   1.574 -10.269   4.384
  238   3HG2  ILE  29          3HG2      ILE  29   0.599 -10.963   3.067
  239   1HD1  ILE  29          1HD1      ILE  29   3.950 -11.512   6.635
  240   2HD1  ILE  29          2HD1      ILE  29   3.346 -10.585   5.240
  241   3HD1  ILE  29          3HD1      ILE  29   2.263 -10.943   6.607
  242    H    GLU  30           H        GLU  30  -1.167 -14.483   3.642
  243    HA   GLU  30           HA       GLU  30  -1.928 -13.614   1.036
  244   1HB   GLU  30          1HB       GLU  30  -2.833 -15.548   2.958
  245   2HB   GLU  30          2HB       GLU  30  -4.183 -14.485   2.617
  246   1HG   GLU  30          1HG       GLU  30  -3.430 -14.823   0.081
  247   2HG   GLU  30          2HG       GLU  30  -2.636 -16.253   0.709
  248    H    ASN  31           H        ASN  31  -1.381 -11.881   3.731
  249    HA   ASN  31           HA       ASN  31  -3.375  -9.954   2.977
  250   1HB   ASN  31          1HB       ASN  31  -3.655  -9.596   5.632
  251   2HB   ASN  31          2HB       ASN  31  -4.679 -10.718   4.760
  252   1HD2  ASN  31          1HD2      ASN  31  -2.441 -10.295   7.242
  253   2HD2  ASN  31          2HD2      ASN  31  -2.149 -11.948   7.671
  254    HA   PRO  32           HA       PRO  32   0.803  -8.412   4.109
  255   1HB   PRO  32          1HB       PRO  32   1.464  -7.259   1.720
  256   2HB   PRO  32          2HB       PRO  32   1.946  -8.884   2.166
  257   1HG   PRO  32          1HG       PRO  32  -0.157  -8.029   0.274
  258   2HG   PRO  32          2HG       PRO  32   0.621  -9.593   0.417
  259   1HD   PRO  32          1HD       PRO  32  -2.005  -8.892   1.335
  260   2HD   PRO  32          2HD       PRO  32  -1.182 -10.420   1.580
  261    H    ILE  33           H        ILE  33   0.645  -6.773   5.493
  262    HA   ILE  33           HA       ILE  33  -0.993  -4.541   4.549
  263    HB   ILE  33           HB       ILE  33  -0.230  -5.579   7.259
  264   1HG1  ILE  33          1HG1      ILE  33  -2.965  -4.723   6.354
  265   2HG1  ILE  33          2HG1      ILE  33  -2.318  -6.262   5.820
  266   1HG2  ILE  33          1HG2      ILE  33  -1.118  -3.604   8.313
  267   2HG2  ILE  33          2HG2      ILE  33   0.211  -3.136   7.226
  268   3HG2  ILE  33          3HG2      ILE  33  -1.478  -2.869   6.731
  269   1HD1  ILE  33          1HD1      ILE  33  -2.453  -7.206   7.911
  270   2HD1  ILE  33          2HD1      ILE  33  -1.989  -5.697   8.733
  271   3HD1  ILE  33          3HD1      ILE  33  -3.663  -5.927   8.173
  272    H    LEU  34           H        LEU  34   0.383  -3.338   3.253
  273    HA   LEU  34           HA       LEU  34   2.960  -2.618   4.437
  274   1HB   LEU  34          1HB       LEU  34   3.775  -2.284   2.324
  275   2HB   LEU  34          2HB       LEU  34   2.705  -3.654   2.105
  276    HG   LEU  34           HG       LEU  34   2.344  -2.264   0.246
  277   1HD1  LEU  34          1HD1      LEU  34   0.265  -3.104   1.077
  278   2HD1  LEU  34          2HD1      LEU  34   0.145  -1.791   2.273
  279   3HD1  LEU  34          3HD1      LEU  34   0.002  -1.429   0.536
  280   1HD2  LEU  34          1HD2      LEU  34   1.846   0.150   1.992
  281   2HD2  LEU  34          2HD2      LEU  34   3.455  -0.255   1.346
  282   3HD2  LEU  34          3HD2      LEU  34   2.107   0.079   0.233
  283    H    ARG  35           H        ARG  35   3.627  -0.360   4.461
  284    HA   ARG  35           HA       ARG  35   1.324   1.419   4.384
  285   1HB   ARG  35          1HB       ARG  35   2.071   2.532   6.387
  286   2HB   ARG  35          2HB       ARG  35   2.161   0.818   6.740
  287   1HG   ARG  35          1HG       ARG  35   4.599   0.825   6.207
  288   2HG   ARG  35          2HG       ARG  35   4.518   2.531   5.818
  289   1HD   ARG  35          1HD       ARG  35   4.193   3.175   8.068
  290   2HD   ARG  35          2HD       ARG  35   3.534   1.619   8.531
  291    HE   ARG  35           HE       ARG  35   6.178   1.101   7.719
  292   1HH1  ARG  35          2HH2      ARG  35   4.589   3.038  10.190
  293   2HH1  ARG  35          1HH2      ARG  35   5.911   2.932  11.304
  294   1HH2  ARG  35          2HH1      ARG  35   7.922   0.960   9.189
  295   2HH2  ARG  35          1HH1      ARG  35   7.819   1.742  10.731
  296    H    ILE  36           H        ILE  36   1.742   3.573   3.589
  297    HA   ILE  36           HA       ILE  36   4.183   3.735   2.026
  298    HB   ILE  36           HB       ILE  36   1.795   4.151   1.180
  299   1HG1  ILE  36          1HG1      ILE  36   2.660   6.074  -0.280
  300   2HG1  ILE  36          2HG1      ILE  36   4.144   5.977   0.646
  301   1HG2  ILE  36          1HG2      ILE  36   2.296   6.867   2.424
  302   2HG2  ILE  36          2HG2      ILE  36   0.902   6.372   1.434
  303   3HG2  ILE  36          3HG2      ILE  36   1.147   5.658   3.046
  304   1HD1  ILE  36          1HD1      ILE  36   3.462   3.290  -0.061
  305   2HD1  ILE  36          2HD1      ILE  36   3.262   4.283  -1.525
  306   3HD1  ILE  36          3HD1      ILE  36   4.822   4.266  -0.668
  307    H    ARG  37           H        ARG  37   5.703   5.440   2.200
  308    HA   ARG  37           HA       ARG  37   5.306   7.197   4.459
  309   1HB   ARG  37          1HB       ARG  37   6.857   4.964   4.792
  310   2HB   ARG  37          2HB       ARG  37   8.069   6.057   4.154
  311   1HG   ARG  37          1HG       ARG  37   7.391   7.753   5.917
  312   2HG   ARG  37          2HG       ARG  37   6.300   6.560   6.593
  313   1HD   ARG  37          1HD       ARG  37   8.621   5.083   6.464
  314   2HD   ARG  37          2HD       ARG  37   9.284   6.685   6.716
  315    HE   ARG  37           HE       ARG  37   7.744   5.116   8.641
  316   1HH1  ARG  37          2HH2      ARG  37   8.678   8.377   7.706
  317   2HH1  ARG  37          1HH2      ARG  37   8.440   9.037   9.290
  318   1HH2  ARG  37          2HH1      ARG  37   7.429   5.986  10.731
  319   2HH2  ARG  37          1HH1      ARG  37   7.724   7.667  11.022
  320    H    VAL  38           H        VAL  38   7.040   9.015   4.442
  321    HA   VAL  38           HA       VAL  38   7.589   9.679   1.644
  322    HB   VAL  38           HB       VAL  38   7.742  11.603   3.936
  323   1HG1  VAL  38          1HG1      VAL  38   6.533  12.871   1.837
  324   2HG1  VAL  38          2HG1      VAL  38   8.287  12.854   2.139
  325   3HG1  VAL  38          3HG1      VAL  38   7.571  11.700   0.988
  326   1HG2  VAL  38          1HG2      VAL  38   5.628  11.014   4.507
  327   2HG2  VAL  38          2HG2      VAL  38   5.199  12.005   3.092
  328   3HG2  VAL  38          3HG2      VAL  38   5.304  10.235   2.940
  329    H    VAL  39           H        VAL  39   9.661   9.850   0.898
  330    HA   VAL  39           HA       VAL  39  11.773   9.734   2.938
  331    HB   VAL  39           HB       VAL  39  11.719   8.410   0.219
  332   1HG1  VAL  39          1HG1      VAL  39  13.945   9.271   1.414
  333   2HG1  VAL  39          2HG1      VAL  39  13.749   7.745   2.310
  334   3HG1  VAL  39          3HG1      VAL  39  13.880   7.724   0.535
  335   1HG2  VAL  39          1HG2      VAL  39  11.786   6.949   2.854
  336   2HG2  VAL  39          2HG2      VAL  39  10.239   7.471   2.143
  337   3HG2  VAL  39          3HG2      VAL  39  11.301   6.360   1.245
  338    HA   PRO  40           HA       PRO  40  12.476  13.484   0.642
  339   1HB   PRO  40          1HB       PRO  40  13.472  14.941   2.728
  340   2HB   PRO  40          2HB       PRO  40  11.772  14.910   2.306
  341   1HG   PRO  40          1HG       PRO  40  13.148  13.574   4.555
  342   2HG   PRO  40          2HG       PRO  40  11.439  13.908   4.357
  343   1HD   PRO  40          1HD       PRO  40  12.746  11.379   4.004
  344   2HD   PRO  40          2HD       PRO  40  11.059  11.739   3.694
  345    H    GLY  41           H        GLY  41  13.993  12.402  -0.681
  346   1HA   GLY  41          1HA       GLY  41  16.408  13.298  -0.958
  347   2HA   GLY  41          2HA       GLY  41  16.696  12.323   0.469
  348    H    GLY  42           H        GLY  42  15.779  12.273  -2.980
  349   1HA   GLY  42          1HA       GLY  42  16.407   9.382  -3.021
  350   2HA   GLY  42          2HA       GLY  42  15.100  10.085  -3.954
  351    H    CYS  43           H        CYS  43  17.987   8.791  -4.457
  352    HA   CYS  43           HA       CYS  43  19.567  10.687  -5.675
  353   1HB   CYS  43          1HB       CYS  43  19.376   7.759  -5.646
  354   2HB   CYS  43          2HB       CYS  43  19.993   8.381  -7.164
  355    HG   CYS  43           HG       CYS  43  20.983   9.700  -4.327
  356    H    SER  44           H        SER  44  16.933   8.571  -7.007
  357    HA   SER  44           HA       SER  44  17.151   9.780  -9.565
  358   1HB   SER  44          1HB       SER  44  16.171   7.386  -8.658
  359   2HB   SER  44          2HB       SER  44  14.673   8.275  -8.849
  360    HG   SER  44           HG       SER  44  16.150   8.782 -11.050
  361    H    GLY  45           H        GLY  45  15.031  10.042  -6.672
  362   1HA   GLY  45          1HA       GLY  45  14.348  12.681  -7.005
  363   2HA   GLY  45          2HA       GLY  45  13.129  11.789  -7.893
  364    H    PHE  46           H        PHE  46  12.234  13.236  -5.760
  365    HA   PHE  46           HA       PHE  46  12.230  11.576  -3.406
  366   1HB   PHE  46          1HB       PHE  46  10.728  13.495  -2.623
  367   2HB   PHE  46          2HB       PHE  46  12.280  14.042  -3.226
  368    HD1  PHE  46           1HD      PHE  46  12.442  15.276  -5.308
  369    HD2  PHE  46           2HD      PHE  46   8.684  13.905  -3.892
  370    HE1  PHE  46           1HE      PHE  46  11.276  16.794  -6.931
  371    HE2  PHE  46           2HE      PHE  46   7.518  15.423  -5.515
  372    HZ   PHE  46           HZ       PHE  46   8.828  16.849  -7.016
  373    H    GLN  47           H        GLN  47  10.943   9.793  -3.330
  374    HA   GLN  47           HA       GLN  47   8.192  10.170  -4.121
  375   1HB   GLN  47          1HB       GLN  47  10.002   7.984  -5.223
  376   2HB   GLN  47          2HB       GLN  47   8.254   7.872  -5.266
  377   1HG   GLN  47          1HG       GLN  47   8.534   8.900  -7.310
  378   2HG   GLN  47          2HG       GLN  47   8.515  10.353  -6.329
  379   1HE2  GLN  47          1HE2      GLN  47   9.689  10.986  -8.385
  380   2HE2  GLN  47          2HE2      GLN  47  11.419  10.899  -8.371
  381    H    TYR  48           H        TYR  48   7.031   7.818  -3.572
  382    HA   TYR  48           HA       TYR  48   7.885   7.293  -0.815
  383   1HB   TYR  48          1HB       TYR  48   5.288   6.898  -2.429
  384   2HB   TYR  48          2HB       TYR  48   5.446   6.437  -0.746
  385    HD1  TYR  48           1HD      TYR  48   6.048   9.471  -2.885
  386    HD2  TYR  48           2HD      TYR  48   4.601   7.912   0.827
  387    HE1  TYR  48           1HE      TYR  48   5.340  11.806  -2.173
  388    HE2  TYR  48           2HE      TYR  48   3.898  10.253   1.527
  389    HH   TYR  48           HH       TYR  48   4.682  12.621   0.927
  390    H    ALA  49           H        ALA  49   8.435   5.245  -0.135
  391    HA   ALA  49           HA       ALA  49   8.552   3.227  -2.249
  392   1HB   ALA  49          1HB       ALA  49  10.183   2.141  -0.681
  393   2HB   ALA  49          2HB       ALA  49  10.675   3.770  -1.200
  394   3HB   ALA  49          3HB       ALA  49   9.983   3.525   0.421
  395    H    MET  50           H        MET  50   8.043   0.943  -1.615
  396    HA   MET  50           HA       MET  50   5.848   0.974   0.309
  397   1HB   MET  50          1HB       MET  50   6.264  -0.268  -2.397
  398   2HB   MET  50          2HB       MET  50   5.443  -1.288  -1.232
  399   1HG   MET  50          1HG       MET  50   3.613   0.203  -1.007
  400   2HG   MET  50          2HG       MET  50   4.535   1.584  -1.568
  401   1HE   MET  50          1HE       MET  50   1.770   0.632  -2.193
  402   2HE   MET  50          2HE       MET  50   1.483   0.437  -3.939
  403   3HE   MET  50          3HE       MET  50   1.798  -0.991  -2.924
  404    H    GLY  51           H        GLY  51   5.483  -1.083   1.535
  405   1HA   GLY  51          1HA       GLY  51   7.317  -3.196   1.568
  406   2HA   GLY  51          2HA       GLY  51   7.858  -2.003   2.732
  407    H    PHE  52           H        PHE  52   6.327  -4.827   2.690
  408    HA   PHE  52           HA       PHE  52   3.884  -4.310   3.992
  409   1HB   PHE  52          1HB       PHE  52   4.222  -6.449   2.922
  410   2HB   PHE  52          2HB       PHE  52   5.829  -6.627   3.598
  411    HD1  PHE  52           1HD      PHE  52   6.137  -7.424   5.887
  412    HD2  PHE  52           2HD      PHE  52   2.259  -7.069   4.200
  413    HE1  PHE  52           1HE      PHE  52   5.205  -8.856   7.726
  414    HE2  PHE  52           2HE      PHE  52   1.328  -8.501   6.039
  415    HZ   PHE  52           HZ       PHE  52   2.812  -9.378   7.780
  416    H    ASP  53           H        ASP  53   3.419  -3.868   6.105
  417    HA   ASP  53           HA       ASP  53   5.662  -3.635   7.872
  418   1HB   ASP  53          1HB       ASP  53   3.607  -2.009   7.576
  419   2HB   ASP  53          2HB       ASP  53   2.755  -3.144   8.604
  420    H    ASP  54           H        ASP  54   4.972  -4.316  10.347
  421    HA   ASP  54           HA       ASP  54   4.701  -7.106  10.246
  422   1HB   ASP  54          1HB       ASP  54   4.987  -4.998  12.373
  423   2HB   ASP  54          2HB       ASP  54   4.370  -6.556  12.888
  424    H    THR  55           H        THR  55   2.617  -4.310  11.185
  425    HA   THR  55           HA       THR  55   0.239  -5.781  10.683
  426    HB   THR  55           HB       THR  55   1.225  -6.449  13.103
  427    HG1  THR  55           1HG      THR  55  -0.916  -7.099  13.285
  428   1HG2  THR  55          1HG2      THR  55   0.880  -3.740  13.559
  429   2HG2  THR  55          2HG2      THR  55  -0.713  -4.378  14.030
  430   3HG2  THR  55          3HG2      THR  55   0.758  -4.984  14.827
  431    H    VAL  56           H        VAL  56  -1.700  -4.319  11.768
  432    HA   VAL  56           HA       VAL  56  -1.248  -1.764  10.512
  433    HB   VAL  56           HB       VAL  56  -3.440  -3.523  11.047
  434   1HG1  VAL  56          1HG1      VAL  56  -3.850  -2.056  13.009
  435   2HG1  VAL  56          2HG1      VAL  56  -3.946  -0.657  11.913
  436   3HG1  VAL  56          3HG1      VAL  56  -5.147  -1.965  11.794
  437   1HG2  VAL  56          1HG2      VAL  56  -4.382  -2.499   9.186
  438   2HG2  VAL  56          2HG2      VAL  56  -3.668  -0.913   9.565
  439   3HG2  VAL  56          3HG2      VAL  56  -2.643  -2.221   8.928
  440    H    GLU  57           H        GLU  57  -1.767   0.298  11.597
  441    HA   GLU  57           HA       GLU  57  -0.735   0.209  14.282
  442   1HB   GLU  57          1HB       GLU  57  -1.469   2.705  12.714
  443   2HB   GLU  57          2HB       GLU  57  -0.323   2.559  14.031
  444   1HG   GLU  57          1HG       GLU  57   0.638   0.709  12.155
  445   2HG   GLU  57          2HG       GLU  57   0.054   2.021  11.150
  446    H    GLU  58           H        GLU  58  -1.791   1.938  15.862
  447    HA   GLU  58           HA       GLU  58  -4.560   1.187  15.982
  448   1HB   GLU  58          1HB       GLU  58  -2.885   1.152  17.953
  449   2HB   GLU  58          2HB       GLU  58  -3.035   2.898  17.982
  450   1HG   GLU  58          1HG       GLU  58  -4.992   2.754  19.116
  451   2HG   GLU  58          2HG       GLU  58  -5.696   1.778  17.842
  452    H    GLY  59           H        GLY  59  -3.484   3.155  13.926
  453   1HA   GLY  59          1HA       GLY  59  -5.615   4.958  13.917
  454   2HA   GLY  59          2HA       GLY  59  -4.242   5.778  14.634
  455    H    ASP  60           H        ASP  60  -4.918   3.537  11.843
  456    HA   ASP  60           HA       ASP  60  -3.424   5.412  10.204
  457   1HB   ASP  60          1HB       ASP  60  -2.480   2.867  10.962
  458   2HB   ASP  60          2HB       ASP  60  -3.134   2.602   9.358
  459    H    HIS  61           H        HIS  61  -4.409   5.716   8.143
  460    HA   HIS  61           HA       HIS  61  -7.041   4.772   7.849
  461   1HB   HIS  61          1HB       HIS  61  -5.264   6.092   5.780
  462   2HB   HIS  61          2HB       HIS  61  -7.012   5.982   5.739
  463    HD1  HIS  61           1HD      HIS  61  -5.807   6.708   9.136
  464    HD2  HIS  61           2HD      HIS  61  -6.770   8.919   5.704
  465    HE1  HIS  61           1HE      HIS  61  -6.100   9.125   9.901
  466    H    VAL  62           H        VAL  62  -7.069   2.491   7.845
  467    HA   VAL  62           HA       VAL  62  -5.370   1.050   6.053
  468    HB   VAL  62           HB       VAL  62  -6.622   0.479   8.377
  469   1HG1  VAL  62          1HG1      VAL  62  -8.418  -1.106   8.017
  470   2HG1  VAL  62          2HG1      VAL  62  -8.847   0.445   7.258
  471   3HG1  VAL  62          3HG1      VAL  62  -8.286  -0.913   6.253
  472   1HG2  VAL  62          1HG2      VAL  62  -4.927  -0.967   7.943
  473   2HG2  VAL  62          2HG2      VAL  62  -6.263  -2.035   7.453
  474   3HG2  VAL  62          3HG2      VAL  62  -5.354  -1.126   6.223
  475    H    PHE  63           H        PHE  63  -5.685   0.877   3.901
  476    HA   PHE  63           HA       PHE  63  -8.455   1.131   2.960
  477   1HB   PHE  63          1HB       PHE  63  -6.267   2.730   2.423
  478   2HB   PHE  63          2HB       PHE  63  -6.034   1.513   1.184
  479    HD1  PHE  63           1HD      PHE  63  -6.602   2.498  -0.830
  480    HD2  PHE  63           2HD      PHE  63  -9.169   3.048   2.504
  481    HE1  PHE  63           1HE      PHE  63  -8.260   3.677  -2.301
  482    HE2  PHE  63           2HE      PHE  63 -10.826   4.227   1.034
  483    HZ   PHE  63           HZ       PHE  63 -10.352   4.527  -1.351
  484    H    GLU  64           H        GLU  64  -9.308  -0.748   2.219
  485    HA   GLU  64           HA       GLU  64  -7.728  -3.012   1.876
  486   1HB   GLU  64          1HB       GLU  64 -10.563  -2.454   0.898
  487   2HB   GLU  64          2HB       GLU  64  -9.828  -4.042   0.992
  488   1HG   GLU  64          1HG       GLU  64  -9.583  -3.840   3.437
  489   2HG   GLU  64          2HG       GLU  64 -10.155  -2.184   3.394
  490    H    TYR  65           H        TYR  65  -6.934  -4.071   0.016
  491    HA   TYR  65           HA       TYR  65  -7.143  -2.491  -2.459
  492   1HB   TYR  65          1HB       TYR  65  -4.940  -3.758  -0.854
  493   2HB   TYR  65          2HB       TYR  65  -4.844  -4.115  -2.567
  494    HD1  TYR  65           1HD      TYR  65  -6.312  -0.921  -1.570
  495    HD2  TYR  65           2HD      TYR  65  -2.679  -2.906  -2.648
  496    HE1  TYR  65           1HE      TYR  65  -5.196   1.327  -1.978
  497    HE2  TYR  65           2HE      TYR  65  -1.575  -0.652  -3.052
  498    HH   TYR  65           HH       TYR  65  -1.966   1.512  -3.356
  499    H    ASP  66           H        ASP  66  -5.879  -4.352  -4.165
  500    HA   ASP  66           HA       ASP  66  -8.044  -6.004  -4.720
  501   1HB   ASP  66          1HB       ASP  66  -6.085  -5.078  -6.233
  502   2HB   ASP  66          2HB       ASP  66  -5.226  -6.519  -5.728
  503    H    GLY  67           H        GLY  67  -8.090  -7.014  -2.415
  504   1HA   GLY  67          1HA       GLY  67  -7.967  -8.984  -1.292
  505   2HA   GLY  67          2HA       GLY  67  -6.877  -9.620  -2.508
  506    H    VAL  68           H        VAL  68  -6.086  -6.472  -1.151
  507    HA   VAL  68           HA       VAL  68  -4.281  -7.703   0.786
  508    HB   VAL  68           HB       VAL  68  -3.452  -5.753  -1.373
  509   1HG1  VAL  68          1HG1      VAL  68  -1.156  -6.107  -0.418
  510   2HG1  VAL  68          2HG1      VAL  68  -2.269  -5.218   0.649
  511   3HG1  VAL  68          3HG1      VAL  68  -1.917  -6.934   0.962
  512   1HG2  VAL  68          1HG2      VAL  68  -1.798  -7.845  -1.700
  513   2HG2  VAL  68          2HG2      VAL  68  -3.224  -8.709  -1.076
  514   3HG2  VAL  68          3HG2      VAL  68  -3.360  -7.707  -2.541
  515    H    LYS  69           H        LYS  69  -3.305  -5.946   2.247
  516    HA   LYS  69           HA       LYS  69  -5.359  -3.883   2.635
  517   1HB   LYS  69          1HB       LYS  69  -3.666  -5.420   4.617
  518   2HB   LYS  69          2HB       LYS  69  -4.529  -3.956   5.046
  519   1HG   LYS  69          1HG       LYS  69  -6.508  -5.064   5.176
  520   2HG   LYS  69          2HG       LYS  69  -6.301  -5.751   3.577
  521   1HD   LYS  69          1HD       LYS  69  -5.343  -7.714   4.380
  522   2HD   LYS  69          2HD       LYS  69  -4.601  -6.923   5.756
  523   1HE   LYS  69          1HE       LYS  69  -6.549  -7.040   7.062
  524   2HE   LYS  69          2HE       LYS  69  -7.615  -7.044   5.671
  525   1HZ   LYS  69          1HZ       LYS  69  -5.837  -9.279   6.361
  526   2HZ   LYS  69          2HZ       LYS  69  -7.413  -9.200   6.783
  527   3HZ   LYS  69          3HZ       LYS  69  -6.992  -9.271   5.206
  528    H    VAL  70           H        VAL  70  -4.677  -1.741   3.185
  529    HA   VAL  70           HA       VAL  70  -1.818  -1.232   2.967
  530    HB   VAL  70           HB       VAL  70  -3.935  -0.015   1.183
  531   1HG1  VAL  70          1HG1      VAL  70  -2.448   1.753   1.863
  532   2HG1  VAL  70          2HG1      VAL  70  -1.019   0.734   1.566
  533   3HG1  VAL  70          3HG1      VAL  70  -2.024   1.277   0.201
  534   1HG2  VAL  70          1HG2      VAL  70  -1.852  -2.095   0.824
  535   2HG2  VAL  70          2HG2      VAL  70  -3.393  -1.848  -0.031
  536   3HG2  VAL  70          3HG2      VAL  70  -1.966  -0.880  -0.471
  537    H    VAL  71           H        VAL  71  -1.191   0.814   3.912
  538    HA   VAL  71           HA       VAL  71  -3.300   2.317   5.217
  539    HB   VAL  71           HB       VAL  71  -2.672   1.929   7.380
  540   1HG1  VAL  71          1HG1      VAL  71  -2.335  -0.538   7.692
  541   2HG1  VAL  71          2HG1      VAL  71  -3.664  -0.114   6.586
  542   3HG1  VAL  71          3HG1      VAL  71  -2.107  -0.678   5.932
  543   1HG2  VAL  71          1HG2      VAL  71  -0.314   2.476   7.166
  544   2HG2  VAL  71          2HG2      VAL  71  -0.496   0.963   8.085
  545   3HG2  VAL  71          3HG2      VAL  71   0.009   0.913   6.379
  546    H    ILE  72           H        ILE  72  -2.519   4.423   6.003
  547    HA   ILE  72           HA       ILE  72   0.162   5.122   5.124
  548    HB   ILE  72           HB       ILE  72  -2.328   6.503   4.118
  549   1HG1  ILE  72          1HG1      ILE  72  -0.965   5.832   1.898
  550   2HG1  ILE  72          2HG1      ILE  72  -0.454   4.513   2.932
  551   1HG2  ILE  72          1HG2      ILE  72  -0.514   7.761   2.747
  552   2HG2  ILE  72          2HG2      ILE  72  -0.847   8.255   4.424
  553   3HG2  ILE  72          3HG2      ILE  72   0.580   7.256   4.057
  554   1HD1  ILE  72          1HD1      ILE  72  -3.295   5.282   2.161
  555   2HD1  ILE  72          2HD1      ILE  72  -2.452   3.744   1.859
  556   3HD1  ILE  72          3HD1      ILE  72  -2.948   4.177   3.513
  557    H    ASP  73           H        ASP  73   1.093   6.759   6.364
  558    HA   ASP  73           HA       ASP  73   0.066   7.099   8.885
  559   1HB   ASP  73          1HB       ASP  73   2.377   7.902   7.390
  560   2HB   ASP  73          2HB       ASP  73   1.743   9.355   8.134
  561    HA   PRO  74           HA       PRO  74  -2.538  10.600   8.439
  562   1HB   PRO  74          1HB       PRO  74  -2.158  12.014  10.746
  563   2HB   PRO  74          2HB       PRO  74  -3.159  10.578  10.656
  564   1HG   PRO  74          1HG       PRO  74  -0.453  10.883  11.807
  565   2HG   PRO  74          2HG       PRO  74  -1.623   9.606  12.076
  566   1HD   PRO  74          1HD       PRO  74   0.717   9.469  10.423
  567   2HD   PRO  74          2HD       PRO  74  -0.514   8.235  10.601
  568    H    PHE  75           H        PHE  75   0.790  11.295   9.085
  569    HA   PHE  75           HA       PHE  75   0.510  14.025   8.262
  570   1HB   PHE  75          1HB       PHE  75   2.327  12.371   9.686
  571   2HB   PHE  75          2HB       PHE  75   3.188  12.718   8.200
  572    HD1  PHE  75           1HD      PHE  75   1.748  14.180  11.240
  573    HD2  PHE  75           2HD      PHE  75   3.981  14.945   7.713
  574    HE1  PHE  75           1HE      PHE  75   2.439  16.410  12.162
  575    HE2  PHE  75           2HE      PHE  75   4.672  17.175   8.635
  576    HZ   PHE  75           HZ       PHE  75   3.893  17.881  10.848
  577    H    SER  76           H        SER  76   0.956  10.924   6.715
  578    HA   SER  76           HA       SER  76   2.215  12.107   4.420
  579   1HB   SER  76          1HB       SER  76   3.072   9.972   4.705
  580   2HB   SER  76          2HB       SER  76   1.578   9.336   5.365
  581    HG   SER  76           HG       SER  76   2.359   8.770   3.023
  582    H    MET  77           H        MET  77  -0.963  11.504   5.669
  583    HA   MET  77           HA       MET  77  -2.373  10.893   3.407
  584   1HB   MET  77          1HB       MET  77  -2.896  11.572   6.094
  585   2HB   MET  77          2HB       MET  77  -3.704  12.850   5.207
  586   1HG   MET  77          1HG       MET  77  -4.088   9.943   4.402
  587   2HG   MET  77          2HG       MET  77  -5.022  10.629   5.716
  588   1HE   MET  77          1HE       MET  77  -5.909  10.898   1.383
  589   2HE   MET  77          2HE       MET  77  -4.187  10.919   1.833
  590   3HE   MET  77          3HE       MET  77  -5.244   9.610   2.416
  591    HA   PRO  78           HA       PRO  78  -2.681  15.564   2.618
  592   1HB   PRO  78          1HB       PRO  78  -1.074  17.288   4.001
  593   2HB   PRO  78          2HB       PRO  78  -2.728  16.938   4.465
  594   1HG   PRO  78          1HG       PRO  78  -0.216  15.990   5.702
  595   2HG   PRO  78          2HG       PRO  78  -1.833  16.010   6.378
  596   1HD   PRO  78          1HD       PRO  78  -0.435  13.731   5.339
  597   2HD   PRO  78          2HD       PRO  78  -2.092  13.775   5.907
  598    H    TYR  79           H        TYR  79  -0.168  13.577   2.544
  599    HA   TYR  79           HA       TYR  79   1.388  15.370   0.815
  600   1HB   TYR  79          1HB       TYR  79   1.944  13.498   2.938
  601   2HB   TYR  79          2HB       TYR  79   2.487  12.705   1.472
  602    HD1  TYR  79           1HD      TYR  79   4.160  13.727   3.880
  603    HD2  TYR  79           2HD      TYR  79   3.246  15.401   0.050
  604    HE1  TYR  79           1HE      TYR  79   6.316  15.072   3.946
  605    HE2  TYR  79           2HE      TYR  79   5.406  16.741   0.129
  606    HH   TYR  79           HH       TYR  79   7.452  16.693   3.012
  607    H    VAL  80           H        VAL  80  -0.312  12.220   1.042
  608    HA   VAL  80           HA       VAL  80  -0.027  12.017  -1.874
  609    HB   VAL  80           HB       VAL  80  -0.001   9.559  -1.571
  610   1HG1  VAL  80          1HG1      VAL  80   2.103  10.482  -2.030
  611   2HG1  VAL  80          2HG1      VAL  80   2.215  11.266  -0.436
  612   3HG1  VAL  80          3HG1      VAL  80   2.382   9.499  -0.572
  613   1HG2  VAL  80          1HG2      VAL  80  -0.492  10.290   1.190
  614   2HG2  VAL  80          2HG2      VAL  80  -0.587   8.696   0.403
  615   3HG2  VAL  80          3HG2      VAL  80   0.964   9.276   1.054
  616    H    ASN  81           H        ASN  81  -2.094  13.482  -0.933
  617    HA   ASN  81           HA       ASN  81  -4.296  11.652  -0.546
  618   1HB   ASN  81          1HB       ASN  81  -4.494  13.484   0.949
  619   2HB   ASN  81          2HB       ASN  81  -3.880  14.637  -0.220
  620   1HD2  ASN  81          1HD2      ASN  81  -6.556  12.330   0.223
  621   2HD2  ASN  81          2HD2      ASN  81  -7.814  13.321  -0.439
  622    H    GLY  82           H        GLY  82  -5.885  11.335  -2.174
  623   1HA   GLY  82          1HA       GLY  82  -6.702  11.267  -4.273
  624   2HA   GLY  82          2HA       GLY  82  -6.636  13.016  -4.188
  625    H    ALA  83           H        ALA  83  -4.311  10.242  -4.601
  626    HA   ALA  83           HA       ALA  83  -3.412  11.396  -7.084
  627   1HB   ALA  83          1HB       ALA  83  -2.132  12.241  -4.786
  628   2HB   ALA  83          2HB       ALA  83  -1.135  10.855  -5.287
  629   3HB   ALA  83          3HB       ALA  83  -1.408  12.208  -6.411
  630    H    GLU  84           H        GLU  84  -1.338   9.879  -7.765
  631    HA   GLU  84           HA       GLU  84  -1.979   7.178  -6.916
  632   1HB   GLU  84          1HB       GLU  84  -2.034   6.367  -9.221
  633   2HB   GLU  84          2HB       GLU  84  -3.228   7.635  -9.027
  634   1HG   GLU  84          1HG       GLU  84  -1.421   9.275  -9.896
  635   2HG   GLU  84          2HG       GLU  84  -0.487   7.861 -10.341
  636    H    LEU  85           H        LEU  85  -0.195   5.708  -6.989
  637    HA   LEU  85           HA       LEU  85   2.346   6.925  -7.804
  638   1HB   LEU  85          1HB       LEU  85   3.050   6.983  -5.724
  639   2HB   LEU  85          2HB       LEU  85   1.507   6.374  -5.159
  640    HG   LEU  85           HG       LEU  85   2.348   4.043  -5.506
  641   1HD1  LEU  85          1HD1      LEU  85   5.172   4.786  -5.512
  642   2HD1  LEU  85          2HD1      LEU  85   4.303   3.555  -6.460
  643   3HD1  LEU  85          3HD1      LEU  85   4.330   5.248  -7.011
  644   1HD2  LEU  85          1HD2      LEU  85   3.548   5.963  -3.549
  645   2HD2  LEU  85          2HD2      LEU  85   2.411   4.619  -3.288
  646   3HD2  LEU  85          3HD2      LEU  85   4.133   4.282  -3.586
  647    H    ASP  86           H        ASP  86   3.219   5.747  -9.413
  648    HA   ASP  86           HA       ASP  86   2.332   3.011  -9.656
  649   1HB   ASP  86          1HB       ASP  86   3.685   3.212 -11.867
  650   2HB   ASP  86          2HB       ASP  86   2.202   4.136 -11.734
  651    H    TYR  87           H        TYR  87   3.616   1.603  -8.427
  652    HA   TYR  87           HA       TYR  87   6.405   2.224  -8.000
  653   1HB   TYR  87          1HB       TYR  87   4.384   1.061  -6.543
  654   2HB   TYR  87          2HB       TYR  87   5.018  -0.388  -7.297
  655    HD1  TYR  87           1HD      TYR  87   6.796   2.638  -5.974
  656    HD2  TYR  87           2HD      TYR  87   6.144  -1.577  -5.639
  657    HE1  TYR  87           1HE      TYR  87   8.601   2.493  -4.189
  658    HE2  TYR  87           2HE      TYR  87   7.951  -1.708  -3.855
  659    HH   TYR  87           HH       TYR  87  10.150   0.736  -3.337
  660    H    VAL  88           H        VAL  88   8.072   1.476  -9.212
  661    HA   VAL  88           HA       VAL  88   7.442  -0.605 -11.166
  662    HB   VAL  88           HB       VAL  88   9.539   1.545 -10.962
  663   1HG1  VAL  88          1HG1      VAL  88   9.484  -0.719 -12.986
  664   2HG1  VAL  88          2HG1      VAL  88  10.604   0.665 -12.974
  665   3HG1  VAL  88          3HG1      VAL  88  10.663  -0.539 -11.665
  666   1HG2  VAL  88          1HG2      VAL  88   7.179   1.919 -11.926
  667   2HG2  VAL  88          2HG2      VAL  88   8.571   2.436 -12.909
  668   3HG2  VAL  88          3HG2      VAL  88   7.724   0.919 -13.294
  669    H    VAL  89           H        VAL  89   8.822  -2.458 -11.412
  670    HA   VAL  89           HA       VAL  89  10.596  -2.915  -9.120
  671    HB   VAL  89           HB       VAL  89   8.744  -4.982 -10.306
  672   1HG1  VAL  89          1HG1      VAL  89   9.970  -6.407  -9.108
  673   2HG1  VAL  89          2HG1      VAL  89  10.955  -5.072  -8.462
  674   3HG1  VAL  89          3HG1      VAL  89   9.460  -5.559  -7.628
  675   1HG2  VAL  89          1HG2      VAL  89   7.374  -3.227  -9.302
  676   2HG2  VAL  89          2HG2      VAL  89   7.339  -4.695  -8.296
  677   3HG2  VAL  89          3HG2      VAL  89   8.336  -3.304  -7.807
  678    H    ASP  90           H        ASP  90  12.587  -2.827 -10.065
  679    HA   ASP  90           HA       ASP  90  13.059  -4.758 -12.137
  680   1HB   ASP  90          1HB       ASP  90  14.052  -1.910 -12.530
  681   2HB   ASP  90          2HB       ASP  90  14.060  -3.219 -13.695
  682    H    PHE  91           H        PHE  91  15.710  -3.281 -12.703
  683    HA   PHE  91           HA       PHE  91  17.281  -4.534 -10.802
  684   1HB   PHE  91          1HB       PHE  91  17.644  -3.353 -13.217
  685   2HB   PHE  91          2HB       PHE  91  18.097  -1.972 -12.237
  686    HD1  PHE  91           1HD      PHE  91  20.224  -1.852 -11.214
  687    HD2  PHE  91           2HD      PHE  91  18.948  -5.497 -12.972
  688    HE1  PHE  91           1HE      PHE  91  22.546  -2.776 -10.983
  689    HE2  PHE  91           2HE      PHE  91  21.270  -6.421 -12.741
  690    HZ   PHE  91           HZ       PHE  91  23.041  -5.050 -11.749
  691    H    MET  92           H        MET  92  15.384  -1.670 -10.514
  692    HA   MET  92           HA       MET  92  17.140  -0.453  -8.600
  693   1HB   MET  92          1HB       MET  92  14.829   0.288 -10.227
  694   2HB   MET  92          2HB       MET  92  14.496   0.699  -8.557
  695   1HG   MET  92          1HG       MET  92  16.228   2.267  -8.442
  696   2HG   MET  92          2HG       MET  92  17.216   1.430  -9.622
  697   1HE   MET  92          1HE       MET  92  15.111   5.116 -10.298
  698   2HE   MET  92          2HE       MET  92  14.066   4.059  -9.319
  699   3HE   MET  92          3HE       MET  92  15.761   4.323  -8.844
  700    H    GLY  93           H        GLY  93  15.698  -3.222  -8.277
  701   1HA   GLY  93          1HA       GLY  93  14.577  -4.366  -6.685
  702   2HA   GLY  93          2HA       GLY  93  15.494  -3.360  -5.582
  703    H    GLY  94           H        GLY  94  13.201  -1.853  -7.830
  704   1HA   GLY  94          1HA       GLY  94  10.816  -1.692  -7.172
  705   2HA   GLY  94          2HA       GLY  94  11.383  -1.360  -5.547
  706    H    GLY  95           H        GLY  95  11.355  -0.143  -8.931
  707   1HA   GLY  95          1HA       GLY  95  12.485   2.409  -8.221
  708   2HA   GLY  95          2HA       GLY  95  11.829   1.916  -9.769
  709    H    PHE  96           H        PHE  96  11.339   3.913  -7.083
  710    HA   PHE  96           HA       PHE  96   8.473   3.804  -7.071
  711   1HB   PHE  96          1HB       PHE  96   9.016   5.987  -5.653
  712   2HB   PHE  96          2HB       PHE  96   9.499   4.434  -4.999
  713    HD1  PHE  96           1HD      PHE  96  11.697   4.119  -4.332
  714    HD2  PHE  96           2HD      PHE  96  10.822   7.221  -7.093
  715    HE1  PHE  96           1HE      PHE  96  14.072   4.918  -4.187
  716    HE2  PHE  96           2HE      PHE  96  13.197   8.020  -6.948
  717    HZ   PHE  96           HZ       PHE  96  14.793   6.859  -5.497
  718    H    THR  97           H        THR  97   7.023   5.363  -7.903
  719    HA   THR  97           HA       THR  97   8.013   7.690  -9.244
  720    HB   THR  97           HB       THR  97   7.209   5.185 -10.763
  721    HG1  THR  97           1HG      THR  97   9.406   5.600 -10.906
  722   1HG2  THR  97          1HG2      THR  97   6.771   6.487 -12.755
  723   2HG2  THR  97          2HG2      THR  97   5.730   7.185 -11.491
  724   3HG2  THR  97          3HG2      THR  97   7.244   8.001 -11.947
  725    H    ILE  98           H        ILE  98   6.461   9.256  -9.424
  726    HA   ILE  98           HA       ILE  98   3.745   8.387  -8.721
  727    HB   ILE  98           HB       ILE  98   5.432  10.597  -7.616
  728   1HG1  ILE  98          1HG1      ILE  98   3.422   9.073  -6.033
  729   2HG1  ILE  98          2HG1      ILE  98   4.804   8.173  -6.625
  730   1HG2  ILE  98          1HG2      ILE  98   3.774  12.066  -7.917
  731   2HG2  ILE  98          2HG2      ILE  98   2.598  10.802  -8.347
  732   3HG2  ILE  98          3HG2      ILE  98   2.931  11.162  -6.636
  733   1HD1  ILE  98          1HD1      ILE  98   4.706   9.916  -4.374
  734   2HD1  ILE  98          2HD1      ILE  98   6.133   9.086  -5.039
  735   3HD1  ILE  98          3HD1      ILE  98   5.720  10.726  -5.593
  736    H    ARG  99           H        ARG  99   2.056   9.293  -9.902
  737    HA   ARG  99           HA       ARG  99   2.919  11.162 -11.959
  738   1HB   ARG  99          1HB       ARG  99   1.704   8.506 -12.243
  739   2HB   ARG  99          2HB       ARG  99   0.690   9.724 -12.990
  740   1HG   ARG  99          1HG       ARG  99   2.744  10.594 -14.213
  741   2HG   ARG  99          2HG       ARG  99   3.654   9.250 -13.554
  742   1HD   ARG  99          1HD       ARG  99   2.359   7.626 -14.762
  743   2HD   ARG  99          2HD       ARG  99   1.079   8.773 -15.104
  744    HE   ARG  99           HE       ARG  99   3.431   9.840 -16.260
  745   1HH1  ARG  99          2HH2      ARG  99   1.399   6.993 -16.646
  746   2HH1  ARG  99          1HH2      ARG  99   1.771   6.799 -18.327
  747   1HH2  ARG  99          2HH1      ARG  99   3.921   9.585 -18.477
  748   2HH2  ARG  99          1HH1      ARG  99   3.214   8.284 -19.375
  749    H    ASN 100           H        ASN 100   2.030  13.056 -11.078
  750    HA   ASN 100           HA       ASN 100  -0.240  13.182  -9.576
  751   1HB   ASN 100          1HB       ASN 100   1.460  15.030  -9.894
  752   2HB   ASN 100          2HB       ASN 100   0.832  15.310 -11.506
  753   1HD2  ASN 100          1HD2      ASN 100   0.380  15.729  -8.119
  754   2HD2  ASN 100          2HD2      ASN 100  -1.033  16.730  -8.156
  755    HA   PRO 101           HA       PRO 101  -3.343  12.713 -12.657
  756   1HB   PRO 101          1HB       PRO 101  -5.541  13.454 -11.211
  757   2HB   PRO 101          2HB       PRO 101  -4.836  11.851 -11.130
  758   1HG   PRO 101          1HG       PRO 101  -4.672  14.049  -9.160
  759   2HG   PRO 101          2HG       PRO 101  -4.354  12.341  -8.929
  760   1HD   PRO 101          1HD       PRO 101  -2.406  14.430  -9.194
  761   2HD   PRO 101          2HD       PRO 101  -2.090  12.710  -9.079
  Start of MODEL   15
    1    H    MET   1           H        MET   1 -13.798  11.906  20.561
    2    HA   MET   1           HA       MET   1 -16.127  10.893  19.698
    3   1HB   MET   1          1HB       MET   1 -13.555  11.678  18.257
    4   2HB   MET   1          2HB       MET   1 -14.944  11.152  17.327
    5   1HG   MET   1          1HG       MET   1 -15.858  13.221  17.510
    6   2HG   MET   1          2HG       MET   1 -15.916  13.048  19.253
    7   1HE   MET   1          1HE       MET   1 -14.025  16.124  19.986
    8   2HE   MET   1          2HE       MET   1 -15.655  15.592  19.508
    9   3HE   MET   1          3HE       MET   1 -14.753  14.690  20.749
   10    H    GLN   2           H        GLN   2 -16.582   9.271  17.890
   11    HA   GLN   2           HA       GLN   2 -15.836   6.767  18.708
   12   1HB   GLN   2          1HB       GLN   2 -17.480   7.943  16.656
   13   2HB   GLN   2          2HB       GLN   2 -16.527   6.674  15.914
   14   1HG   GLN   2          1HG       GLN   2 -17.282   5.407  18.229
   15   2HG   GLN   2          2HG       GLN   2 -18.653   6.475  18.008
   16   1HE2  GLN   2          1HE2      GLN   2 -20.253   5.453  17.095
   17   2HE2  GLN   2          2HE2      GLN   2 -20.176   4.350  15.761
   18    H    GLU   3           H        GLU   3 -15.139   5.354  16.285
   19    HA   GLU   3           HA       GLU   3 -12.354   5.664  16.434
   20   1HB   GLU   3          1HB       GLU   3 -14.288   3.869  15.040
   21   2HB   GLU   3          2HB       GLU   3 -12.725   4.028  14.264
   22   1HG   GLU   3          1HG       GLU   3 -11.550   3.220  16.190
   23   2HG   GLU   3          2HG       GLU   3 -12.921   3.487  17.249
   24    H    GLN   4           H        GLN   4 -10.873   6.095  14.579
   25    HA   GLN   4           HA       GLN   4 -11.879   8.333  13.103
   26   1HB   GLN   4          1HB       GLN   4  -9.597   8.224  14.265
   27   2HB   GLN   4          2HB       GLN   4  -9.086   7.122  13.003
   28   1HG   GLN   4          1HG       GLN   4  -9.906   8.959  11.330
   29   2HG   GLN   4          2HG       GLN   4  -9.926  10.031  12.716
   30   1HE2  GLN   4          1HE2      GLN   4  -7.888   7.714  10.969
   31   2HE2  GLN   4          2HE2      GLN   4  -6.368   8.497  11.243
   32    H    ALA   5           H        ALA   5 -11.966   8.503  10.798
   33    HA   ALA   5           HA       ALA   5 -12.826   6.252   9.454
   34   1HB   ALA   5          1HB       ALA   5 -11.528   8.576   8.032
   35   2HB   ALA   5          2HB       ALA   5 -13.003   7.675   7.608
   36   3HB   ALA   5          3HB       ALA   5 -13.022   8.827   8.966
   37    H    GLN   6           H        GLN   6 -11.800   4.511   8.602
   38    HA   GLN   6           HA       GLN   6  -8.907   4.729   8.394
   39   1HB   GLN   6          1HB       GLN   6 -10.564   2.787   9.589
   40   2HB   GLN   6          2HB       GLN   6 -10.007   2.023   8.113
   41   1HG   GLN   6          1HG       GLN   6  -8.055   1.572   9.177
   42   2HG   GLN   6          2HG       GLN   6  -7.699   3.287   9.120
   43   1HE2  GLN   6          1HE2      GLN   6  -8.309   0.611  11.061
   44   2HE2  GLN   6          2HE2      GLN   6  -8.481   1.384  12.602
   45    H    GLN   7           H        GLN   7 -10.666   5.875   6.369
   46    HA   GLN   7           HA       GLN   7  -9.952   4.095   4.173
   47   1HB   GLN   7          1HB       GLN   7 -12.573   4.894   4.935
   48   2HB   GLN   7          2HB       GLN   7 -12.198   5.828   3.501
   49   1HG   GLN   7          1HG       GLN   7 -12.203   3.984   2.135
   50   2HG   GLN   7          2HG       GLN   7 -11.362   2.987   3.306
   51   1HE2  GLN   7          1HE2      GLN   7 -12.609   2.299   5.227
   52   2HE2  GLN   7          2HE2      GLN   7 -14.273   1.859   5.030
   53    H    PHE   8           H        PHE   8  -8.325   5.041   3.027
   54    HA   PHE   8           HA       PHE   8  -8.292   7.969   2.944
   55   1HB   PHE   8          1HB       PHE   8  -5.867   7.604   2.460
   56   2HB   PHE   8          2HB       PHE   8  -6.313   6.722   3.907
   57    HD1  PHE   8           1HD      PHE   8  -6.083   6.200   0.216
   58    HD2  PHE   8           2HD      PHE   8  -5.655   4.518   4.089
   59    HE1  PHE   8           1HE      PHE   8  -5.199   4.083  -0.801
   60    HE2  PHE   8           2HE      PHE   8  -4.771   2.400   3.071
   61    HZ   PHE   8           HZ       PHE   8  -4.554   2.208   0.638
   62    H    ILE   9           H        ILE   9  -8.182   9.077   0.968
   63    HA   ILE   9           HA       ILE   9  -9.018   7.500  -1.310
   64    HB   ILE   9           HB       ILE   9  -8.717  10.486  -0.967
   65   1HG1  ILE   9          1HG1      ILE   9 -10.348   9.422   0.600
   66   2HG1  ILE   9          2HG1      ILE   9 -11.052  10.584  -0.506
   67   1HG2  ILE   9          1HG2      ILE   9 -10.414  10.398  -2.926
   68   2HG2  ILE   9          2HG2      ILE   9  -8.683  10.158  -3.262
   69   3HG2  ILE   9          3HG2      ILE   9  -9.777   8.756  -3.186
   70   1HD1  ILE   9          1HD1      ILE   9 -12.536   8.706  -0.529
   71   2HD1  ILE   9          2HD1      ILE   9 -11.609   8.586  -2.044
   72   3HD1  ILE   9          3HD1      ILE   9 -11.189   7.549  -0.659
   73    H    PHE  10           H        PHE  10  -7.447   6.476  -2.438
   74    HA   PHE  10           HA       PHE  10  -5.371   8.060  -3.585
   75   1HB   PHE  10          1HB       PHE  10  -4.593   7.383  -1.201
   76   2HB   PHE  10          2HB       PHE  10  -4.703   5.711  -1.714
   77    HD1  PHE  10           1HD      PHE  10  -2.567   4.858  -1.880
   78    HD2  PHE  10           2HD      PHE  10  -3.329   8.741  -3.413
   79    HE1  PHE  10           1HE      PHE  10  -0.218   4.972  -2.757
   80    HE2  PHE  10           2HE      PHE  10  -0.980   8.855  -4.291
   81    HZ   PHE  10           HZ       PHE  10   0.547   6.969  -3.952
   82    H    LYS  11           H        LYS  11  -4.237   6.912  -5.303
   83    HA   LYS  11           HA       LYS  11  -5.502   4.345  -5.963
   84   1HB   LYS  11          1HB       LYS  11  -4.997   6.735  -7.745
   85   2HB   LYS  11          2HB       LYS  11  -5.247   5.124  -8.386
   86   1HG   LYS  11          1HG       LYS  11  -7.490   5.127  -7.889
   87   2HG   LYS  11          2HG       LYS  11  -7.253   5.914  -6.342
   88   1HD   LYS  11          1HD       LYS  11  -6.985   7.404  -8.989
   89   2HD   LYS  11          2HD       LYS  11  -8.511   7.271  -8.139
   90   1HE   LYS  11          1HE       LYS  11  -7.527   8.365  -6.138
   91   2HE   LYS  11          2HE       LYS  11  -5.960   8.433  -6.920
   92   1HZ   LYS  11          1HZ       LYS  11  -8.383   9.905  -7.609
   93   2HZ   LYS  11          2HZ       LYS  11  -6.882  10.482  -7.323
   94   3HZ   LYS  11          3HZ       LYS  11  -7.204   9.698  -8.720
   95    H    VAL  12           H        VAL  12  -4.134   2.709  -6.607
   96    HA   VAL  12           HA       VAL  12  -1.338   3.458  -7.050
   97    HB   VAL  12           HB       VAL  12  -2.195   2.460  -4.674
   98   1HG1  VAL  12          1HG1      VAL  12  -2.925   0.339  -5.685
   99   2HG1  VAL  12          2HG1      VAL  12  -1.278   0.063  -6.300
  100   3HG1  VAL  12          3HG1      VAL  12  -1.580   0.091  -4.546
  101   1HG2  VAL  12          1HG2      VAL  12   0.429   2.297  -6.138
  102   2HG2  VAL  12          2HG2      VAL  12  -0.041   3.320  -4.760
  103   3HG2  VAL  12          3HG2      VAL  12   0.265   1.583  -4.516
  104    H    THR  13           H        THR  13  -0.367   2.360  -8.729
  105    HA   THR  13           HA       THR  13  -1.994   1.021 -10.561
  106    HB   THR  13           HB       THR  13   0.250   0.530 -11.634
  107    HG1  THR  13           1HG      THR  13   2.081   1.024 -10.328
  108   1HG2  THR  13          1HG2      THR  13  -0.860   3.079 -11.140
  109   2HG2  THR  13          2HG2      THR  13   0.837   3.237 -10.625
  110   3HG2  THR  13          3HG2      THR  13   0.455   2.718 -12.285
  111    H    ASP  14           H        ASP  14  -1.320  -1.253 -11.460
  112    HA   ASP  14           HA       ASP  14  -1.986  -3.026  -9.372
  113   1HB   ASP  14          1HB       ASP  14  -1.791  -3.048 -12.295
  114   2HB   ASP  14          2HB       ASP  14  -1.108  -4.518 -11.629
  115    H    LYS  15           H        LYS  15   0.952  -1.901 -10.991
  116    HA   LYS  15           HA       LYS  15   2.598  -4.113 -10.446
  117   1HB   LYS  15          1HB       LYS  15   2.812  -1.812 -11.913
  118   2HB   LYS  15          2HB       LYS  15   3.860  -1.444 -10.557
  119   1HG   LYS  15          1HG       LYS  15   4.983  -3.714 -10.915
  120   2HG   LYS  15          2HG       LYS  15   4.036  -3.887 -12.380
  121   1HD   LYS  15          1HD       LYS  15   5.178  -1.292 -12.551
  122   2HD   LYS  15          2HD       LYS  15   6.461  -2.308 -11.924
  123   1HE   LYS  15          1HE       LYS  15   6.277  -3.848 -13.804
  124   2HE   LYS  15          2HE       LYS  15   4.797  -3.092 -14.359
  125   1HZ   LYS  15          1HZ       LYS  15   6.975  -2.442 -15.451
  126   2HZ   LYS  15          2HZ       LYS  15   5.940  -1.240 -15.062
  127   3HZ   LYS  15          3HZ       LYS  15   7.249  -1.525 -14.128
  128    H    ALA  16           H        ALA  16   1.897  -1.047  -8.663
  129    HA   ALA  16           HA       ALA  16   3.710  -1.474  -6.597
  130   1HB   ALA  16          1HB       ALA  16   1.754  -0.035  -5.402
  131   2HB   ALA  16          2HB       ALA  16   2.903   0.669  -6.565
  132   3HB   ALA  16          3HB       ALA  16   1.278   0.181  -7.104
  133    H    VAL  17           H        VAL  17   0.127  -2.118  -6.675
  134    HA   VAL  17           HA       VAL  17   0.017  -3.406  -4.236
  135    HB   VAL  17           HB       VAL  17  -1.627  -3.195  -6.679
  136   1HG1  VAL  17          1HG1      VAL  17  -3.261  -4.910  -5.782
  137   2HG1  VAL  17          2HG1      VAL  17  -1.776  -5.570  -6.509
  138   3HG1  VAL  17          3HG1      VAL  17  -1.946  -5.502  -4.739
  139   1HG2  VAL  17          1HG2      VAL  17  -1.628  -2.220  -4.015
  140   2HG2  VAL  17          2HG2      VAL  17  -2.791  -1.870  -5.316
  141   3HG2  VAL  17          3HG2      VAL  17  -3.086  -3.225  -4.199
  142    H    GLU  18           H        GLU  18   0.564  -4.750  -7.555
  143    HA   GLU  18           HA       GLU  18   0.596  -7.379  -6.897
  144   1HB   GLU  18          1HB       GLU  18   2.014  -5.736  -8.995
  145   2HB   GLU  18          2HB       GLU  18   2.422  -7.434  -8.843
  146   1HG   GLU  18          1HG       GLU  18   0.153  -8.129  -9.285
  147   2HG   GLU  18          2HG       GLU  18  -0.471  -6.508  -9.053
  148    H    GLU  19           H        GLU  19   3.380  -5.049  -6.857
  149    HA   GLU  19           HA       GLU  19   5.366  -6.719  -6.193
  150   1HB   GLU  19          1HB       GLU  19   5.811  -4.386  -6.586
  151   2HB   GLU  19          2HB       GLU  19   4.793  -3.886  -5.250
  152   1HG   GLU  19          1HG       GLU  19   6.513  -4.075  -3.781
  153   2HG   GLU  19          2HG       GLU  19   6.815  -5.731  -4.267
  154    H    ILE  20           H        ILE  20   3.012  -5.171  -3.911
  155    HA   ILE  20           HA       ILE  20   4.129  -6.368  -1.617
  156    HB   ILE  20           HB       ILE  20   1.575  -4.953  -2.279
  157   1HG1  ILE  20          1HG1      ILE  20   2.423  -3.251  -0.848
  158   2HG1  ILE  20          2HG1      ILE  20   3.666  -4.300  -0.196
  159   1HG2  ILE  20          1HG2      ILE  20   0.780  -6.612  -0.771
  160   2HG2  ILE  20          2HG2      ILE  20   2.192  -6.418   0.295
  161   3HG2  ILE  20          3HG2      ILE  20   0.990  -5.112   0.164
  162   1HD1  ILE  20          1HD1      ILE  20   4.547  -2.686  -1.906
  163   2HD1  ILE  20          2HD1      ILE  20   4.818  -4.384  -2.363
  164   3HD1  ILE  20          3HD1      ILE  20   3.505  -3.456  -3.126
  165    H    LYS  21           H        LYS  21   1.511  -7.285  -3.909
  166    HA   LYS  21           HA       LYS  21   0.553  -9.455  -2.453
  167   1HB   LYS  21          1HB       LYS  21   0.467  -8.588  -5.321
  168   2HB   LYS  21          2HB       LYS  21  -0.052 -10.212  -4.920
  169   1HG   LYS  21          1HG       LYS  21  -1.697  -9.354  -3.307
  170   2HG   LYS  21          2HG       LYS  21  -1.101  -7.718  -3.505
  171   1HD   LYS  21          1HD       LYS  21  -2.687  -7.472  -5.117
  172   2HD   LYS  21          2HD       LYS  21  -1.665  -8.467  -6.135
  173   1HE   LYS  21          1HE       LYS  21  -3.279 -10.099  -4.285
  174   2HE   LYS  21          2HE       LYS  21  -4.283  -9.078  -5.295
  175   1HZ   LYS  21          1HZ       LYS  21  -3.921 -10.979  -6.529
  176   2HZ   LYS  21          2HZ       LYS  21  -2.853  -9.927  -7.176
  177   3HZ   LYS  21          3HZ       LYS  21  -2.337 -11.086  -6.147
  178    H    LYS  22           H        LYS  22   3.225  -9.163  -4.861
  179    HA   LYS  22           HA       LYS  22   3.792 -11.948  -4.787
  180   1HB   LYS  22          1HB       LYS  22   4.553  -9.678  -6.328
  181   2HB   LYS  22          2HB       LYS  22   6.024 -10.384  -5.690
  182   1HG   LYS  22          1HG       LYS  22   5.008 -12.681  -6.452
  183   2HG   LYS  22          2HG       LYS  22   3.896 -11.717  -7.403
  184   1HD   LYS  22          1HD       LYS  22   5.578 -11.945  -8.977
  185   2HD   LYS  22          2HD       LYS  22   6.165 -10.497  -8.183
  186   1HE   LYS  22          1HE       LYS  22   7.398 -12.217  -6.570
  187   2HE   LYS  22          2HE       LYS  22   7.149 -13.347  -7.886
  188   1HZ   LYS  22          1HZ       LYS  22   9.220 -12.242  -8.152
  189   2HZ   LYS  22          2HZ       LYS  22   8.229 -11.735  -9.347
  190   3HZ   LYS  22          3HZ       LYS  22   8.533 -10.763  -8.071
  191    H    VAL  23           H        VAL  23   5.229  -8.988  -3.278
  192    HA   VAL  23           HA       VAL  23   7.352 -10.170  -2.017
  193    HB   VAL  23           HB       VAL  23   5.598  -7.813  -1.497
  194   1HG1  VAL  23          1HG1      VAL  23   7.394  -9.103   0.514
  195   2HG1  VAL  23          2HG1      VAL  23   7.424  -7.328   0.386
  196   3HG1  VAL  23          3HG1      VAL  23   5.897  -8.169   0.745
  197   1HG2  VAL  23          1HG2      VAL  23   7.518  -7.909  -3.178
  198   2HG2  VAL  23          2HG2      VAL  23   7.537  -6.557  -2.020
  199   3HG2  VAL  23          3HG2      VAL  23   8.609  -7.956  -1.773
  200    H    ALA  24           H        ALA  24   4.003  -9.677  -0.686
  201    HA   ALA  24           HA       ALA  24   4.478 -11.071   1.680
  202   1HB   ALA  24          1HB       ALA  24   2.407  -9.619   0.498
  203   2HB   ALA  24          2HB       ALA  24   1.736 -11.259   0.664
  204   3HB   ALA  24          3HB       ALA  24   2.364 -10.405   2.094
  205    H    GLN  25           H        GLN  25   3.290 -12.124  -1.561
  206    HA   GLN  25           HA       GLN  25   2.595 -14.677  -0.863
  207   1HB   GLN  25          1HB       GLN  25   3.258 -13.213  -3.345
  208   2HB   GLN  25          2HB       GLN  25   3.596 -14.929  -3.452
  209   1HG   GLN  25          1HG       GLN  25   1.147 -15.043  -2.253
  210   2HG   GLN  25          2HG       GLN  25   0.966 -13.526  -3.111
  211   1HE2  GLN  25          1HE2      GLN  25  -0.357 -14.058  -4.715
  212   2HE2  GLN  25          2HE2      GLN  25  -0.055 -15.249  -5.935
  213    H    GLU  26           H        GLU  26   5.795 -13.230  -1.514
  214    HA   GLU  26           HA       GLU  26   7.085 -15.754  -1.639
  215   1HB   GLU  26          1HB       GLU  26   7.734 -13.203  -2.452
  216   2HB   GLU  26          2HB       GLU  26   8.714 -13.344  -1.006
  217   1HG   GLU  26          1HG       GLU  26   9.634 -15.526  -1.877
  218   2HG   GLU  26          2HG       GLU  26   8.700 -15.311  -3.344
  219    H    ASN  27           H        ASN  27   5.671 -14.018   0.876
  220    HA   ASN  27           HA       ASN  27   7.601 -15.101   2.775
  221   1HB   ASN  27          1HB       ASN  27   6.020 -12.560   2.682
  222   2HB   ASN  27          2HB       ASN  27   6.056 -13.338   4.252
  223   1HD2  ASN  27          1HD2      ASN  27   7.686 -11.391   2.038
  224   2HD2  ASN  27          2HD2      ASN  27   9.236 -11.295   2.804
  225    H    ASN  28           H        ASN  28   4.867 -15.956   1.265
  226    HA   ASN  28           HA       ASN  28   3.192 -17.266   1.688
  227   1HB   ASN  28          1HB       ASN  28   4.952 -18.446   3.186
  228   2HB   ASN  28          2HB       ASN  28   4.215 -17.625   4.548
  229   1HD2  ASN  28          1HD2      ASN  28   4.342 -20.372   4.347
  230   2HD2  ASN  28          2HD2      ASN  28   2.754 -21.040   4.170
  231    H    ILE  29           H        ILE  29   3.039 -14.370   2.244
  232    HA   ILE  29           HA       ILE  29   1.262 -14.261   4.562
  233    HB   ILE  29           HB       ILE  29   2.740 -12.164   2.985
  234   1HG1  ILE  29          1HG1      ILE  29   2.865 -12.929   5.917
  235   2HG1  ILE  29          2HG1      ILE  29   3.989 -13.486   4.693
  236   1HG2  ILE  29          1HG2      ILE  29   0.630 -11.771   5.122
  237   2HG2  ILE  29          2HG2      ILE  29   1.744 -10.508   4.548
  238   3HG2  ILE  29          3HG2      ILE  29   0.566 -11.233   3.427
  239   1HD1  ILE  29          1HD1      ILE  29   3.743 -10.612   4.459
  240   2HD1  ILE  29          2HD1      ILE  29   4.071 -11.032   6.157
  241   3HD1  ILE  29          3HD1      ILE  29   5.182 -11.574   4.876
  242    H    GLU  30           H        GLU  30  -0.891 -13.494   4.390
  243    HA   GLU  30           HA       GLU  30  -1.831 -13.322   1.635
  244   1HB   GLU  30          1HB       GLU  30  -2.497 -15.304   3.609
  245   2HB   GLU  30          2HB       GLU  30  -3.925 -14.322   3.350
  246   1HG   GLU  30          1HG       GLU  30  -3.925 -14.768   0.973
  247   2HG   GLU  30          2HG       GLU  30  -2.305 -15.433   1.022
  248    H    ASN  31           H        ASN  31  -1.179 -11.540   4.254
  249    HA   ASN  31           HA       ASN  31  -3.347  -9.748   3.672
  250   1HB   ASN  31          1HB       ASN  31  -3.405  -9.394   6.350
  251   2HB   ASN  31          2HB       ASN  31  -4.452 -10.557   5.561
  252   1HD2  ASN  31          1HD2      ASN  31  -2.298 -10.085   8.004
  253   2HD2  ASN  31          2HD2      ASN  31  -1.803 -11.711   8.336
  254    HA   PRO  32           HA       PRO  32   0.821  -7.964   4.465
  255   1HB   PRO  32          1HB       PRO  32   1.264  -6.853   2.008
  256   2HB   PRO  32          2HB       PRO  32   1.863  -8.434   2.467
  257   1HG   PRO  32          1HG       PRO  32  -0.400  -7.754   0.691
  258   2HG   PRO  32          2HG       PRO  32   0.471  -9.268   0.827
  259   1HD   PRO  32          1HD       PRO  32  -2.126  -8.682   1.893
  260   2HD   PRO  32          2HD       PRO  32  -1.205 -10.154   2.127
  261    H    ILE  33           H        ILE  33   1.565  -5.735   4.675
  262    HA   ILE  33           HA       ILE  33  -0.730  -3.923   4.412
  263    HB   ILE  33           HB       ILE  33   0.960  -4.545   6.784
  264   1HG1  ILE  33          1HG1      ILE  33  -1.723  -3.499   7.209
  265   2HG1  ILE  33          2HG1      ILE  33  -1.734  -4.838   6.079
  266   1HG2  ILE  33          1HG2      ILE  33   0.280  -2.309   7.757
  267   2HG2  ILE  33          2HG2      ILE  33   1.580  -2.275   6.542
  268   3HG2  ILE  33          3HG2      ILE  33  -0.073  -1.790   6.091
  269   1HD1  ILE  33          1HD1      ILE  33  -0.026  -5.153   8.530
  270   2HD1  ILE  33          2HD1      ILE  33  -1.791  -5.218   8.746
  271   3HD1  ILE  33          3HD1      ILE  33  -0.986  -6.368   7.652
  272    H    LEU  34           H        LEU  34  -0.247  -2.424   2.908
  273    HA   LEU  34           HA       LEU  34   2.561  -1.818   2.450
  274   1HB   LEU  34          1HB       LEU  34   1.251  -2.420   0.530
  275   2HB   LEU  34          2HB       LEU  34   0.038  -1.214   0.908
  276    HG   LEU  34           HG       LEU  34   1.864   0.541   0.587
  277   1HD1  LEU  34          1HD1      LEU  34   3.384  -1.224  -1.195
  278   2HD1  LEU  34          2HD1      LEU  34   3.942   0.017  -0.047
  279   3HD1  LEU  34          3HD1      LEU  34   3.556  -1.622   0.531
  280   1HD2  LEU  34          1HD2      LEU  34   0.312  -0.957  -1.361
  281   2HD2  LEU  34          2HD2      LEU  34   0.604   0.794  -1.228
  282   3HD2  LEU  34          3HD2      LEU  34   1.773  -0.241  -2.083
  283    H    ARG  35           H        ARG  35   3.481  -0.191   3.566
  284    HA   ARG  35           HA       ARG  35   1.691   1.940   4.410
  285   1HB   ARG  35          1HB       ARG  35   2.859   0.699   6.247
  286   2HB   ARG  35          2HB       ARG  35   4.411   1.102   5.540
  287   1HG   ARG  35          1HG       ARG  35   3.232   3.605   5.727
  288   2HG   ARG  35          2HG       ARG  35   2.559   2.802   7.132
  289   1HD   ARG  35          1HD       ARG  35   5.547   2.853   6.488
  290   2HD   ARG  35          2HD       ARG  35   4.767   4.004   7.554
  291    HE   ARG  35           HE       ARG  35   3.991   1.505   8.541
  292   1HH1  ARG  35          2HH2      ARG  35   7.055   3.127   7.939
  293   2HH1  ARG  35          1HH2      ARG  35   7.892   2.290   9.204
  294   1HH2  ARG  35          2HH1      ARG  35   5.095   0.401  10.209
  295   2HH2  ARG  35          1HH1      ARG  35   6.770   0.729  10.504
  296    H    ILE  36           H        ILE  36   1.905   3.850   3.286
  297    HA   ILE  36           HA       ILE  36   4.317   4.223   1.707
  298    HB   ILE  36           HB       ILE  36   1.526   5.249   1.656
  299   1HG1  ILE  36          1HG1      ILE  36   2.605   4.979  -0.918
  300   2HG1  ILE  36          2HG1      ILE  36   3.311   3.661  -0.003
  301   1HG2  ILE  36          1HG2      ILE  36   2.568   7.354   1.703
  302   2HG2  ILE  36          2HG2      ILE  36   3.930   6.803   0.699
  303   3HG2  ILE  36          3HG2      ILE  36   2.315   7.002  -0.024
  304   1HD1  ILE  36          1HD1      ILE  36   1.089   3.094  -1.067
  305   2HD1  ILE  36          2HD1      ILE  36   1.113   2.867   0.698
  306   3HD1  ILE  36          3HD1      ILE  36   0.327   4.301  -0.004
  307    H    ARG  37           H        ARG  37   6.011   5.227   2.640
  308    HA   ARG  37           HA       ARG  37   5.339   7.309   4.562
  309   1HB   ARG  37          1HB       ARG  37   7.489   6.824   5.681
  310   2HB   ARG  37          2HB       ARG  37   6.537   5.357   5.567
  311   1HG   ARG  37          1HG       ARG  37   8.143   4.331   4.335
  312   2HG   ARG  37          2HG       ARG  37   8.143   5.631   3.160
  313   1HD   ARG  37          1HD       ARG  37  10.306   5.910   3.929
  314   2HD   ARG  37          2HD       ARG  37   9.503   6.899   5.132
  315    HE   ARG  37           HE       ARG  37   9.653   4.062   5.866
  316   1HH1  ARG  37          2HH2      ARG  37  11.300   7.169   5.976
  317   2HH1  ARG  37          1HH2      ARG  37  12.280   6.746   7.341
  318   1HH2  ARG  37          2HH1      ARG  37  10.945   3.503   7.666
  319   2HH2  ARG  37          1HH1      ARG  37  12.076   4.646   8.308
  320    H    VAL  38           H        VAL  38   6.834   9.215   4.594
  321    HA   VAL  38           HA       VAL  38   7.660   9.858   1.901
  322    HB   VAL  38           HB       VAL  38   7.564  11.452   4.470
  323   1HG1  VAL  38          1HG1      VAL  38   8.462  12.152   1.691
  324   2HG1  VAL  38          2HG1      VAL  38   7.639  13.383   2.680
  325   3HG1  VAL  38          3HG1      VAL  38   9.143  12.631   3.264
  326   1HG2  VAL  38          1HG2      VAL  38   5.425  10.564   3.115
  327   2HG2  VAL  38          2HG2      VAL  38   5.470  12.158   3.906
  328   3HG2  VAL  38          3HG2      VAL  38   5.771  12.024   2.157
  329    H    VAL  39           H        VAL  39   9.749   9.984   1.165
  330    HA   VAL  39           HA       VAL  39  11.827   9.445   3.174
  331    HB   VAL  39           HB       VAL  39  11.592   8.550   0.296
  332   1HG1  VAL  39          1HG1      VAL  39  13.835   8.605   0.265
  333   2HG1  VAL  39          2HG1      VAL  39  13.941   8.884   2.020
  334   3HG1  VAL  39          3HG1      VAL  39  13.763   7.228   1.391
  335   1HG2  VAL  39          1HG2      VAL  39  10.869   6.570   1.059
  336   2HG2  VAL  39          2HG2      VAL  39  12.087   6.529   2.357
  337   3HG2  VAL  39          3HG2      VAL  39  10.556   7.406   2.599
  338    HA   PRO  40           HA       PRO  40  12.743  13.484   1.469
  339   1HB   PRO  40          1HB       PRO  40  13.527  14.652   3.811
  340   2HB   PRO  40          2HB       PRO  40  11.884  14.724   3.208
  341   1HG   PRO  40          1HG       PRO  40  12.979  13.089   5.414
  342   2HG   PRO  40          2HG       PRO  40  11.309  13.496   5.074
  343   1HD   PRO  40          1HD       PRO  40  12.601  10.988   4.561
  344   2HD   PRO  40          2HD       PRO  40  10.966  11.434   4.116
  345    H    GLY  41           H        GLY  41  14.317  11.519   0.747
  346   1HA   GLY  41          1HA       GLY  41  16.892  11.714   2.002
  347   2HA   GLY  41          2HA       GLY  41  16.468  10.826   0.552
  348    H    GLY  42           H        GLY  42  16.437  11.917  -1.534
  349   1HA   GLY  42          1HA       GLY  42  18.486  13.847  -1.821
  350   2HA   GLY  42          2HA       GLY  42  17.391  13.269  -3.061
  351    H    CYS  43           H        CYS  43  18.390  16.064  -2.331
  352    HA   CYS  43           HA       CYS  43  16.287  17.489  -1.180
  353   1HB   CYS  43          1HB       CYS  43  18.865  18.061  -2.138
  354   2HB   CYS  43          2HB       CYS  43  17.800  19.055  -3.111
  355    HG   CYS  43           HG       CYS  43  18.587  20.507  -1.125
  356    H    SER  44           H        SER  44  17.008  16.307  -4.473
  357    HA   SER  44           HA       SER  44  14.648  17.703  -5.435
  358   1HB   SER  44          1HB       SER  44  15.733  17.925  -7.412
  359   2HB   SER  44          2HB       SER  44  17.174  17.414  -6.555
  360    HG   SER  44           HG       SER  44  16.768  15.230  -7.193
  361    H    GLY  45           H        GLY  45  16.134  14.506  -4.872
  362   1HA   GLY  45          1HA       GLY  45  13.755  13.177  -5.992
  363   2HA   GLY  45          2HA       GLY  45  15.316  12.441  -5.686
  364    H    PHE  46           H        PHE  46  12.227  12.366  -4.628
  365    HA   PHE  46           HA       PHE  46  12.911  11.156  -2.182
  366   1HB   PHE  46          1HB       PHE  46  11.763  12.864  -0.723
  367   2HB   PHE  46          2HB       PHE  46  13.159  13.561  -1.520
  368    HD1  PHE  46           1HD      PHE  46   9.756  14.007  -0.804
  369    HD2  PHE  46           2HD      PHE  46  12.643  14.745  -3.825
  370    HE1  PHE  46           1HE      PHE  46   8.310  15.833  -1.741
  371    HE2  PHE  46           2HE      PHE  46  11.197  16.570  -4.762
  372    HZ   PHE  46           HZ       PHE  46   9.048  17.092  -3.709
  373    H    GLN  47           H        GLN  47  11.647   9.545  -3.394
  374    HA   GLN  47           HA       GLN  47   8.836  10.220  -3.610
  375   1HB   GLN  47          1HB       GLN  47  10.403   7.822  -4.659
  376   2HB   GLN  47          2HB       GLN  47   8.689   8.080  -4.919
  377   1HG   GLN  47          1HG       GLN  47  10.341  10.436  -5.634
  378   2HG   GLN  47          2HG       GLN  47  10.738   9.009  -6.570
  379   1HE2  GLN  47          1HE2      GLN  47   9.907  10.391  -8.307
  380   2HE2  GLN  47          2HE2      GLN  47   8.215  10.370  -8.675
  381    H    TYR  48           H        TYR  48   7.374   8.090  -3.142
  382    HA   TYR  48           HA       TYR  48   7.993   7.421  -0.375
  383   1HB   TYR  48          1HB       TYR  48   5.567   6.984  -2.229
  384   2HB   TYR  48          2HB       TYR  48   5.555   6.680  -0.503
  385    HD1  TYR  48           1HD      TYR  48   5.082   8.418   1.040
  386    HD2  TYR  48           2HD      TYR  48   5.915   9.381  -3.045
  387    HE1  TYR  48           1HE      TYR  48   4.352  10.818   1.449
  388    HE2  TYR  48           2HE      TYR  48   5.182  11.778  -2.622
  389    HH   TYR  48           HH       TYR  48   4.702  12.985   0.532
  390    H    ALA  49           H        ALA  49   8.958   5.521   0.116
  391    HA   ALA  49           HA       ALA  49   9.105   3.470  -1.900
  392   1HB   ALA  49          1HB       ALA  49  10.163   2.617   0.614
  393   2HB   ALA  49          2HB       ALA  49  11.054   3.137  -0.837
  394   3HB   ALA  49          3HB       ALA  49  10.599   4.330   0.403
  395    H    MET  50           H        MET  50   8.523   1.178  -1.401
  396    HA   MET  50           HA       MET  50   6.072   1.169   0.175
  397   1HB   MET  50          1HB       MET  50   6.997  -0.779  -2.008
  398   2HB   MET  50          2HB       MET  50   5.405  -0.739  -1.278
  399   1HG   MET  50          1HG       MET  50   6.071   1.909  -2.304
  400   2HG   MET  50          2HG       MET  50   6.302   0.717  -3.567
  401   1HE   MET  50          1HE       MET  50   3.039  -1.338  -3.201
  402   2HE   MET  50          2HE       MET  50   3.793  -0.699  -4.682
  403   3HE   MET  50          3HE       MET  50   4.809  -1.383  -3.390
  404    H    GLY  51           H        GLY  51   5.562  -1.292   0.918
  405   1HA   GLY  51          1HA       GLY  51   7.690  -3.002   1.551
  406   2HA   GLY  51          2HA       GLY  51   7.453  -1.911   2.902
  407    H    PHE  52           H        PHE  52   6.932  -4.193   3.866
  408    HA   PHE  52           HA       PHE  52   4.029  -4.483   3.723
  409   1HB   PHE  52          1HB       PHE  52   4.691  -7.052   4.017
  410   2HB   PHE  52          2HB       PHE  52   4.732  -6.352   2.411
  411    HD1  PHE  52           1HD      PHE  52   6.527  -8.260   4.713
  412    HD2  PHE  52           2HD      PHE  52   7.074  -5.243   1.779
  413    HE1  PHE  52           1HE      PHE  52   8.940  -8.915   4.489
  414    HE2  PHE  52           2HE      PHE  52   9.487  -5.898   1.555
  415    HZ   PHE  52           HZ       PHE  52  10.391  -7.726   2.913
  416    H    ASP  53           H        ASP  53   3.146  -4.366   5.732
  417    HA   ASP  53           HA       ASP  53   4.956  -4.951   7.941
  418   1HB   ASP  53          1HB       ASP  53   3.960  -2.570   7.620
  419   2HB   ASP  53          2HB       ASP  53   2.418  -3.270   8.071
  420    H    ASP  54           H        ASP  54   3.445  -5.509  10.043
  421    HA   ASP  54           HA       ASP  54   1.188  -7.103   9.180
  422   1HB   ASP  54          1HB       ASP  54   3.562  -8.081  10.824
  423   2HB   ASP  54          2HB       ASP  54   2.020  -8.914  10.830
  424    H    THR  55           H        THR  55   1.090  -4.576  10.428
  425    HA   THR  55           HA       THR  55  -0.292  -5.181  12.837
  426    HB   THR  55           HB       THR  55   2.057  -5.309  13.681
  427    HG1  THR  55           1HG      THR  55   0.275  -4.282  14.924
  428   1HG2  THR  55          1HG2      THR  55   2.236  -2.351  12.929
  429   2HG2  THR  55          2HG2      THR  55   3.512  -3.369  13.641
  430   3HG2  THR  55          3HG2      THR  55   3.001  -3.630  11.955
  431    H    VAL  56           H        VAL  56  -1.489  -3.370  13.654
  432    HA   VAL  56           HA       VAL  56  -1.839  -1.369  11.563
  433    HB   VAL  56           HB       VAL  56  -3.515  -2.679  13.605
  434   1HG1  VAL  56          1HG1      VAL  56  -3.688  -0.514  14.573
  435   2HG1  VAL  56          2HG1      VAL  56  -3.797   0.272  12.980
  436   3HG1  VAL  56          3HG1      VAL  56  -5.145  -0.729  13.573
  437   1HG2  VAL  56          1HG2      VAL  56  -3.943  -3.269  11.364
  438   2HG2  VAL  56          2HG2      VAL  56  -5.255  -2.144  11.793
  439   3HG2  VAL  56          3HG2      VAL  56  -3.881  -1.577  10.813
  440    H    GLU  57           H        GLU  57  -2.060   0.925  12.151
  441    HA   GLU  57           HA       GLU  57  -0.240   1.519  14.329
  442   1HB   GLU  57          1HB       GLU  57  -1.231   3.569  12.338
  443   2HB   GLU  57          2HB       GLU  57   0.291   3.527  13.205
  444   1HG   GLU  57          1HG       GLU  57  -0.516   1.542  11.026
  445   2HG   GLU  57          2HG       GLU  57   0.523   2.929  10.770
  446    H    GLU  58           H        GLU  58  -0.771   3.786  15.435
  447    HA   GLU  58           HA       GLU  58  -3.356   3.422  16.567
  448   1HB   GLU  58          1HB       GLU  58  -0.984   4.286  17.580
  449   2HB   GLU  58          2HB       GLU  58  -1.720   5.840  17.240
  450   1HG   GLU  58          1HG       GLU  58  -2.514   5.441  19.405
  451   2HG   GLU  58          2HG       GLU  58  -3.841   4.815  18.448
  452    H    GLY  59           H        GLY  59  -3.750   3.952  13.885
  453   1HA   GLY  59          1HA       GLY  59  -5.658   5.509  13.381
  454   2HA   GLY  59          2HA       GLY  59  -4.551   6.798  13.813
  455    H    ASP  60           H        ASP  60  -4.669   3.844  11.692
  456    HA   ASP  60           HA       ASP  60  -3.339   5.480   9.678
  457   1HB   ASP  60          1HB       ASP  60  -2.452   3.043  10.874
  458   2HB   ASP  60          2HB       ASP  60  -2.982   2.613   9.260
  459    H    HIS  61           H        HIS  61  -4.542   5.621   7.764
  460    HA   HIS  61           HA       HIS  61  -7.067   4.427   7.622
  461   1HB   HIS  61          1HB       HIS  61  -5.372   5.824   5.537
  462   2HB   HIS  61          2HB       HIS  61  -7.031   5.329   5.269
  463    HD1  HIS  61           1HD      HIS  61  -8.899   6.549   6.758
  464    HD2  HIS  61           2HD      HIS  61  -5.046   8.195   6.956
  465    HE1  HIS  61           1HE      HIS  61  -9.166   8.871   7.780
  466    H    VAL  62           H        VAL  62  -7.307   2.237   7.516
  467    HA   VAL  62           HA       VAL  62  -5.429   0.731   5.885
  468    HB   VAL  62           HB       VAL  62  -6.500   0.271   8.322
  469   1HG1  VAL  62          1HG1      VAL  62  -8.168  -1.432   6.444
  470   2HG1  VAL  62          2HG1      VAL  62  -8.211  -1.419   8.223
  471   3HG1  VAL  62          3HG1      VAL  62  -8.777  -0.001   7.309
  472   1HG2  VAL  62          1HG2      VAL  62  -4.673  -0.928   6.815
  473   2HG2  VAL  62          2HG2      VAL  62  -5.363  -1.724   8.250
  474   3HG2  VAL  62          3HG2      VAL  62  -5.964  -2.139   6.626
  475    H    PHE  63           H        PHE  63  -5.893  -0.019   3.869
  476    HA   PHE  63           HA       PHE  63  -8.693   0.241   3.021
  477   1HB   PHE  63          1HB       PHE  63  -6.142   1.274   2.031
  478   2HB   PHE  63          2HB       PHE  63  -6.780   0.164   0.834
  479    HD1  PHE  63           1HD      PHE  63  -7.599   1.458  -0.899
  480    HD2  PHE  63           2HD      PHE  63  -8.541   2.559   3.089
  481    HE1  PHE  63           1HE      PHE  63  -9.124   3.259  -1.756
  482    HE2  PHE  63           2HE      PHE  63 -10.065   4.360   2.233
  483    HZ   PHE  63           HZ       PHE  63 -10.338   4.688  -0.180
  484    H    GLU  64           H        GLU  64  -9.666  -1.527   2.065
  485    HA   GLU  64           HA       GLU  64  -8.075  -3.932   2.092
  486   1HB   GLU  64          1HB       GLU  64 -11.044  -3.741   1.475
  487   2HB   GLU  64          2HB       GLU  64 -10.156  -5.126   2.080
  488   1HG   GLU  64          1HG       GLU  64  -9.785  -4.039   4.239
  489   2HG   GLU  64          2HG       GLU  64 -10.423  -2.519   3.644
  490    H    TYR  65           H        TYR  65  -6.915  -4.323   0.247
  491    HA   TYR  65           HA       TYR  65  -8.114  -3.534  -2.302
  492   1HB   TYR  65          1HB       TYR  65  -5.480  -3.672  -1.019
  493   2HB   TYR  65          2HB       TYR  65  -5.450  -4.701  -2.438
  494    HD1  TYR  65           1HD      TYR  65  -5.720  -1.247  -1.222
  495    HD2  TYR  65           2HD      TYR  65  -5.685  -3.753  -4.690
  496    HE1  TYR  65           1HE      TYR  65  -5.343   0.789  -2.698
  497    HE2  TYR  65           2HE      TYR  65  -5.308  -1.709  -6.154
  498    HH   TYR  65           HH       TYR  65  -5.255   1.540  -4.735
  499    H    ASP  66           H        ASP  66  -6.549  -5.353  -3.911
  500    HA   ASP  66           HA       ASP  66  -8.322  -7.498  -3.918
  501   1HB   ASP  66          1HB       ASP  66  -6.936  -6.525  -5.861
  502   2HB   ASP  66          2HB       ASP  66  -5.562  -7.401  -5.216
  503    H    GLY  67           H        GLY  67  -7.899  -8.061  -1.499
  504   1HA   GLY  67          1HA       GLY  67  -7.178  -9.643  -0.056
  505   2HA   GLY  67          2HA       GLY  67  -6.233 -10.370  -1.340
  506    H    VAL  68           H        VAL  68  -5.972  -6.931  -0.342
  507    HA   VAL  68           HA       VAL  68  -3.561  -7.501   1.160
  508    HB   VAL  68           HB       VAL  68  -3.624  -5.987  -1.447
  509   1HG1  VAL  68          1HG1      VAL  68  -2.500  -4.495   0.039
  510   2HG1  VAL  68          2HG1      VAL  68  -1.584  -5.824   0.790
  511   3HG1  VAL  68          3HG1      VAL  68  -1.241  -5.343  -0.890
  512   1HG2  VAL  68          1HG2      VAL  68  -1.392  -7.467  -1.545
  513   2HG2  VAL  68          2HG2      VAL  68  -2.336  -8.475  -0.422
  514   3HG2  VAL  68          3HG2      VAL  68  -2.983  -8.096  -2.037
  515    H    LYS  69           H        LYS  69  -2.811  -5.559   2.363
  516    HA   LYS  69           HA       LYS  69  -5.010  -3.633   2.668
  517   1HB   LYS  69          1HB       LYS  69  -3.664  -5.354   4.628
  518   2HB   LYS  69          2HB       LYS  69  -3.681  -3.666   5.095
  519   1HG   LYS  69          1HG       LYS  69  -6.107  -3.543   4.868
  520   2HG   LYS  69          2HG       LYS  69  -6.176  -5.126   4.120
  521   1HD   LYS  69          1HD       LYS  69  -4.955  -5.861   6.412
  522   2HD   LYS  69          2HD       LYS  69  -5.727  -4.407   7.013
  523   1HE   LYS  69          1HE       LYS  69  -7.887  -5.401   5.807
  524   2HE   LYS  69          2HE       LYS  69  -7.015  -6.918   5.913
  525   1HZ   LYS  69          1HZ       LYS  69  -8.223  -5.390   7.989
  526   2HZ   LYS  69          2HZ       LYS  69  -7.853  -6.981   7.949
  527   3HZ   LYS  69          3HZ       LYS  69  -6.713  -5.887   8.366
  528    H    VAL  70           H        VAL  70  -4.453  -1.440   2.906
  529    HA   VAL  70           HA       VAL  70  -1.592  -0.862   2.619
  530    HB   VAL  70           HB       VAL  70  -3.907   0.064   0.944
  531   1HG1  VAL  70          1HG1      VAL  70  -2.565   1.893   0.060
  532   2HG1  VAL  70          2HG1      VAL  70  -2.788   2.095   1.814
  533   3HG1  VAL  70          3HG1      VAL  70  -1.238   1.494   1.177
  534   1HG2  VAL  70          1HG2      VAL  70  -1.293  -0.346  -0.311
  535   2HG2  VAL  70          2HG2      VAL  70  -1.885  -1.790   0.544
  536   3HG2  VAL  70          3HG2      VAL  70  -2.883  -1.034  -0.721
  537    H    VAL  71           H        VAL  71  -0.916   1.158   3.553
  538    HA   VAL  71           HA       VAL  71  -2.940   2.621   5.036
  539    HB   VAL  71           HB       VAL  71  -2.086   2.257   7.134
  540   1HG1  VAL  71          1HG1      VAL  71  -1.519  -0.402   5.781
  541   2HG1  VAL  71          2HG1      VAL  71  -1.937  -0.137   7.491
  542   3HG1  VAL  71          3HG1      VAL  71  -3.137   0.196   6.219
  543   1HG2  VAL  71          1HG2      VAL  71   0.137   1.323   7.636
  544   2HG2  VAL  71          2HG2      VAL  71   0.469   1.179   5.894
  545   3HG2  VAL  71          3HG2      VAL  71   0.251   2.785   6.628
  546    H    ILE  72           H        ILE  72  -2.213   4.763   5.654
  547    HA   ILE  72           HA       ILE  72   0.413   5.533   4.691
  548    HB   ILE  72           HB       ILE  72  -2.059   6.936   3.684
  549   1HG1  ILE  72          1HG1      ILE  72  -0.344   4.877   2.265
  550   2HG1  ILE  72          2HG1      ILE  72  -2.015   4.677   2.753
  551   1HG2  ILE  72          1HG2      ILE  72  -0.596   8.178   2.298
  552   2HG2  ILE  72          2HG2      ILE  72   0.113   8.209   3.930
  553   3HG2  ILE  72          3HG2      ILE  72   0.788   7.129   2.687
  554   1HD1  ILE  72          1HD1      ILE  72  -2.591   6.705   1.307
  555   2HD1  ILE  72          2HD1      ILE  72  -0.923   6.635   0.688
  556   3HD1  ILE  72          3HD1      ILE  72  -2.033   5.271   0.412
  557    H    ASP  73           H        ASP  73   1.334   6.734   6.258
  558    HA   ASP  73           HA       ASP  73   0.300   7.326   8.595
  559   1HB   ASP  73          1HB       ASP  73   2.079   9.252   7.028
  560   2HB   ASP  73          2HB       ASP  73   1.941   9.187   8.774
  561    HA   PRO  74           HA       PRO  74  -2.561  10.610   8.082
  562   1HB   PRO  74          1HB       PRO  74  -2.378  11.972  10.445
  563   2HB   PRO  74          2HB       PRO  74  -3.273  10.476  10.268
  564   1HG   PRO  74          1HG       PRO  74  -0.647  10.924  11.549
  565   2HG   PRO  74          2HG       PRO  74  -1.737   9.564  11.727
  566   1HD   PRO  74          1HD       PRO  74   0.676   9.637  10.178
  567   2HD   PRO  74          2HD       PRO  74  -0.475   8.318  10.265
  568    H    PHE  75           H        PHE  75   0.720  11.368   8.607
  569    HA   PHE  75           HA       PHE  75   0.291  14.153   7.964
  570   1HB   PHE  75          1HB       PHE  75   2.363  12.335   9.067
  571   2HB   PHE  75          2HB       PHE  75   3.053  13.430   7.886
  572    HD1  PHE  75           1HD      PHE  75   1.538  13.150  11.186
  573    HD2  PHE  75           2HD      PHE  75   3.053  15.850   8.284
  574    HE1  PHE  75           1HE      PHE  75   1.645  14.957  12.924
  575    HE2  PHE  75           2HE      PHE  75   3.161  17.657  10.023
  576    HZ   PHE  75           HZ       PHE  75   2.456  17.189  12.322
  577    H    SER  76           H        SER  76   1.279  11.109   6.417
  578    HA   SER  76           HA       SER  76   2.252  12.533   4.117
  579   1HB   SER  76          1HB       SER  76   2.753  10.250   3.240
  580   2HB   SER  76          2HB       SER  76   3.470  10.534   4.814
  581    HG   SER  76           HG       SER  76   2.522   8.613   5.189
  582    H    MET  77           H        MET  77  -0.704  11.202   5.362
  583    HA   MET  77           HA       MET  77  -1.921  10.292   3.082
  584   1HB   MET  77          1HB       MET  77  -2.598  10.844   5.786
  585   2HB   MET  77          2HB       MET  77  -3.723  11.820   4.862
  586   1HG   MET  77          1HG       MET  77  -3.283   8.931   4.060
  587   2HG   MET  77          2HG       MET  77  -4.304   9.285   5.440
  588   1HE   MET  77          1HE       MET  77  -4.265  10.573   1.294
  589   2HE   MET  77          2HE       MET  77  -3.619   9.082   2.021
  590   3HE   MET  77          3HE       MET  77  -5.232   9.079   1.268
  591    HA   PRO  78           HA       PRO  78  -3.330  14.770   2.364
  592   1HB   PRO  78          1HB       PRO  78  -2.151  16.803   3.758
  593   2HB   PRO  78          2HB       PRO  78  -3.673  16.073   4.230
  594   1HG   PRO  78          1HG       PRO  78  -0.996  15.721   5.433
  595   2HG   PRO  78          2HG       PRO  78  -2.565  15.357   6.122
  596   1HD   PRO  78          1HD       PRO  78  -0.688  13.477   5.040
  597   2HD   PRO  78          2HD       PRO  78  -2.304  13.128   5.622
  598    H    TYR  79           H        TYR  79  -0.366  13.473   2.324
  599    HA   TYR  79           HA       TYR  79   0.658  15.567   0.537
  600   1HB   TYR  79          1HB       TYR  79   1.765  13.358   2.333
  601   2HB   TYR  79          2HB       TYR  79   2.750  13.897   0.988
  602    HD1  TYR  79           1HD      TYR  79   0.795  15.364   3.841
  603    HD2  TYR  79           2HD      TYR  79   4.285  15.594   1.377
  604    HE1  TYR  79           1HE      TYR  79   1.668  17.295   5.245
  605    HE2  TYR  79           2HE      TYR  79   5.146  17.524   2.789
  606    HH   TYR  79           HH       TYR  79   4.079  18.202   5.755
  607    H    VAL  80           H        VAL  80  -0.641  12.327   0.709
  608    HA   VAL  80           HA       VAL  80  -0.027  12.019  -2.134
  609    HB   VAL  80           HB       VAL  80   0.411   9.626  -1.757
  610   1HG1  VAL  80          1HG1      VAL  80   2.296  11.368  -0.138
  611   2HG1  VAL  80          2HG1      VAL  80   2.685   9.865  -1.009
  612   3HG1  VAL  80          3HG1      VAL  80   2.244  11.331  -1.917
  613   1HG2  VAL  80          1HG2      VAL  80   1.151   9.612   0.988
  614   2HG2  VAL  80          2HG2      VAL  80  -0.514  10.234   0.892
  615   3HG2  VAL  80          3HG2      VAL  80  -0.112   8.654   0.179
  616    H    ASN  81           H        ASN  81  -2.367  13.147  -1.246
  617    HA   ASN  81           HA       ASN  81  -4.240  10.945  -1.062
  618   1HB   ASN  81          1HB       ASN  81  -4.224  13.190   0.396
  619   2HB   ASN  81          2HB       ASN  81  -5.029  13.877  -1.001
  620   1HD2  ASN  81          1HD2      ASN  81  -5.631  12.754   1.904
  621   2HD2  ASN  81          2HD2      ASN  81  -7.173  11.989   1.717
  622    H    GLY  82           H        GLY  82  -5.841  10.622  -2.721
  623   1HA   GLY  82          1HA       GLY  82  -6.604  10.609  -4.839
  624   2HA   GLY  82          2HA       GLY  82  -6.653  12.353  -4.675
  625    H    ALA  83           H        ALA  83  -4.110   9.778  -5.100
  626    HA   ALA  83           HA       ALA  83  -3.235  11.073  -7.523
  627   1HB   ALA  83          1HB       ALA  83  -0.939  10.657  -5.754
  628   2HB   ALA  83          2HB       ALA  83  -1.379  12.078  -6.731
  629   3HB   ALA  83          3HB       ALA  83  -2.073  11.867  -5.106
  630    H    GLU  84           H        GLU  84  -1.624   9.705  -8.682
  631    HA   GLU  84           HA       GLU  84  -2.075   6.937  -7.932
  632   1HB   GLU  84          1HB       GLU  84  -1.424   6.443 -10.303
  633   2HB   GLU  84          2HB       GLU  84  -2.823   7.491 -10.178
  634   1HG   GLU  84          1HG       GLU  84  -1.765   9.156 -11.300
  635   2HG   GLU  84          2HG       GLU  84  -0.408   9.115 -10.191
  636    H    LEU  85           H        LEU  85  -0.381   5.542  -7.433
  637    HA   LEU  85           HA       LEU  85   2.307   6.714  -7.620
  638   1HB   LEU  85          1HB       LEU  85   2.153   6.748  -5.389
  639   2HB   LEU  85          2HB       LEU  85   0.837   5.592  -5.342
  640    HG   LEU  85           HG       LEU  85   2.445   3.742  -5.653
  641   1HD1  LEU  85          1HD1      LEU  85   4.165   4.947  -6.908
  642   2HD1  LEU  85          2HD1      LEU  85   4.572   5.892  -5.456
  643   3HD1  LEU  85          3HD1      LEU  85   4.850   4.134  -5.481
  644   1HD2  LEU  85          1HD2      LEU  85   2.922   5.614  -3.325
  645   2HD2  LEU  85          2HD2      LEU  85   1.803   4.232  -3.414
  646   3HD2  LEU  85          3HD2      LEU  85   3.562   3.955  -3.410
  647    H    ASP  86           H        ASP  86   3.287   5.714  -9.306
  648    HA   ASP  86           HA       ASP  86   2.641   2.930  -9.736
  649   1HB   ASP  86          1HB       ASP  86   2.947   5.001 -11.494
  650   2HB   ASP  86          2HB       ASP  86   4.587   4.385 -11.497
  651    H    TYR  87           H        TYR  87   3.935   1.668  -8.339
  652    HA   TYR  87           HA       TYR  87   6.654   2.479  -7.798
  653   1HB   TYR  87          1HB       TYR  87   5.017   1.475  -6.117
  654   2HB   TYR  87          2HB       TYR  87   4.916   0.029  -7.101
  655    HD1  TYR  87           1HD      TYR  87   8.148   1.725  -6.682
  656    HD2  TYR  87           2HD      TYR  87   5.599  -1.384  -5.218
  657    HE1  TYR  87           1HE      TYR  87  10.101   0.715  -5.405
  658    HE2  TYR  87           2HE      TYR  87   7.560  -2.383  -3.946
  659    HH   TYR  87           HH       TYR  87  10.694  -1.620  -4.579
  660    H    VAL  88           H        VAL  88   8.219   2.061  -9.281
  661    HA   VAL  88           HA       VAL  88   7.889   0.011 -11.223
  662    HB   VAL  88           HB       VAL  88  10.267   1.716 -10.456
  663   1HG1  VAL  88          1HG1      VAL  88  10.761  -0.426 -11.738
  664   2HG1  VAL  88          2HG1      VAL  88   9.823   0.271 -13.081
  665   3HG1  VAL  88          3HG1      VAL  88  11.295   1.090 -12.504
  666   1HG2  VAL  88          1HG2      VAL  88   8.102   2.859 -11.236
  667   2HG2  VAL  88          2HG2      VAL  88   9.602   3.257 -12.108
  668   3HG2  VAL  88          3HG2      VAL  88   8.432   2.123 -12.823
  669    H    VAL  89           H        VAL  89   9.068  -1.959 -11.443
  670    HA   VAL  89           HA       VAL  89  10.430  -2.808  -8.985
  671    HB   VAL  89           HB       VAL  89   8.620  -4.553 -10.654
  672   1HG1  VAL  89          1HG1      VAL  89   8.714  -5.617  -8.135
  673   2HG1  VAL  89          2HG1      VAL  89   9.755  -6.116  -9.490
  674   3HG1  VAL  89          3HG1      VAL  89  10.352  -4.939  -8.295
  675   1HG2  VAL  89          1HG2      VAL  89   7.973  -2.674  -8.427
  676   2HG2  VAL  89          2HG2      VAL  89   6.985  -3.197  -9.812
  677   3HG2  VAL  89          3HG2      VAL  89   7.191  -4.273  -8.410
  678    H    ASP  90           H        ASP  90  12.514  -3.298  -9.412
  679    HA   ASP  90           HA       ASP  90  13.133  -4.905 -11.647
  680   1HB   ASP  90          1HB       ASP  90  14.142  -2.022 -11.576
  681   2HB   ASP  90          2HB       ASP  90  14.794  -3.259 -12.632
  682    H    PHE  91           H        PHE  91  15.895  -4.608 -11.778
  683    HA   PHE  91           HA       PHE  91  17.625  -5.461 -10.630
  684   1HB   PHE  91          1HB       PHE  91  17.357  -2.763 -10.458
  685   2HB   PHE  91          2HB       PHE  91  17.177  -3.107  -8.749
  686    HD1  PHE  91           1HD      PHE  91  19.107  -2.593  -7.613
  687    HD2  PHE  91           2HD      PHE  91  19.432  -4.457 -11.411
  688    HE1  PHE  91           1HE      PHE  91  21.604  -2.665  -7.364
  689    HE2  PHE  91           2HE      PHE  91  21.929  -4.529 -11.162
  690    HZ   PHE  91           HZ       PHE  91  22.985  -3.632  -9.142
  691    H    MET  92           H        MET  92  18.051  -4.468  -7.682
  692    HA   MET  92           HA       MET  92  16.782  -6.800  -6.561
  693   1HB   MET  92          1HB       MET  92  19.218  -5.277  -6.144
  694   2HB   MET  92          2HB       MET  92  18.326  -5.269  -4.636
  695   1HG   MET  92          1HG       MET  92  18.931  -7.807  -6.229
  696   2HG   MET  92          2HG       MET  92  19.921  -7.234  -4.901
  697   1HE   MET  92          1HE       MET  92  16.795  -8.829  -6.138
  698   2HE   MET  92          2HE       MET  92  17.815 -10.061  -5.357
  699   3HE   MET  92          3HE       MET  92  16.203  -9.693  -4.699
  700    H    GLY  93           H        GLY  93  15.389  -4.104  -7.269
  701   1HA   GLY  93          1HA       GLY  93  13.718  -4.040  -4.933
  702   2HA   GLY  93          2HA       GLY  93  14.705  -2.602  -5.099
  703    H    GLY  94           H        GLY  94  14.232  -1.053  -6.690
  704   1HA   GLY  94          1HA       GLY  94  12.899  -1.340  -9.041
  705   2HA   GLY  94          2HA       GLY  94  11.609  -1.232  -7.860
  706    H    GLY  95           H        GLY  95  10.935   0.827  -8.769
  707   1HA   GLY  95          1HA       GLY  95  12.553   3.055  -7.742
  708   2HA   GLY  95          2HA       GLY  95  12.091   3.047  -9.433
  709    H    PHE  96           H        PHE  96  11.196   4.095  -6.350
  710    HA   PHE  96           HA       PHE  96   8.371   3.818  -6.613
  711   1HB   PHE  96          1HB       PHE  96   9.898   5.864  -4.929
  712   2HB   PHE  96          2HB       PHE  96   8.411   5.037  -4.511
  713    HD1  PHE  96           1HD      PHE  96  11.822   5.173  -3.871
  714    HD2  PHE  96           2HD      PHE  96   8.683   2.367  -4.403
  715    HE1  PHE  96           1HE      PHE  96  13.135   3.461  -2.588
  716    HE2  PHE  96           2HE      PHE  96   9.996   0.656  -3.119
  717    HZ   PHE  96           HZ       PHE  96  12.206   1.223  -2.227
  718    H    THR  97           H        THR  97   7.041   5.037  -7.862
  719    HA   THR  97           HA       THR  97   7.878   7.801  -8.416
  720    HB   THR  97           HB       THR  97   6.985   5.607 -10.341
  721    HG1  THR  97           1HG      THR  97   9.264   5.924 -10.038
  722   1HG2  THR  97          1HG2      THR  97   7.124   7.519 -12.068
  723   2HG2  THR  97          2HG2      THR  97   5.663   7.519 -11.052
  724   3HG2  THR  97          3HG2      THR  97   6.995   8.645 -10.695
  725    H    ILE  98           H        ILE  98   6.388   9.299  -7.951
  726    HA   ILE  98           HA       ILE  98   3.616   8.356  -7.742
  727    HB   ILE  98           HB       ILE  98   4.918   8.681  -5.544
  728   1HG1  ILE  98          1HG1      ILE  98   2.446  10.325  -5.460
  729   2HG1  ILE  98          2HG1      ILE  98   2.284   8.733  -6.175
  730   1HG2  ILE  98          1HG2      ILE  98   5.297  10.813  -4.715
  731   2HG2  ILE  98          2HG2      ILE  98   5.803  10.956  -6.415
  732   3HG2  ILE  98          3HG2      ILE  98   4.218  11.583  -5.902
  733   1HD1  ILE  98          1HD1      ILE  98   1.870   8.462  -3.820
  734   2HD1  ILE  98          2HD1      ILE  98   3.496   7.800  -4.113
  735   3HD1  ILE  98          3HD1      ILE  98   3.310   9.415  -3.389
  736    H    ARG  99           H        ARG  99   2.253   9.455  -9.045
  737    HA   ARG  99           HA       ARG  99   3.287  11.936 -10.131
  738   1HB   ARG  99          1HB       ARG  99   2.341   9.807 -11.494
  739   2HB   ARG  99          2HB       ARG  99   0.802  10.594 -11.208
  740   1HG   ARG  99          1HG       ARG  99   2.875  12.494 -12.110
  741   2HG   ARG  99          2HG       ARG  99   2.613  11.202 -13.265
  742   1HD   ARG  99          1HD       ARG  99   0.006  11.831 -12.606
  743   2HD   ARG  99          2HD       ARG  99   0.771  13.397 -12.426
  744    HE   ARG  99           HE       ARG  99   1.752  12.409 -14.853
  745   1HH1  ARG  99          2HH2      ARG  99  -1.430  13.093 -13.515
  746   2HH1  ARG  99          1HH2      ARG  99  -2.140  13.450 -15.054
  747   1HH2  ARG  99          2HH1      ARG  99   0.815  12.881 -16.883
  748   2HH2  ARG  99          1HH1      ARG  99  -0.855  13.329 -16.982
  749    H    ASN 100           H        ASN 100   2.263  13.895  -9.688
  750    HA   ASN 100           HA       ASN 100  -0.299  13.676  -8.313
  751   1HB   ASN 100          1HB       ASN 100   2.170  15.311  -7.704
  752   2HB   ASN 100          2HB       ASN 100   0.617  16.047  -7.363
  753   1HD2  ASN 100          1HD2      ASN 100   0.290  15.932  -5.275
  754   2HD2  ASN 100          2HD2      ASN 100   0.446  14.531  -4.268
  755    HA   PRO 101           HA       PRO 101  -1.573  16.517 -11.406
  756   1HB   PRO 101          1HB       PRO 101  -3.851  17.528 -10.284
  757   2HB   PRO 101          2HB       PRO 101  -3.791  15.979 -11.102
  758   1HG   PRO 101          1HG       PRO 101  -3.922  16.539  -8.203
  759   2HG   PRO 101          2HG       PRO 101  -4.285  15.049  -9.051
  760   1HD   PRO 101          1HD       PRO 101  -1.915  15.633  -7.544
  761   2HD   PRO 101          2HD       PRO 101  -2.229  14.189  -8.487
  Start of MODEL   16
    1    H    MET   1           H        MET   1 -12.124   8.431  23.738
    2    HA   MET   1           HA       MET   1 -14.692   7.371  23.338
    3   1HB   MET   1          1HB       MET   1 -15.415   9.562  24.315
    4   2HB   MET   1          2HB       MET   1 -14.079   8.889  25.228
    5   1HG   MET   1          1HG       MET   1 -12.599  10.331  23.522
    6   2HG   MET   1          2HG       MET   1 -14.082  11.244  23.330
    7   1HE   MET   1          1HE       MET   1 -12.688   9.411  26.704
    8   2HE   MET   1          2HE       MET   1 -11.394   9.899  25.582
    9   3HE   MET   1          3HE       MET   1 -11.587  10.740  27.139
   10    H    GLN   2           H        GLN   2 -13.790   7.229  20.813
   11    HA   GLN   2           HA       GLN   2 -15.622   8.697  19.390
   12   1HB   GLN   2          1HB       GLN   2 -13.206  10.187  19.922
   13   2HB   GLN   2          2HB       GLN   2 -13.260   9.826  18.208
   14   1HG   GLN   2          1HG       GLN   2 -15.650  10.695  18.163
   15   2HG   GLN   2          2HG       GLN   2 -15.462  11.176  19.838
   16   1HE2  GLN   2          1HE2      GLN   2 -15.078  12.044  16.624
   17   2HE2  GLN   2          2HE2      GLN   2 -14.123  13.479  16.802
   18    H    GLU   3           H        GLU   3 -14.918   8.615  16.845
   19    HA   GLU   3           HA       GLU   3 -13.848   5.927  16.548
   20   1HB   GLU   3          1HB       GLU   3 -15.085   5.834  14.435
   21   2HB   GLU   3          2HB       GLU   3 -16.166   6.311  15.729
   22   1HG   GLU   3          1HG       GLU   3 -16.534   8.383  14.827
   23   2HG   GLU   3          2HG       GLU   3 -14.842   8.623  14.442
   24    H    GLN   4           H        GLN   4 -12.453   5.488  14.614
   25    HA   GLN   4           HA       GLN   4 -11.014   7.901  13.831
   26   1HB   GLN   4          1HB       GLN   4  -9.997   5.314  14.952
   27   2HB   GLN   4          2HB       GLN   4  -9.051   6.033  13.665
   28   1HG   GLN   4          1HG       GLN   4  -8.092   7.145  15.454
   29   2HG   GLN   4          2HG       GLN   4  -9.398   8.266  15.124
   30   1HE2  GLN   4          1HE2      GLN   4  -9.196   8.909  17.323
   31   2HE2  GLN   4          2HE2      GLN   4  -9.950   8.012  18.598
   32    H    ALA   5           H        ALA   5 -11.673   8.217  11.729
   33    HA   ALA   5           HA       ALA   5 -12.588   6.253  10.025
   34   1HB   ALA   5          1HB       ALA   5 -13.100   8.447   9.421
   35   2HB   ALA   5          2HB       ALA   5 -11.438   9.022   9.697
   36   3HB   ALA   5          3HB       ALA   5 -11.815   8.045   8.257
   37    H    GLN   6           H        GLN   6 -11.643   4.719   8.739
   38    HA   GLN   6           HA       GLN   6  -8.739   4.890   8.519
   39   1HB   GLN   6          1HB       GLN   6 -10.171   2.942   9.936
   40   2HB   GLN   6          2HB       GLN   6  -9.825   2.153   8.410
   41   1HG   GLN   6          1HG       GLN   6  -7.701   1.782   9.103
   42   2HG   GLN   6          2HG       GLN   6  -7.424   3.512   9.137
   43   1HE2  GLN   6          1HE2      GLN   6  -7.264   0.782  10.900
   44   2HE2  GLN   6          2HE2      GLN   6  -7.410   1.394  12.514
   45    H    GLN   7           H        GLN   7 -10.635   5.987   6.649
   46    HA   GLN   7           HA       GLN   7 -10.200   4.131   4.441
   47   1HB   GLN   7          1HB       GLN   7 -12.689   5.198   5.415
   48   2HB   GLN   7          2HB       GLN   7 -12.388   5.909   3.842
   49   1HG   GLN   7          1HG       GLN   7 -11.906   3.556   2.964
   50   2HG   GLN   7          2HG       GLN   7 -12.438   2.931   4.513
   51   1HE2  GLN   7          1HE2      GLN   7 -13.477   5.304   2.063
   52   2HE2  GLN   7          2HE2      GLN   7 -15.151   4.863   2.027
   53    H    PHE   8           H        PHE   8  -8.459   5.001   3.368
   54    HA   PHE   8           HA       PHE   8  -8.607   7.881   2.811
   55   1HB   PHE   8          1HB       PHE   8  -6.206   7.915   3.086
   56   2HB   PHE   8          2HB       PHE   8  -6.757   6.883   4.390
   57    HD1  PHE   8           1HD      PHE   8  -6.354   4.482   4.334
   58    HD2  PHE   8           2HD      PHE   8  -5.007   6.988   1.185
   59    HE1  PHE   8           1HE      PHE   8  -4.859   2.642   3.510
   60    HE2  PHE   8           2HE      PHE   8  -3.512   5.148   0.361
   61    HZ   PHE   8           HZ       PHE   8  -3.455   2.997   1.533
   62    H    ILE   9           H        ILE   9  -8.766   8.412   0.683
   63    HA   ILE   9           HA       ILE   9  -8.710   6.330  -1.261
   64    HB   ILE   9           HB       ILE   9  -8.986   9.324  -1.548
   65   1HG1  ILE   9          1HG1      ILE   9 -10.687   7.895  -0.137
   66   2HG1  ILE   9          2HG1      ILE   9 -11.245   9.131  -1.247
   67   1HG2  ILE   9          1HG2      ILE   9  -9.480   7.071  -3.510
   68   2HG2  ILE   9          2HG2      ILE   9 -10.040   8.745  -3.734
   69   3HG2  ILE   9          3HG2      ILE   9  -8.297   8.394  -3.648
   70   1HD1  ILE   9          1HD1      ILE   9 -10.877   6.285  -2.223
   71   2HD1  ILE   9          2HD1      ILE   9 -12.351   6.755  -1.343
   72   3HD1  ILE   9          3HD1      ILE   9 -11.933   7.561  -2.874
   73    H    PHE  10           H        PHE  10  -7.134   5.802  -2.745
   74    HA   PHE  10           HA       PHE  10  -4.909   7.553  -3.152
   75   1HB   PHE  10          1HB       PHE  10  -4.519   6.245  -0.936
   76   2HB   PHE  10          2HB       PHE  10  -4.536   4.774  -1.888
   77    HD1  PHE  10           1HD      PHE  10  -2.437   3.899  -2.195
   78    HD2  PHE  10           2HD      PHE  10  -2.891   8.118  -2.236
   79    HE1  PHE  10           1HE      PHE  10   0.020   4.159  -2.640
   80    HE2  PHE  10           2HE      PHE  10  -0.434   8.378  -2.681
   81    HZ   PHE  10           HZ       PHE  10   0.992   6.395  -2.877
   82    H    LYS  11           H        LYS  11  -4.226   7.293  -5.235
   83    HA   LYS  11           HA       LYS  11  -5.236   4.959  -6.648
   84   1HB   LYS  11          1HB       LYS  11  -4.017   7.546  -7.658
   85   2HB   LYS  11          2HB       LYS  11  -4.627   6.255  -8.673
   86   1HG   LYS  11          1HG       LYS  11  -6.359   7.579  -6.544
   87   2HG   LYS  11          2HG       LYS  11  -6.237   8.226  -8.168
   88   1HD   LYS  11          1HD       LYS  11  -7.337   6.395  -9.140
   89   2HD   LYS  11          2HD       LYS  11  -6.849   5.287  -7.872
   90   1HE   LYS  11          1HE       LYS  11  -8.439   6.307  -6.292
   91   2HE   LYS  11          2HE       LYS  11  -8.843   7.562  -7.445
   92   1HZ   LYS  11          1HZ       LYS  11 -10.490   5.984  -7.679
   93   2HZ   LYS  11          2HZ       LYS  11  -9.504   5.651  -8.937
   94   3HZ   LYS  11          3HZ       LYS  11  -9.468   4.712  -7.602
   95    H    VAL  12           H        VAL  12  -3.973   3.192  -6.798
   96    HA   VAL  12           HA       VAL  12  -1.098   3.654  -7.136
   97    HB   VAL  12           HB       VAL  12  -2.245   2.715  -4.814
   98   1HG1  VAL  12          1HG1      VAL  12  -1.612   0.326  -4.676
   99   2HG1  VAL  12          2HG1      VAL  12  -2.917   0.614  -5.852
  100   3HG1  VAL  12          3HG1      VAL  12  -1.253   0.335  -6.420
  101   1HG2  VAL  12          1HG2      VAL  12   0.011   2.209  -4.128
  102   2HG2  VAL  12          2HG2      VAL  12   0.538   2.040  -5.819
  103   3HG2  VAL  12          3HG2      VAL  12   0.050   3.634  -5.194
  104    H    THR  13           H        THR  13  -0.316   2.672  -8.933
  105    HA   THR  13           HA       THR  13  -2.010   1.291 -10.672
  106    HB   THR  13           HB       THR  13   0.277   0.768 -11.778
  107    HG1  THR  13           1HG      THR  13   1.800   0.896 -10.157
  108   1HG2  THR  13          1HG2      THR  13   0.694   3.048 -12.418
  109   2HG2  THR  13          2HG2      THR  13  -1.053   2.994 -12.083
  110   3HG2  THR  13          3HG2      THR  13   0.064   3.674 -10.876
  111    H    ASP  14           H        ASP  14  -2.057  -0.909 -11.369
  112    HA   ASP  14           HA       ASP  14  -2.324  -2.679  -9.329
  113   1HB   ASP  14          1HB       ASP  14  -2.174  -2.778 -12.281
  114   2HB   ASP  14          2HB       ASP  14  -1.638  -4.272 -11.537
  115    H    LYS  15           H        LYS  15   0.539  -1.651 -11.157
  116    HA   LYS  15           HA       LYS  15   2.179  -3.868 -10.632
  117   1HB   LYS  15          1HB       LYS  15   2.341  -1.557 -12.137
  118   2HB   LYS  15          2HB       LYS  15   3.526  -1.268 -10.880
  119   1HG   LYS  15          1HG       LYS  15   4.252  -3.785 -11.409
  120   2HG   LYS  15          2HG       LYS  15   3.447  -3.484 -12.936
  121   1HD   LYS  15          1HD       LYS  15   4.869  -1.332 -13.110
  122   2HD   LYS  15          2HD       LYS  15   5.794  -1.940 -11.751
  123   1HE   LYS  15          1HE       LYS  15   6.792  -3.622 -12.995
  124   2HE   LYS  15          2HE       LYS  15   5.373  -3.884 -13.988
  125   1HZ   LYS  15          1HZ       LYS  15   5.981  -2.254 -15.405
  126   2HZ   LYS  15          2HZ       LYS  15   6.754  -1.356 -14.281
  127   3HZ   LYS  15          3HZ       LYS  15   7.475  -2.683 -14.903
  128    H    ALA  16           H        ALA  16   1.417  -0.859  -8.827
  129    HA   ALA  16           HA       ALA  16   3.410  -1.219  -6.869
  130   1HB   ALA  16          1HB       ALA  16   2.249   0.923  -7.392
  131   2HB   ALA  16          2HB       ALA  16   0.747   0.250  -6.713
  132   3HB   ALA  16          3HB       ALA  16   2.162   0.506  -5.664
  133    H    VAL  17           H        VAL  17  -0.178  -1.833  -6.800
  134    HA   VAL  17           HA       VAL  17  -0.225  -3.040  -4.320
  135    HB   VAL  17           HB       VAL  17  -1.937  -2.804  -6.678
  136   1HG1  VAL  17          1HG1      VAL  17  -1.874  -5.257  -6.566
  137   2HG1  VAL  17          2HG1      VAL  17  -2.329  -5.195  -4.846
  138   3HG1  VAL  17          3HG1      VAL  17  -3.470  -4.629  -6.090
  139   1HG2  VAL  17          1HG2      VAL  17  -1.898  -1.855  -4.093
  140   2HG2  VAL  17          2HG2      VAL  17  -3.287  -1.775  -5.204
  141   3HG2  VAL  17          3HG2      VAL  17  -3.166  -3.102  -4.023
  142    H    GLU  18           H        GLU  18   0.292  -4.478  -7.600
  143    HA   GLU  18           HA       GLU  18   0.362  -7.094  -6.781
  144   1HB   GLU  18          1HB       GLU  18   1.571  -5.577  -9.098
  145   2HB   GLU  18          2HB       GLU  18   1.983  -7.266  -8.879
  146   1HG   GLU  18          1HG       GLU  18  -0.411  -7.896  -8.927
  147   2HG   GLU  18          2HG       GLU  18  -0.880  -6.211  -9.027
  148    H    GLU  19           H        GLU  19   2.927  -4.574  -6.820
  149    HA   GLU  19           HA       GLU  19   5.121  -6.077  -6.431
  150   1HB   GLU  19          1HB       GLU  19   5.029  -3.577  -6.650
  151   2HB   GLU  19          2HB       GLU  19   4.475  -3.466  -4.992
  152   1HG   GLU  19          1HG       GLU  19   6.919  -3.093  -5.121
  153   2HG   GLU  19          2HG       GLU  19   6.563  -4.531  -4.186
  154    H    ILE  20           H        ILE  20   2.493  -5.390  -4.129
  155    HA   ILE  20           HA       ILE  20   3.944  -6.375  -1.871
  156    HB   ILE  20           HB       ILE  20   1.049  -5.670  -2.337
  157   1HG1  ILE  20          1HG1      ILE  20   1.673  -3.766  -0.788
  158   2HG1  ILE  20          2HG1      ILE  20   3.349  -4.242  -0.980
  159   1HG2  ILE  20          1HG2      ILE  20   0.456  -6.350  -0.279
  160   2HG2  ILE  20          2HG2      ILE  20   1.849  -7.445  -0.442
  161   3HG2  ILE  20          3HG2      ILE  20   2.025  -5.908   0.439
  162   1HD1  ILE  20          1HD1      ILE  20   2.340  -2.413  -2.582
  163   2HD1  ILE  20          2HD1      ILE  20   3.401  -3.667  -3.265
  164   3HD1  ILE  20          3HD1      ILE  20   1.635  -3.805  -3.439
  165    H    LYS  21           H        LYS  21   1.495  -7.634  -4.193
  166    HA   LYS  21           HA       LYS  21   0.928 -10.014  -2.955
  167   1HB   LYS  21          1HB       LYS  21   1.157  -9.411  -5.919
  168   2HB   LYS  21          2HB       LYS  21   0.376 -10.824  -5.238
  169   1HG   LYS  21          1HG       LYS  21  -1.204  -9.345  -3.979
  170   2HG   LYS  21          2HG       LYS  21  -0.422  -7.931  -4.658
  171   1HD   LYS  21          1HD       LYS  21  -1.348  -8.247  -6.765
  172   2HD   LYS  21          2HD       LYS  21  -1.344  -9.994  -6.629
  173   1HE   LYS  21          1HE       LYS  21  -3.203  -9.669  -4.817
  174   2HE   LYS  21          2HE       LYS  21  -3.334  -8.031  -5.426
  175   1HZ   LYS  21          1HZ       LYS  21  -4.564 -10.174  -6.465
  176   2HZ   LYS  21          2HZ       LYS  21  -4.349  -8.753  -7.240
  177   3HZ   LYS  21          3HZ       LYS  21  -3.308  -9.986  -7.492
  178    H    LYS  22           H        LYS  22   3.782  -9.056  -4.903
  179    HA   LYS  22           HA       LYS  22   4.835 -11.713  -4.923
  180   1HB   LYS  22          1HB       LYS  22   5.355  -9.215  -6.225
  181   2HB   LYS  22          2HB       LYS  22   6.842  -9.762  -5.479
  182   1HG   LYS  22          1HG       LYS  22   6.398 -12.067  -6.524
  183   2HG   LYS  22          2HG       LYS  22   5.085 -11.328  -7.420
  184   1HD   LYS  22          1HD       LYS  22   7.237  -9.568  -7.848
  185   2HD   LYS  22          2HD       LYS  22   7.993 -11.149  -7.877
  186   1HE   LYS  22          1HE       LYS  22   5.763 -11.658  -9.402
  187   2HE   LYS  22          2HE       LYS  22   6.003  -9.961  -9.768
  188   1HZ   LYS  22          1HZ       LYS  22   8.392 -10.617 -10.162
  189   2HZ   LYS  22          2HZ       LYS  22   7.876 -12.167 -10.183
  190   3HZ   LYS  22          3HZ       LYS  22   7.304 -11.101 -11.279
  191    H    VAL  23           H        VAL  23   5.493  -8.644  -3.121
  192    HA   VAL  23           HA       VAL  23   7.617  -9.613  -1.622
  193    HB   VAL  23           HB       VAL  23   5.675  -7.384  -1.497
  194   1HG1  VAL  23          1HG1      VAL  23   7.318  -8.168   0.936
  195   2HG1  VAL  23          2HG1      VAL  23   6.395  -6.659   0.736
  196   3HG1  VAL  23          3HG1      VAL  23   5.543  -8.220   0.810
  197   1HG2  VAL  23          1HG2      VAL  23   8.063  -7.509  -2.557
  198   2HG2  VAL  23          2HG2      VAL  23   7.565  -6.046  -1.672
  199   3HG2  VAL  23          3HG2      VAL  23   8.619  -7.246  -0.886
  200    H    ALA  24           H        ALA  24   4.061  -9.851  -1.165
  201    HA   ALA  24           HA       ALA  24   4.313 -11.038   1.419
  202   1HB   ALA  24          1HB       ALA  24   2.288  -9.876  -0.176
  203   2HB   ALA  24          2HB       ALA  24   1.800 -11.571   0.067
  204   3HB   ALA  24          3HB       ALA  24   2.125 -10.528   1.472
  205    H    GLN  25           H        GLN  25   3.873 -12.170  -1.972
  206    HA   GLN  25           HA       GLN  25   3.270 -14.762  -1.500
  207   1HB   GLN  25          1HB       GLN  25   4.353 -13.185  -3.691
  208   2HB   GLN  25          2HB       GLN  25   5.114 -14.763  -3.674
  209   1HG   GLN  25          1HG       GLN  25   2.371 -15.281  -3.169
  210   2HG   GLN  25          2HG       GLN  25   2.369 -14.041  -4.407
  211   1HE2  GLN  25          1HE2      GLN  25   2.320 -17.246  -3.915
  212   2HE2  GLN  25          2HE2      GLN  25   3.039 -17.844  -5.372
  213    H    GLU  26           H        GLU  26   6.543 -13.218  -1.581
  214    HA   GLU  26           HA       GLU  26   7.892 -15.634  -1.144
  215   1HB   GLU  26          1HB       GLU  26   8.732 -13.299  -2.044
  216   2HB   GLU  26          2HB       GLU  26   9.007 -12.932  -0.352
  217   1HG   GLU  26          1HG       GLU  26  10.174 -15.388  -0.438
  218   2HG   GLU  26          2HG       GLU  26  10.393 -14.930  -2.116
  219    H    ASN  27           H        ASN  27   5.923 -13.699   0.883
  220    HA   ASN  27           HA       ASN  27   7.315 -14.683   3.242
  221   1HB   ASN  27          1HB       ASN  27   5.211 -12.474   2.943
  222   2HB   ASN  27          2HB       ASN  27   5.914 -12.963   4.472
  223   1HD2  ASN  27          1HD2      ASN  27   5.966 -10.450   2.816
  224   2HD2  ASN  27          2HD2      ASN  27   7.634 -10.004   2.690
  225    H    ASN  28           H        ASN  28   4.894 -15.503   1.108
  226    HA   ASN  28           HA       ASN  28   3.084 -16.700   1.149
  227   1HB   ASN  28          1HB       ASN  28   4.865 -18.020   2.775
  228   2HB   ASN  28          2HB       ASN  28   3.543 -17.806   3.906
  229   1HD2  ASN  28          1HD2      ASN  28   3.494 -20.149   3.820
  230   2HD2  ASN  28          2HD2      ASN  28   2.576 -20.954   2.591
  231    H    ILE  29           H        ILE  29   2.737 -14.034   2.105
  232    HA   ILE  29           HA       ILE  29   0.991 -14.314   4.433
  233    HB   ILE  29           HB       ILE  29   2.144 -11.856   3.109
  234   1HG1  ILE  29          1HG1      ILE  29   2.923 -13.132   5.745
  235   2HG1  ILE  29          2HG1      ILE  29   3.792 -13.389   4.244
  236   1HG2  ILE  29          1HG2      ILE  29   0.105 -12.249   5.208
  237   2HG2  ILE  29          2HG2      ILE  29   1.386 -11.075   5.595
  238   3HG2  ILE  29          3HG2      ILE  29   0.401 -10.867   4.127
  239   1HD1  ILE  29          1HD1      ILE  29   4.118 -10.897   4.041
  240   2HD1  ILE  29          2HD1      ILE  29   3.339 -10.707   5.630
  241   3HD1  ILE  29          3HD1      ILE  29   4.879 -11.589   5.493
  242    H    GLU  30           H        GLU  30  -1.202 -13.665   4.372
  243    HA   GLU  30           HA       GLU  30  -2.196 -13.397   1.642
  244   1HB   GLU  30          1HB       GLU  30  -2.868 -15.266   3.703
  245   2HB   GLU  30          2HB       GLU  30  -4.259 -14.218   3.504
  246   1HG   GLU  30          1HG       GLU  30  -4.470 -14.746   1.171
  247   2HG   GLU  30          2HG       GLU  30  -2.857 -15.426   1.091
  248    H    ASN  31           H        ASN  31  -1.416 -11.551   4.211
  249    HA   ASN  31           HA       ASN  31  -3.472  -9.658   3.556
  250   1HB   ASN  31          1HB       ASN  31  -3.536  -9.219   6.222
  251   2HB   ASN  31          2HB       ASN  31  -4.642 -10.342   5.455
  252   1HD2  ASN  31          1HD2      ASN  31  -2.490  -9.925   7.909
  253   2HD2  ASN  31          2HD2      ASN  31  -2.096 -11.567   8.295
  254    HA   PRO  32           HA       PRO  32   0.789  -8.105   4.356
  255   1HB   PRO  32          1HB       PRO  32   1.347  -7.128   1.865
  256   2HB   PRO  32          2HB       PRO  32   1.839  -8.722   2.402
  257   1HG   PRO  32          1HG       PRO  32  -0.344  -7.982   0.551
  258   2HG   PRO  32          2HG       PRO  32   0.431  -9.539   0.768
  259   1HD   PRO  32          1HD       PRO  32  -2.146  -8.752   1.752
  260   2HD   PRO  32          2HD       PRO  32  -1.322 -10.266   2.066
  261    H    ILE  33           H        ILE  33   0.779  -6.345   5.589
  262    HA   ILE  33           HA       ILE  33  -0.887  -4.165   4.556
  263    HB   ILE  33           HB       ILE  33  -0.037  -4.939   7.340
  264   1HG1  ILE  33          1HG1      ILE  33  -2.863  -4.391   6.731
  265   2HG1  ILE  33          2HG1      ILE  33  -2.198  -5.737   5.828
  266   1HG2  ILE  33          1HG2      ILE  33  -0.688  -2.296   6.285
  267   2HG2  ILE  33          2HG2      ILE  33  -1.769  -2.800   7.606
  268   3HG2  ILE  33          3HG2      ILE  33  -0.007  -2.771   7.859
  269   1HD1  ILE  33          1HD1      ILE  33  -1.162  -6.360   8.244
  270   2HD1  ILE  33          2HD1      ILE  33  -2.582  -5.435   8.789
  271   3HD1  ILE  33          3HD1      ILE  33  -2.797  -6.869   7.756
  272    H    LEU  34           H        LEU  34   0.515  -3.107   3.153
  273    HA   LEU  34           HA       LEU  34   3.126  -2.378   4.243
  274   1HB   LEU  34          1HB       LEU  34   2.091  -3.049   1.628
  275   2HB   LEU  34          2HB       LEU  34   2.885  -1.487   1.595
  276    HG   LEU  34           HG       LEU  34   4.893  -2.578   2.674
  277   1HD1  LEU  34          1HD1      LEU  34   3.413  -5.133   1.990
  278   2HD1  LEU  34          2HD1      LEU  34   5.100  -5.011   2.545
  279   3HD1  LEU  34          3HD1      LEU  34   3.771  -4.530   3.626
  280   1HD2  LEU  34          1HD2      LEU  34   4.010  -2.578  -0.029
  281   2HD2  LEU  34          2HD2      LEU  34   5.675  -2.541   0.601
  282   3HD2  LEU  34          3HD2      LEU  34   4.887  -4.100   0.259
  283    H    ARG  35           H        ARG  35   3.774  -0.217   4.496
  284    HA   ARG  35           HA       ARG  35   1.522   1.619   4.434
  285   1HB   ARG  35          1HB       ARG  35   2.385   1.449   6.675
  286   2HB   ARG  35          2HB       ARG  35   4.049   1.493   6.129
  287   1HG   ARG  35          1HG       ARG  35   3.783   3.855   5.412
  288   2HG   ARG  35          2HG       ARG  35   2.090   3.822   5.863
  289   1HD   ARG  35          1HD       ARG  35   2.966   4.744   7.809
  290   2HD   ARG  35          2HD       ARG  35   3.077   3.049   8.238
  291    HE   ARG  35           HE       ARG  35   5.480   3.555   6.929
  292   1HH1  ARG  35          2HH2      ARG  35   3.817   4.976   9.685
  293   2HH1  ARG  35          1HH2      ARG  35   5.278   5.465  10.477
  294   1HH2  ARG  35          2HH1      ARG  35   7.407   4.199   7.973
  295   2HH2  ARG  35          1HH1      ARG  35   7.334   5.019   9.497
  296    H    ILE  36           H        ILE  36   1.840   3.781   3.554
  297    HA   ILE  36           HA       ILE  36   4.231   3.969   1.856
  298    HB   ILE  36           HB       ILE  36   1.439   4.092   1.228
  299   1HG1  ILE  36          1HG1      ILE  36   2.744   4.509  -1.116
  300   2HG1  ILE  36          2HG1      ILE  36   4.059   3.876  -0.146
  301   1HG2  ILE  36          1HG2      ILE  36   2.996   6.640   0.764
  302   2HG2  ILE  36          2HG2      ILE  36   1.574   6.177  -0.200
  303   3HG2  ILE  36          3HG2      ILE  36   1.414   6.435   1.554
  304   1HD1  ILE  36          1HD1      ILE  36   1.413   2.450   0.018
  305   2HD1  ILE  36          2HD1      ILE  36   2.381   2.249  -1.462
  306   3HD1  ILE  36          3HD1      ILE  36   3.064   1.791   0.117
  307    H    ARG  37           H        ARG  37   5.664   5.364   2.730
  308    HA   ARG  37           HA       ARG  37   4.508   7.743   3.949
  309   1HB   ARG  37          1HB       ARG  37   5.959   5.850   5.306
  310   2HB   ARG  37          2HB       ARG  37   7.266   6.886   4.769
  311   1HG   ARG  37          1HG       ARG  37   5.131   8.578   5.737
  312   2HG   ARG  37          2HG       ARG  37   5.414   7.329   6.934
  313   1HD   ARG  37          1HD       ARG  37   7.857   8.625   5.758
  314   2HD   ARG  37          2HD       ARG  37   6.879   9.622   6.816
  315    HE   ARG  37           HE       ARG  37   8.471   7.285   7.593
  316   1HH1  ARG  37          2HH2      ARG  37   5.786   9.376   8.489
  317   2HH1  ARG  37          1HH2      ARG  37   5.888   8.999  10.177
  318   1HH2  ARG  37          2HH1      ARG  37   8.606   6.787   9.819
  319   2HH2  ARG  37          1HH1      ARG  37   7.503   7.516  10.938
  320    H    VAL  38           H        VAL  38   6.354   9.577   4.060
  321    HA   VAL  38           HA       VAL  38   7.220   9.919   1.341
  322    HB   VAL  38           HB       VAL  38   7.773  11.742   3.671
  323   1HG1  VAL  38          1HG1      VAL  38   7.202  12.305   0.741
  324   2HG1  VAL  38          2HG1      VAL  38   7.648  13.496   1.986
  325   3HG1  VAL  38          3HG1      VAL  38   8.818  12.253   1.484
  326   1HG2  VAL  38          1HG2      VAL  38   5.170  10.916   2.646
  327   2HG2  VAL  38          2HG2      VAL  38   5.578  11.894   4.076
  328   3HG2  VAL  38          3HG2      VAL  38   5.429  12.670   2.481
  329    H    VAL  39           H        VAL  39   9.206   9.456   0.536
  330    HA   VAL  39           HA       VAL  39  11.368   9.113   2.494
  331    HB   VAL  39           HB       VAL  39  10.505   7.337   0.224
  332   1HG1  VAL  39          1HG1      VAL  39  13.264   7.691   1.377
  333   2HG1  VAL  39          2HG1      VAL  39  12.727   6.093   0.805
  334   3HG1  VAL  39          3HG1      VAL  39  12.762   7.476  -0.317
  335   1HG2  VAL  39          1HG2      VAL  39   9.734   6.097   1.909
  336   2HG2  VAL  39          2HG2      VAL  39  11.407   5.886   2.477
  337   3HG2  VAL  39          3HG2      VAL  39  10.416   7.225   3.105
  338    HA   PRO  40           HA       PRO  40  13.176  12.026  -0.194
  339   1HB   PRO  40          1HB       PRO  40  15.520  12.374   1.168
  340   2HB   PRO  40          2HB       PRO  40  14.043  13.230   1.567
  341   1HG   PRO  40          1HG       PRO  40  15.313  10.967   2.982
  342   2HG   PRO  40          2HG       PRO  40  14.107  12.093   3.572
  343   1HD   PRO  40          1HD       PRO  40  13.664   9.385   2.738
  344   2HD   PRO  40          2HD       PRO  40  12.443  10.547   3.218
  345    H    GLY  41           H        GLY  41  13.462  11.089  -2.158
  346   1HA   GLY  41          1HA       GLY  41  15.942  10.544  -3.079
  347   2HA   GLY  41          2HA       GLY  41  15.451   9.008  -2.394
  348    H    GLY  42           H        GLY  42  15.853   8.761  -4.982
  349   1HA   GLY  42          1HA       GLY  42  14.339   7.625  -6.478
  350   2HA   GLY  42          2HA       GLY  42  13.156   8.886  -6.190
  351    H    CYS  43           H        CYS  43  13.244   8.926  -8.667
  352    HA   CYS  43           HA       CYS  43  15.548   9.856  -9.952
  353   1HB   CYS  43          1HB       CYS  43  12.727   9.368 -10.661
  354   2HB   CYS  43          2HB       CYS  43  13.474  10.660 -11.578
  355    HG   CYS  43           HG       CYS  43  13.621   8.359 -12.880
  356    H    SER  44           H        SER  44  12.520  11.475  -8.759
  357    HA   SER  44           HA       SER  44  13.710  14.033  -9.322
  358   1HB   SER  44          1HB       SER  44  11.064  13.021  -9.219
  359   2HB   SER  44          2HB       SER  44  11.176  14.126  -7.864
  360    HG   SER  44           HG       SER  44  10.884  15.669  -9.315
  361    H    GLY  45           H        GLY  45  12.522  12.068  -6.523
  362   1HA   GLY  45          1HA       GLY  45  13.880  12.076  -4.529
  363   2HA   GLY  45          2HA       GLY  45  14.145  13.794  -4.753
  364    H    PHE  46           H        PHE  46  11.228  11.609  -4.771
  365    HA   PHE  46           HA       PHE  46  10.190  12.658  -2.395
  366   1HB   PHE  46          1HB       PHE  46   9.904  14.290  -4.745
  367   2HB   PHE  46          2HB       PHE  46   8.341  13.526  -4.529
  368    HD1  PHE  46           1HD      PHE  46  10.194  16.338  -3.743
  369    HD2  PHE  46           2HD      PHE  46   7.523  13.570  -1.951
  370    HE1  PHE  46           1HE      PHE  46   9.605  18.039  -1.994
  371    HE2  PHE  46           2HE      PHE  46   6.934  15.271  -0.202
  372    HZ   PHE  46           HZ       PHE  46   7.981  17.485  -0.245
  373    H    GLN  47           H        GLN  47  10.620  10.078  -3.551
  374    HA   GLN  47           HA       GLN  47   7.964   9.256  -4.357
  375   1HB   GLN  47          1HB       GLN  47   9.014   7.149  -5.024
  376   2HB   GLN  47          2HB       GLN  47   9.921   8.489  -5.695
  377   1HG   GLN  47          1HG       GLN  47  11.667   7.219  -4.819
  378   2HG   GLN  47          2HG       GLN  47  11.348   8.275  -3.457
  379   1HE2  GLN  47          1HE2      GLN  47  12.606   6.004  -2.943
  380   2HE2  GLN  47          2HE2      GLN  47  11.599   4.847  -2.138
  381    H    TYR  48           H        TYR  48   7.014   7.253  -3.330
  382    HA   TYR  48           HA       TYR  48   7.739   7.173  -0.479
  383   1HB   TYR  48          1HB       TYR  48   5.110   6.579  -1.975
  384   2HB   TYR  48          2HB       TYR  48   5.288   6.603  -0.232
  385    HD1  TYR  48           1HD      TYR  48   4.725   8.541   0.933
  386    HD2  TYR  48           2HD      TYR  48   5.763   8.839  -3.207
  387    HE1  TYR  48           1HE      TYR  48   4.124  11.011   0.952
  388    HE2  TYR  48           2HE      TYR  48   5.159  11.308  -3.174
  389    HH   TYR  48           HH       TYR  48   4.007  12.841  -0.178
  390    H    ALA  49           H        ALA  49   8.743   5.318   0.102
  391    HA   ALA  49           HA       ALA  49   8.407   2.983  -1.587
  392   1HB   ALA  49          1HB       ALA  49  10.230   2.088  -0.095
  393   2HB   ALA  49          2HB       ALA  49  10.664   3.588  -0.949
  394   3HB   ALA  49          3HB       ALA  49  10.213   3.643   0.772
  395    H    MET  50           H        MET  50   7.960   0.834  -0.569
  396    HA   MET  50           HA       MET  50   6.242   1.167   1.766
  397   1HB   MET  50          1HB       MET  50   4.830  -0.700   0.704
  398   2HB   MET  50          2HB       MET  50   4.788   0.822  -0.164
  399   1HG   MET  50          1HG       MET  50   7.039  -0.769  -1.113
  400   2HG   MET  50          2HG       MET  50   5.578  -1.734  -1.172
  401   1HE   MET  50          1HE       MET  50   3.172  -0.598  -2.568
  402   2HE   MET  50          2HE       MET  50   3.900  -0.723  -4.188
  403   3HE   MET  50          3HE       MET  50   4.323  -1.908  -2.929
  404    H    GLY  51           H        GLY  51   5.888  -0.950   2.992
  405   1HA   GLY  51          1HA       GLY  51   7.558  -3.180   2.565
  406   2HA   GLY  51          2HA       GLY  51   8.336  -2.093   3.698
  407    H    PHE  52           H        PHE  52   6.761  -4.850   3.800
  408    HA   PHE  52           HA       PHE  52   4.529  -4.349   5.444
  409   1HB   PHE  52          1HB       PHE  52   4.879  -6.865   5.887
  410   2HB   PHE  52          2HB       PHE  52   4.795  -6.443   4.189
  411    HD1  PHE  52           1HD      PHE  52   6.698  -6.699   2.752
  412    HD2  PHE  52           2HD      PHE  52   7.052  -7.436   6.916
  413    HE1  PHE  52           1HE      PHE  52   8.922  -7.798   2.368
  414    HE2  PHE  52           2HE      PHE  52   9.276  -8.536   6.532
  415    HZ   PHE  52           HZ       PHE  52  10.184  -8.704   4.263
  416    H    ASP  53           H        ASP  53   4.408  -3.861   7.586
  417    HA   ASP  53           HA       ASP  53   6.888  -4.124   9.078
  418   1HB   ASP  53          1HB       ASP  53   5.517  -1.885   8.798
  419   2HB   ASP  53          2HB       ASP  53   4.433  -2.583   9.984
  420    H    ASP  54           H        ASP  54   6.251  -4.384  11.645
  421    HA   ASP  54           HA       ASP  54   5.500  -6.854  12.118
  422   1HB   ASP  54          1HB       ASP  54   4.603  -5.993  14.383
  423   2HB   ASP  54          2HB       ASP  54   6.249  -5.561  13.966
  424    H    THR  55           H        THR  55   3.258  -3.980  12.095
  425    HA   THR  55           HA       THR  55   1.158  -5.348  10.853
  426    HB   THR  55           HB       THR  55   1.292  -6.452  13.235
  427    HG1  THR  55           1HG      THR  55  -0.586  -6.740  11.977
  428   1HG2  THR  55          1HG2      THR  55   0.859  -5.142  15.056
  429   2HG2  THR  55          2HG2      THR  55   0.978  -3.711  14.003
  430   3HG2  THR  55          3HG2      THR  55  -0.600  -4.491  14.270
  431    H    VAL  56           H        VAL  56  -1.054  -4.001  11.506
  432    HA   VAL  56           HA       VAL  56  -0.361  -1.356  10.670
  433    HB   VAL  56           HB       VAL  56  -2.372  -2.920  10.053
  434   1HG1  VAL  56          1HG1      VAL  56  -3.496  -1.404  12.434
  435   2HG1  VAL  56          2HG1      VAL  56  -4.428  -2.392  11.284
  436   3HG1  VAL  56          3HG1      VAL  56  -3.224  -3.161  12.347
  437   1HG2  VAL  56          1HG2      VAL  56  -3.585  -0.324  10.239
  438   2HG2  VAL  56          2HG2      VAL  56  -1.854  -0.133   9.872
  439   3HG2  VAL  56          3HG2      VAL  56  -2.881  -1.135   8.820
  440    H    GLU  57           H        GLU  57  -1.062   0.627  11.795
  441    HA   GLU  57           HA       GLU  57  -0.447   0.383  14.568
  442   1HB   GLU  57          1HB       GLU  57  -1.288   2.933  13.151
  443   2HB   GLU  57          2HB       GLU  57  -0.252   2.767  14.555
  444   1HG   GLU  57          1HG       GLU  57   1.430   1.540  13.102
  445   2HG   GLU  57          2HG       GLU  57   0.413   1.866  11.713
  446    H    GLU  58           H        GLU  58  -1.849   1.878  16.137
  447    HA   GLU  58           HA       GLU  58  -4.488   0.792  15.951
  448   1HB   GLU  58          1HB       GLU  58  -2.821   1.223  18.057
  449   2HB   GLU  58          2HB       GLU  58  -3.762   2.699  18.143
  450   1HG   GLU  58          1HG       GLU  58  -5.326   1.487  19.264
  451   2HG   GLU  58          2HG       GLU  58  -5.728   0.762  17.720
  452    H    GLY  59           H        GLY  59  -3.510   2.944  14.034
  453   1HA   GLY  59          1HA       GLY  59  -5.864   4.428  13.833
  454   2HA   GLY  59          2HA       GLY  59  -4.701   5.415  14.695
  455    H    ASP  60           H        ASP  60  -4.537   3.066  11.914
  456    HA   ASP  60           HA       ASP  60  -3.104   5.167  10.487
  457   1HB   ASP  60          1HB       ASP  60  -2.110   2.698  11.183
  458   2HB   ASP  60          2HB       ASP  60  -2.798   2.321   9.616
  459    H    HIS  61           H        HIS  61  -3.913   5.655   8.393
  460    HA   HIS  61           HA       HIS  61  -6.498   4.807   7.771
  461   1HB   HIS  61          1HB       HIS  61  -4.460   6.594   6.662
  462   2HB   HIS  61          2HB       HIS  61  -5.429   5.827   5.419
  463    HD1  HIS  61           1HD      HIS  61  -8.212   5.956   6.096
  464    HD2  HIS  61           2HD      HIS  61  -5.599   8.906   7.534
  465    HE1  HIS  61           1HE      HIS  61  -9.665   7.963   6.705
  466    H    VAL  62           H        VAL  62  -6.484   2.485   7.789
  467    HA   VAL  62           HA       VAL  62  -4.813   1.183   5.809
  468    HB   VAL  62           HB       VAL  62  -5.297   0.412   8.222
  469   1HG1  VAL  62          1HG1      VAL  62  -7.607  -1.119   7.147
  470   2HG1  VAL  62          2HG1      VAL  62  -7.297  -0.502   8.788
  471   3HG1  VAL  62          3HG1      VAL  62  -7.901   0.596   7.524
  472   1HG2  VAL  62          1HG2      VAL  62  -4.599  -0.927   5.862
  473   2HG2  VAL  62          2HG2      VAL  62  -4.353  -1.492   7.532
  474   3HG2  VAL  62          3HG2      VAL  62  -5.816  -1.969   6.638
  475    H    PHE  63           H        PHE  63  -5.529   0.362   3.865
  476    HA   PHE  63           HA       PHE  63  -8.382   0.787   3.315
  477   1HB   PHE  63          1HB       PHE  63  -5.952   1.785   2.110
  478   2HB   PHE  63          2HB       PHE  63  -6.603   0.615   0.979
  479    HD1  PHE  63           1HD      PHE  63  -7.243   2.101  -0.747
  480    HD2  PHE  63           2HD      PHE  63  -8.637   2.755   3.208
  481    HE1  PHE  63           1HE      PHE  63  -8.857   3.824  -1.600
  482    HE2  PHE  63           2HE      PHE  63 -10.251   4.477   2.354
  483    HZ   PHE  63           HZ       PHE  63 -10.341   4.991  -0.039
  484    H    GLU  64           H        GLU  64  -9.413  -0.745   1.849
  485    HA   GLU  64           HA       GLU  64  -8.131  -3.335   2.062
  486   1HB   GLU  64          1HB       GLU  64 -11.010  -2.656   1.317
  487   2HB   GLU  64          2HB       GLU  64 -10.381  -4.259   1.638
  488   1HG   GLU  64          1HG       GLU  64  -9.906  -3.684   3.970
  489   2HG   GLU  64          2HG       GLU  64 -10.283  -1.997   3.684
  490    H    TYR  65           H        TYR  65  -7.093  -4.172   0.308
  491    HA   TYR  65           HA       TYR  65  -7.835  -3.082  -2.317
  492   1HB   TYR  65          1HB       TYR  65  -5.369  -3.897  -0.827
  493   2HB   TYR  65          2HB       TYR  65  -5.418  -4.557  -2.449
  494    HD1  TYR  65           1HD      TYR  65  -6.257  -2.667  -4.270
  495    HD2  TYR  65           2HD      TYR  65  -4.205  -1.914  -0.592
  496    HE1  TYR  65           1HE      TYR  65  -5.406  -0.454  -5.190
  497    HE2  TYR  65           2HE      TYR  65  -3.361   0.297  -1.524
  498    HH   TYR  65           HH       TYR  65  -2.980   1.369  -3.540
  499    H    ASP  66           H        ASP  66  -6.567  -5.069  -3.895
  500    HA   ASP  66           HA       ASP  66  -8.629  -6.927  -4.011
  501   1HB   ASP  66          1HB       ASP  66  -7.258  -6.257  -5.965
  502   2HB   ASP  66          2HB       ASP  66  -5.829  -6.959  -5.233
  503    H    GLY  67           H        GLY  67  -8.390  -7.594  -1.593
  504   1HA   GLY  67          1HA       GLY  67  -8.018  -9.374  -0.231
  505   2HA   GLY  67          2HA       GLY  67  -6.995 -10.106  -1.451
  506    H    VAL  68           H        VAL  68  -5.815  -7.016  -1.293
  507    HA   VAL  68           HA       VAL  68  -3.847  -7.800   0.737
  508    HB   VAL  68           HB       VAL  68  -3.685  -6.023  -1.700
  509   1HG1  VAL  68          1HG1      VAL  68  -1.631  -6.457   0.493
  510   2HG1  VAL  68          2HG1      VAL  68  -1.285  -5.707  -1.083
  511   3HG1  VAL  68          3HG1      VAL  68  -2.421  -4.927   0.043
  512   1HG2  VAL  68          1HG2      VAL  68  -1.622  -7.994  -1.547
  513   2HG2  VAL  68          2HG2      VAL  68  -3.182  -8.798  -1.247
  514   3HG2  VAL  68          3HG2      VAL  68  -2.941  -7.851  -2.734
  515    H    LYS  69           H        LYS  69  -2.876  -5.899   1.974
  516    HA   LYS  69           HA       LYS  69  -4.945  -3.868   2.435
  517   1HB   LYS  69          1HB       LYS  69  -4.045  -5.908   4.230
  518   2HB   LYS  69          2HB       LYS  69  -3.494  -4.363   4.845
  519   1HG   LYS  69          1HG       LYS  69  -5.906  -3.502   4.396
  520   2HG   LYS  69          2HG       LYS  69  -6.350  -5.184   4.179
  521   1HD   LYS  69          1HD       LYS  69  -5.257  -5.618   6.491
  522   2HD   LYS  69          2HD       LYS  69  -5.217  -3.877   6.687
  523   1HE   LYS  69          1HE       LYS  69  -7.280  -4.370   7.672
  524   2HE   LYS  69          2HE       LYS  69  -7.787  -4.010   6.033
  525   1HZ   LYS  69          1HZ       LYS  69  -7.184  -6.621   5.921
  526   2HZ   LYS  69          2HZ       LYS  69  -7.825  -6.492   7.418
  527   3HZ   LYS  69          3HZ       LYS  69  -8.688  -6.015   6.116
  528    H    VAL  70           H        VAL  70  -4.170  -1.767   3.042
  529    HA   VAL  70           HA       VAL  70  -1.295  -1.389   2.978
  530    HB   VAL  70           HB       VAL  70  -3.218  -0.338   0.913
  531   1HG1  VAL  70          1HG1      VAL  70  -0.474   0.785   1.576
  532   2HG1  VAL  70          2HG1      VAL  70  -1.472   1.231   0.171
  533   3HG1  VAL  70          3HG1      VAL  70  -2.034   1.607   1.818
  534   1HG2  VAL  70          1HG2      VAL  70  -1.328  -1.047  -0.612
  535   2HG2  VAL  70          2HG2      VAL  70  -0.559  -1.791   0.811
  536   3HG2  VAL  70          3HG2      VAL  70  -2.148  -2.369   0.254
  537    H    VAL  71           H        VAL  71  -0.708   0.857   3.667
  538    HA   VAL  71           HA       VAL  71  -2.883   2.303   4.942
  539    HB   VAL  71           HB       VAL  71  -2.055   2.194   7.094
  540   1HG1  VAL  71          1HG1      VAL  71  -3.087   0.097   6.645
  541   2HG1  VAL  71          2HG1      VAL  71  -1.643  -0.517   5.804
  542   3HG1  VAL  71          3HG1      VAL  71  -1.606  -0.260   7.565
  543   1HG2  VAL  71          1HG2      VAL  71   0.537   0.977   6.082
  544   2HG2  VAL  71          2HG2      VAL  71   0.307   2.696   6.485
  545   3HG2  VAL  71          3HG2      VAL  71   0.157   1.456   7.754
  546    H    ILE  72           H        ILE  72  -2.151   4.502   5.662
  547    HA   ILE  72           HA       ILE  72   0.382   5.348   4.542
  548    HB   ILE  72           HB       ILE  72  -2.264   6.431   3.569
  549   1HG1  ILE  72          1HG1      ILE  72  -0.114   4.745   2.293
  550   2HG1  ILE  72          2HG1      ILE  72  -1.839   4.446   2.378
  551   1HG2  ILE  72          1HG2      ILE  72   0.561   7.399   3.058
  552   2HG2  ILE  72          2HG2      ILE  72  -0.881   7.934   2.163
  553   3HG2  ILE  72          3HG2      ILE  72  -0.740   8.270   3.905
  554   1HD1  ILE  72          1HD1      ILE  72  -0.357   6.450   0.650
  555   2HD1  ILE  72          2HD1      ILE  72  -1.526   5.202   0.158
  556   3HD1  ILE  72          3HD1      ILE  72  -2.088   6.663   1.005
  557    H    ASP  73           H        ASP  73   1.322   6.833   5.863
  558    HA   ASP  73           HA       ASP  73   0.436   7.345   8.316
  559   1HB   ASP  73          1HB       ASP  73   2.343   8.607   6.448
  560   2HB   ASP  73          2HB       ASP  73   1.725   9.748   7.625
  561    HA   PRO  74           HA       PRO  74  -2.730  10.352   7.915
  562   1HB   PRO  74          1HB       PRO  74  -2.614  11.643  10.321
  563   2HB   PRO  74          2HB       PRO  74  -3.391  10.087  10.104
  564   1HG   PRO  74          1HG       PRO  74  -0.786  10.699  11.361
  565   2HG   PRO  74          2HG       PRO  74  -1.762   9.251  11.507
  566   1HD   PRO  74          1HD       PRO  74   0.609   9.569   9.926
  567   2HD   PRO  74          2HD       PRO  74  -0.431   8.160   9.983
  568    H    PHE  75           H        PHE  75   0.480  11.389   8.515
  569    HA   PHE  75           HA       PHE  75  -0.211  14.125   7.862
  570   1HB   PHE  75          1HB       PHE  75   1.691  12.816   9.453
  571   2HB   PHE  75          2HB       PHE  75   2.633  13.173   8.019
  572    HD1  PHE  75           1HD      PHE  75   0.368  14.827  10.475
  573    HD2  PHE  75           2HD      PHE  75   3.644  15.251   7.810
  574    HE1  PHE  75           1HE      PHE  75   0.736  17.169  11.299
  575    HE2  PHE  75           2HE      PHE  75   4.011  17.593   8.634
  576    HZ   PHE  75           HZ       PHE  75   2.553  18.524  10.369
  577    H    SER  76           H        SER  76   1.169  11.203   6.388
  578    HA   SER  76           HA       SER  76   2.120  12.725   4.141
  579   1HB   SER  76          1HB       SER  76   3.517  10.882   4.896
  580   2HB   SER  76          2HB       SER  76   2.176   9.756   4.822
  581    HG   SER  76           HG       SER  76   2.733  11.114   2.407
  582    H    MET  77           H        MET  77  -0.734  11.057   5.222
  583    HA   MET  77           HA       MET  77  -1.705  10.046   2.863
  584   1HB   MET  77          1HB       MET  77  -2.695  10.790   5.541
  585   2HB   MET  77          2HB       MET  77  -3.924  11.080   4.325
  586   1HG   MET  77          1HG       MET  77  -2.470   8.447   4.858
  587   2HG   MET  77          2HG       MET  77  -4.165   8.786   5.145
  588   1HE   MET  77          1HE       MET  77  -4.349  10.773   2.376
  589   2HE   MET  77          2HE       MET  77  -5.255   9.615   1.374
  590   3HE   MET  77          3HE       MET  77  -5.679   9.829   3.089
  591    HA   PRO  78           HA       PRO  78  -3.604  14.342   2.153
  592   1HB   PRO  78          1HB       PRO  78  -2.720  16.470   3.623
  593   2HB   PRO  78          2HB       PRO  78  -4.166  15.563   4.022
  594   1HG   PRO  78          1HG       PRO  78  -1.514  15.495   5.328
  595   2HG   PRO  78          2HG       PRO  78  -3.058  14.942   5.947
  596   1HD   PRO  78          1HD       PRO  78  -0.938  13.308   4.915
  597   2HD   PRO  78          2HD       PRO  78  -2.524  12.767   5.426
  598    H    TYR  79           H        TYR  79  -0.519  13.384   2.204
  599    HA   TYR  79           HA       TYR  79   0.386  15.647   0.578
  600   1HB   TYR  79          1HB       TYR  79   1.464  13.905   2.611
  601   2HB   TYR  79          2HB       TYR  79   2.261  13.428   1.125
  602    HD1  TYR  79           1HD      TYR  79   3.706  15.028  -0.098
  603    HD2  TYR  79           2HD      TYR  79   1.917  16.047   3.652
  604    HE1  TYR  79           1HE      TYR  79   5.319  16.978   0.150
  605    HE2  TYR  79           2HE      TYR  79   3.535  17.994   3.887
  606    HH   TYR  79           HH       TYR  79   6.292  18.273   2.078
  607    H    VAL  80           H        VAL  80  -1.221  12.752   0.163
  608    HA   VAL  80           HA       VAL  80  -0.336  12.604  -2.579
  609    HB   VAL  80           HB       VAL  80   0.291  10.324  -2.554
  610   1HG1  VAL  80          1HG1      VAL  80   2.055  11.907  -1.897
  611   2HG1  VAL  80          2HG1      VAL  80   1.621  11.685  -0.186
  612   3HG1  VAL  80          3HG1      VAL  80   2.281  10.322  -1.120
  613   1HG2  VAL  80          1HG2      VAL  80  -1.375   9.542  -0.897
  614   2HG2  VAL  80          2HG2      VAL  80   0.253   8.895  -0.582
  615   3HG2  VAL  80          3HG2      VAL  80  -0.379  10.233   0.407
  616    H    ASN  81           H        ASN  81  -2.732  13.333  -0.830
  617    HA   ASN  81           HA       ASN  81  -4.654  11.503  -0.727
  618   1HB   ASN  81          1HB       ASN  81  -5.083  13.793  -0.021
  619   2HB   ASN  81          2HB       ASN  81  -4.803  14.416  -1.634
  620   1HD2  ASN  81          1HD2      ASN  81  -6.374  14.364  -3.156
  621   2HD2  ASN  81          2HD2      ASN  81  -8.010  13.872  -2.870
  622    H    GLY  82           H        GLY  82  -5.710  10.189  -2.234
  623   1HA   GLY  82          1HA       GLY  82  -6.132   9.234  -4.239
  624   2HA   GLY  82          2HA       GLY  82  -6.744  10.825  -4.645
  625    H    ALA  83           H        ALA  83  -3.306  10.293  -3.856
  626    HA   ALA  83           HA       ALA  83  -2.548  11.376  -6.387
  627   1HB   ALA  83          1HB       ALA  83  -1.398  11.794  -4.179
  628   2HB   ALA  83          2HB       ALA  83  -0.825  10.109  -4.223
  629   3HB   ALA  83          3HB       ALA  83  -0.310  11.258  -5.482
  630    H    GLU  84           H        GLU  84  -0.897  10.241  -7.807
  631    HA   GLU  84           HA       GLU  84  -1.673   7.437  -7.991
  632   1HB   GLU  84          1HB       GLU  84  -1.582   9.575  -9.942
  633   2HB   GLU  84          2HB       GLU  84  -0.457   8.322 -10.429
  634   1HG   GLU  84          1HG       GLU  84  -2.164   6.638 -10.473
  635   2HG   GLU  84          2HG       GLU  84  -3.275   7.616  -9.534
  636    H    LEU  85           H        LEU  85  -0.101   6.207  -7.021
  637    HA   LEU  85           HA       LEU  85   2.679   7.009  -7.488
  638   1HB   LEU  85          1HB       LEU  85   2.664   6.861  -5.264
  639   2HB   LEU  85          2HB       LEU  85   1.205   5.891  -5.222
  640    HG   LEU  85           HG       LEU  85   2.559   3.880  -5.802
  641   1HD1  LEU  85          1HD1      LEU  85   5.128   4.361  -5.198
  642   2HD1  LEU  85          2HD1      LEU  85   4.490   4.407  -6.859
  643   3HD1  LEU  85          3HD1      LEU  85   4.712   5.920  -5.949
  644   1HD2  LEU  85          1HD2      LEU  85   3.994   4.231  -3.483
  645   2HD2  LEU  85          2HD2      LEU  85   2.675   5.414  -3.307
  646   3HD2  LEU  85          3HD2      LEU  85   2.300   3.697  -3.590
  647    H    ASP  86           H        ASP  86   3.512   6.048  -9.268
  648    HA   ASP  86           HA       ASP  86   2.540   3.406  -9.916
  649   1HB   ASP  86          1HB       ASP  86   4.614   4.490 -11.687
  650   2HB   ASP  86          2HB       ASP  86   2.985   3.975 -12.078
  651    H    TYR  87           H        TYR  87   3.684   1.889  -8.645
  652    HA   TYR  87           HA       TYR  87   6.491   2.311  -8.109
  653   1HB   TYR  87          1HB       TYR  87   4.312   1.158  -6.825
  654   2HB   TYR  87          2HB       TYR  87   5.002  -0.269  -7.573
  655    HD1  TYR  87           1HD      TYR  87   6.243   2.722  -5.657
  656    HD2  TYR  87           2HD      TYR  87   6.435  -1.511  -6.249
  657    HE1  TYR  87           1HE      TYR  87   7.914   2.525  -3.751
  658    HE2  TYR  87           2HE      TYR  87   8.106  -1.694  -4.341
  659    HH   TYR  87           HH       TYR  87   9.891   0.227  -3.322
  660    H    VAL  88           H        VAL  88   8.167   1.463  -9.249
  661    HA   VAL  88           HA       VAL  88   7.517  -0.206 -11.515
  662    HB   VAL  88           HB       VAL  88   9.998   1.193 -10.527
  663   1HG1  VAL  88          1HG1      VAL  88  10.738  -0.907 -11.508
  664   2HG1  VAL  88          2HG1      VAL  88   9.728  -0.624 -12.946
  665   3HG1  VAL  88          3HG1      VAL  88  11.114   0.440 -12.609
  666   1HG2  VAL  88          1HG2      VAL  88   9.665   2.710 -12.257
  667   2HG2  VAL  88          2HG2      VAL  88   8.657   1.582 -13.195
  668   3HG2  VAL  88          3HG2      VAL  88   7.999   2.361 -11.736
  669    H    VAL  89           H        VAL  89   8.607  -2.266 -11.935
  670    HA   VAL  89           HA       VAL  89   9.513  -3.568  -9.464
  671    HB   VAL  89           HB       VAL  89   7.740  -4.786 -11.589
  672   1HG1  VAL  89          1HG1      VAL  89   8.405  -5.865  -8.837
  673   2HG1  VAL  89          2HG1      VAL  89   7.591  -6.700 -10.181
  674   3HG1  VAL  89          3HG1      VAL  89   9.321  -6.298 -10.300
  675   1HG2  VAL  89          1HG2      VAL  89   7.097  -3.168  -9.226
  676   2HG2  VAL  89          2HG2      VAL  89   6.078  -3.638 -10.608
  677   3HG2  VAL  89          3HG2      VAL  89   6.289  -4.754  -9.238
  678    H    ASP  90           H        ASP  90  11.542  -4.355  -9.662
  679    HA   ASP  90           HA       ASP  90  12.322  -5.648 -12.046
  680   1HB   ASP  90          1HB       ASP  90  13.659  -3.006 -11.292
  681   2HB   ASP  90          2HB       ASP  90  14.323  -4.140 -12.452
  682    H    PHE  91           H        PHE  91  15.064  -5.809 -11.729
  683    HA   PHE  91           HA       PHE  91  16.441  -7.104 -10.517
  684   1HB   PHE  91          1HB       PHE  91  16.548  -4.455  -9.929
  685   2HB   PHE  91          2HB       PHE  91  16.038  -5.006  -8.345
  686    HD1  PHE  91           1HD      PHE  91  17.810  -4.990  -6.880
  687    HD2  PHE  91           2HD      PHE  91  18.478  -6.335 -10.849
  688    HE1  PHE  91           1HE      PHE  91  20.192  -5.522  -6.298
  689    HE2  PHE  91           2HE      PHE  91  20.861  -6.867 -10.267
  690    HZ   PHE  91           HZ       PHE  91  21.690  -6.455  -7.999
  691    H    MET  92           H        MET  92  16.518  -6.636  -7.412
  692    HA   MET  92           HA       MET  92  14.718  -8.834  -6.893
  693   1HB   MET  92          1HB       MET  92  17.275  -7.810  -5.840
  694   2HB   MET  92          2HB       MET  92  16.150  -8.117  -4.531
  695   1HG   MET  92          1HG       MET  92  16.416 -10.366  -4.736
  696   2HG   MET  92          2HG       MET  92  16.024 -10.313  -6.444
  697   1HE   MET  92          1HE       MET  92  18.500  -9.415  -8.342
  698   2HE   MET  92          2HE       MET  92  18.947 -11.129  -8.171
  699   3HE   MET  92          3HE       MET  92  17.235 -10.645  -8.107
  700    H    GLY  93           H        GLY  93  13.885  -5.894  -7.282
  701   1HA   GLY  93          1HA       GLY  93  12.024  -5.827  -5.081
  702   2HA   GLY  93          2HA       GLY  93  13.221  -4.548  -5.026
  703    H    GLY  94           H        GLY  94  12.912  -2.717  -6.256
  704   1HA   GLY  94          1HA       GLY  94  11.776  -2.607  -8.785
  705   2HA   GLY  94          2HA       GLY  94  10.464  -2.385  -7.646
  706    H    GLY  95           H        GLY  95  10.600  -0.204  -8.976
  707   1HA   GLY  95          1HA       GLY  95  12.497   1.617  -7.623
  708   2HA   GLY  95          2HA       GLY  95  11.838   1.848  -9.230
  709    H    PHE  96           H        PHE  96  11.431   4.019  -7.855
  710    HA   PHE  96           HA       PHE  96   8.669   3.792  -6.896
  711   1HB   PHE  96          1HB       PHE  96  10.594   5.908  -5.881
  712   2HB   PHE  96          2HB       PHE  96   9.249   5.170  -5.034
  713    HD1  PHE  96           1HD      PHE  96   9.642   3.482  -3.479
  714    HD2  PHE  96           2HD      PHE  96  12.655   4.400  -6.323
  715    HE1  PHE  96           1HE      PHE  96  11.233   1.947  -2.290
  716    HE2  PHE  96           2HE      PHE  96  14.245   2.865  -5.134
  717    HZ   PHE  96           HZ       PHE  96  13.515   1.657  -3.131
  718    H    THR  97           H        THR  97   7.250   5.146  -7.911
  719    HA   THR  97           HA       THR  97   8.214   7.649  -9.005
  720    HB   THR  97           HB       THR  97   7.372   5.245 -10.660
  721    HG1  THR  97           1HG      THR  97   9.600   5.752 -10.629
  722   1HG2  THR  97          1HG2      THR  97   7.511   7.356 -12.453
  723   2HG2  THR  97          2HG2      THR  97   5.988   6.628 -11.887
  724   3HG2  THR  97          3HG2      THR  97   6.618   8.096 -11.102
  725    H    ILE  98           H        ILE  98   6.812   9.160  -8.390
  726    HA   ILE  98           HA       ILE  98   4.001   8.329  -8.196
  727    HB   ILE  98           HB       ILE  98   5.061   8.596  -5.995
  728   1HG1  ILE  98          1HG1      ILE  98   3.211  10.918  -6.131
  729   2HG1  ILE  98          2HG1      ILE  98   2.604   9.409  -6.784
  730   1HG2  ILE  98          1HG2      ILE  98   5.240  11.543  -6.248
  731   2HG2  ILE  98          2HG2      ILE  98   6.231  10.400  -5.310
  732   3HG2  ILE  98          3HG2      ILE  98   6.517  10.601  -7.055
  733   1HD1  ILE  98          1HD1      ILE  98   2.022   9.089  -4.568
  734   2HD1  ILE  98          2HD1      ILE  98   3.674   8.429  -4.505
  735   3HD1  ILE  98          3HD1      ILE  98   3.360  10.095  -3.963
  736    H    ARG  99           H        ARG  99   2.440   9.782  -8.988
  737    HA   ARG  99           HA       ARG  99   3.591  12.095 -10.326
  738   1HB   ARG  99          1HB       ARG  99   2.609   9.899 -11.663
  739   2HB   ARG  99          2HB       ARG  99   1.145  10.853 -11.533
  740   1HG   ARG  99          1HG       ARG  99   2.786  12.830 -12.348
  741   2HG   ARG  99          2HG       ARG  99   3.702  11.485 -13.000
  742   1HD   ARG  99          1HD       ARG  99   0.935  11.014 -13.642
  743   2HD   ARG  99          2HD       ARG  99   1.280  12.685 -14.041
  744    HE   ARG  99           HE       ARG  99   3.462  11.338 -15.082
  745   1HH1  ARG  99          2HH2      ARG  99  -0.019  10.967 -15.438
  746   2HH1  ARG  99          1HH2      ARG  99   0.085  10.329 -17.045
  747   1HH2  ARG  99          2HH1      ARG  99   3.600  10.496 -17.202
  748   2HH2  ARG  99          1HH1      ARG  99   2.157  10.059 -18.055
  749    H    ASN 100           H        ASN 100   2.559  14.029  -9.837
  750    HA   ASN 100           HA       ASN 100   0.185  13.790  -8.203
  751   1HB   ASN 100          1HB       ASN 100   0.638  16.226  -7.694
  752   2HB   ASN 100          2HB       ASN 100   1.989  15.187  -7.285
  753   1HD2  ASN 100          1HD2      ASN 100   3.884  15.895  -7.862
  754   2HD2  ASN 100          2HD2      ASN 100   4.267  16.909  -9.213
  755    HA   PRO 101           HA       PRO 101  -2.201  15.343 -11.549
  756   1HB   PRO 101          1HB       PRO 101  -4.482  16.062 -10.227
  757   2HB   PRO 101          2HB       PRO 101  -4.131  14.413 -10.705
  758   1HG   PRO 101          1HG       PRO 101  -3.993  15.632  -8.016
  759   2HG   PRO 101          2HG       PRO 101  -4.064  13.936  -8.449
  760   1HD   PRO 101          1HD       PRO 101  -1.745  15.393  -7.599
  761   2HD   PRO 101          2HD       PRO 101  -1.795  13.728  -8.143
  Start of MODEL   17
    1    H    MET   1           H        MET   1 -18.596  -2.139  19.637
    2    HA   MET   1           HA       MET   1 -16.443  -2.663  20.582
    3   1HB   MET   1          1HB       MET   1 -17.537  -4.257  18.228
    4   2HB   MET   1          2HB       MET   1 -16.103  -4.831  19.056
    5   1HG   MET   1          1HG       MET   1 -17.656  -4.363  21.234
    6   2HG   MET   1          2HG       MET   1 -18.932  -4.639  20.065
    7   1HE   MET   1          1HE       MET   1 -19.230  -8.139  21.175
    8   2HE   MET   1          2HE       MET   1 -19.762  -6.452  21.373
    9   3HE   MET   1          3HE       MET   1 -19.812  -7.218  19.767
   10    H    GLN   2           H        GLN   2 -14.899  -0.945  20.112
   11    HA   GLN   2           HA       GLN   2 -13.230   0.027  19.086
   12   1HB   GLN   2          1HB       GLN   2 -12.609  -2.717  19.521
   13   2HB   GLN   2          2HB       GLN   2 -11.921  -2.318  17.959
   14   1HG   GLN   2          1HG       GLN   2 -11.476  -0.709  20.519
   15   2HG   GLN   2          2HG       GLN   2 -10.341  -1.870  19.859
   16   1HE2  GLN   2          1HE2      GLN   2  -8.689  -0.596  19.327
   17   2HE2  GLN   2          2HE2      GLN   2  -8.734   0.698  18.176
   18    H    GLU   3           H        GLU   3 -14.122   1.230  17.381
   19    HA   GLU   3           HA       GLU   3 -13.778  -0.024  14.787
   20   1HB   GLU   3          1HB       GLU   3 -16.239  -0.036  15.566
   21   2HB   GLU   3          2HB       GLU   3 -16.197   1.710  15.422
   22   1HG   GLU   3          1HG       GLU   3 -15.123   1.001  12.993
   23   2HG   GLU   3          2HG       GLU   3 -16.172  -0.374  13.278
   24    H    GLN   4           H        GLN   4 -12.191   1.176  13.833
   25    HA   GLN   4           HA       GLN   4 -12.196   4.025  14.420
   26   1HB   GLN   4          1HB       GLN   4 -10.105   2.015  14.144
   27   2HB   GLN   4          2HB       GLN   4  -9.827   3.322  13.010
   28   1HG   GLN   4          1HG       GLN   4 -10.534   4.729  15.290
   29   2HG   GLN   4          2HG       GLN   4  -9.719   3.343  15.985
   30   1HE2  GLN   4          1HE2      GLN   4  -9.180   6.355  15.304
   31   2HE2  GLN   4          2HE2      GLN   4  -7.544   6.360  14.734
   32    H    ALA   5           H        ALA   5 -13.921   4.521  12.898
   33    HA   ALA   5           HA       ALA   5 -13.820   3.726  10.209
   34   1HB   ALA   5          1HB       ALA   5 -15.632   4.944  11.877
   35   2HB   ALA   5          2HB       ALA   5 -15.131   6.304  10.843
   36   3HB   ALA   5          3HB       ALA   5 -15.803   4.828  10.109
   37    H    GLN   6           H        GLN   6 -12.583   4.423   8.533
   38    HA   GLN   6           HA       GLN   6 -11.746   7.106   8.387
   39   1HB   GLN   6          1HB       GLN   6  -9.977   6.676   9.866
   40   2HB   GLN   6          2HB       GLN   6  -9.784   5.018   9.330
   41   1HG   GLN   6          1HG       GLN   6  -8.488   5.606   7.490
   42   2HG   GLN   6          2HG       GLN   6  -9.296   7.145   7.269
   43   1HE2  GLN   6          1HE2      GLN   6  -7.636   8.512   7.249
   44   2HE2  GLN   6          2HE2      GLN   6  -6.512   8.767   8.543
   45    H    GLN   7           H        GLN   7 -12.257   7.377   6.252
   46    HA   GLN   7           HA       GLN   7 -11.277   5.305   4.446
   47   1HB   GLN   7          1HB       GLN   7 -13.189   5.767   2.982
   48   2HB   GLN   7          2HB       GLN   7 -13.759   5.352   4.586
   49   1HG   GLN   7          1HG       GLN   7 -13.620   8.016   4.946
   50   2HG   GLN   7          2HG       GLN   7 -13.766   8.033   3.200
   51   1HE2  GLN   7          1HE2      GLN   7 -15.778   8.803   3.000
   52   2HE2  GLN   7          2HE2      GLN   7 -17.219   8.014   3.549
   53    H    PHE   8           H        PHE   8  -9.346   6.190   3.728
   54    HA   PHE   8           HA       PHE   8  -9.399   8.996   2.922
   55   1HB   PHE   8          1HB       PHE   8  -7.580   7.225   4.261
   56   2HB   PHE   8          2HB       PHE   8  -6.865   7.491   2.684
   57    HD1  PHE   8           1HD      PHE   8  -8.122  10.388   2.504
   58    HD2  PHE   8           2HD      PHE   8  -5.750   8.360   5.381
   59    HE1  PHE   8           1HE      PHE   8  -7.199  12.585   3.293
   60    HE2  PHE   8           2HE      PHE   8  -4.828  10.558   6.169
   61    HZ   PHE   8           HZ       PHE   8  -5.564  12.644   5.116
   62    H    ILE   9           H        ILE   9  -8.589   9.654   0.829
   63    HA   ILE   9           HA       ILE   9  -9.239   7.721  -1.205
   64    HB   ILE   9           HB       ILE   9 -10.031  10.058  -1.260
   65   1HG1  ILE   9          1HG1      ILE   9  -8.684  10.275  -3.724
   66   2HG1  ILE   9          2HG1      ILE   9  -8.789   8.556  -3.405
   67   1HG2  ILE   9          1HG2      ILE   9  -7.680  11.308  -2.329
   68   2HG2  ILE   9          2HG2      ILE   9  -8.682  11.787  -0.938
   69   3HG2  ILE   9          3HG2      ILE   9  -7.323  10.661  -0.709
   70   1HD1  ILE   9          1HD1      ILE   9 -10.886   8.787  -4.310
   71   2HD1  ILE   9          2HD1      ILE   9 -11.314   9.322  -2.668
   72   3HD1  ILE   9          3HD1      ILE   9 -10.964  10.525  -3.933
   73    H    PHE  10           H        PHE  10  -7.825   6.589  -2.470
   74    HA   PHE  10           HA       PHE  10  -5.110   7.457  -2.718
   75   1HB   PHE  10          1HB       PHE  10  -5.286   6.234  -0.461
   76   2HB   PHE  10          2HB       PHE  10  -5.860   4.819  -1.320
   77    HD1  PHE  10           1HD      PHE  10  -4.230   3.191  -1.208
   78    HD2  PHE  10           2HD      PHE  10  -3.059   7.185  -2.036
   79    HE1  PHE  10           1HE      PHE  10  -1.861   2.429  -1.536
   80    HE2  PHE  10           2HE      PHE  10  -0.690   6.423  -2.364
   81    HZ   PHE  10           HZ       PHE  10  -0.120   4.054  -2.109
   82    H    LYS  11           H        LYS  11  -4.149   6.602  -4.572
   83    HA   LYS  11           HA       LYS  11  -5.558   4.385  -5.856
   84   1HB   LYS  11          1HB       LYS  11  -4.702   6.800  -7.446
   85   2HB   LYS  11          2HB       LYS  11  -5.766   5.492  -7.923
   86   1HG   LYS  11          1HG       LYS  11  -6.432   7.408  -5.644
   87   2HG   LYS  11          2HG       LYS  11  -6.912   7.708  -7.302
   88   1HD   LYS  11          1HD       LYS  11  -8.427   5.911  -7.343
   89   2HD   LYS  11          2HD       LYS  11  -7.570   5.016  -6.105
   90   1HE   LYS  11          1HE       LYS  11  -8.413   6.429  -4.343
   91   2HE   LYS  11          2HE       LYS  11  -8.949   7.656  -5.473
   92   1HZ   LYS  11          1HZ       LYS  11 -10.070   5.036  -5.861
   93   2HZ   LYS  11          2HZ       LYS  11 -10.532   5.802  -4.495
   94   3HZ   LYS  11          3HZ       LYS  11 -10.787   6.500  -5.949
   95    H    VAL  12           H        VAL  12  -4.112   2.781  -6.126
   96    HA   VAL  12           HA       VAL  12  -1.354   3.590  -6.743
   97    HB   VAL  12           HB       VAL  12  -2.021   2.543  -4.411
   98   1HG1  VAL  12          1HG1      VAL  12  -1.392  -0.011  -5.879
   99   2HG1  VAL  12          2HG1      VAL  12  -2.111   0.223  -4.267
  100   3HG1  VAL  12          3HG1      VAL  12  -3.074   0.553  -5.728
  101   1HG2  VAL  12          1HG2      VAL  12   0.385   2.028  -6.143
  102   2HG2  VAL  12          2HG2      VAL  12   0.219   3.069  -4.708
  103   3HG2  VAL  12          3HG2      VAL  12   0.281   1.300  -4.522
  104    H    THR  13           H        THR  13  -0.332   2.502  -8.431
  105    HA   THR  13           HA       THR  13  -2.006   1.343 -10.370
  106    HB   THR  13           HB       THR  13   0.244   0.893 -11.472
  107    HG1  THR  13           1HG      THR  13   2.067   1.305 -10.142
  108   1HG2  THR  13          1HG2      THR  13  -0.425   3.576 -10.230
  109   2HG2  THR  13          2HG2      THR  13   1.149   3.371 -11.035
  110   3HG2  THR  13          3HG2      THR  13  -0.357   3.125 -11.951
  111    H    ASP  14           H        ASP  14  -1.952  -0.820 -11.279
  112    HA   ASP  14           HA       ASP  14  -2.423  -2.714  -9.361
  113   1HB   ASP  14          1HB       ASP  14  -1.927  -2.720 -12.326
  114   2HB   ASP  14          2HB       ASP  14  -1.827  -4.271 -11.516
  115    H    LYS  15           H        LYS  15   0.542  -1.727 -11.092
  116    HA   LYS  15           HA       LYS  15   2.077  -4.014 -10.524
  117   1HB   LYS  15          1HB       LYS  15   2.366  -1.756 -12.067
  118   2HB   LYS  15          2HB       LYS  15   3.512  -1.452 -10.777
  119   1HG   LYS  15          1HG       LYS  15   4.389  -3.848 -11.156
  120   2HG   LYS  15          2HG       LYS  15   3.400  -3.893 -12.602
  121   1HD   LYS  15          1HD       LYS  15   4.746  -1.447 -12.843
  122   2HD   LYS  15          2HD       LYS  15   5.956  -2.489 -12.120
  123   1HE   LYS  15          1HE       LYS  15   5.668  -4.154 -13.920
  124   2HE   LYS  15          2HE       LYS  15   4.341  -3.235 -14.604
  125   1HZ   LYS  15          1HZ       LYS  15   7.145  -2.777 -14.817
  126   2HZ   LYS  15          2HZ       LYS  15   5.935  -2.299 -15.804
  127   3HZ   LYS  15          3HZ       LYS  15   6.300  -1.421 -14.476
  128    H    ALA  16           H        ALA  16   1.484  -0.915  -8.789
  129    HA   ALA  16           HA       ALA  16   3.400  -1.303  -6.797
  130   1HB   ALA  16          1HB       ALA  16   1.836   0.734  -7.513
  131   2HB   ALA  16          2HB       ALA  16   0.799   0.083  -6.222
  132   3HB   ALA  16          3HB       ALA  16   2.465   0.590  -5.854
  133    H    VAL  17           H        VAL  17  -0.076  -2.266  -7.050
  134    HA   VAL  17           HA       VAL  17  -0.194  -3.360  -4.459
  135    HB   VAL  17           HB       VAL  17  -1.858  -3.129  -6.842
  136   1HG1  VAL  17          1HG1      VAL  17  -1.989  -5.670  -5.200
  137   2HG1  VAL  17          2HG1      VAL  17  -3.378  -5.042  -6.120
  138   3HG1  VAL  17          3HG1      VAL  17  -1.881  -5.498  -6.968
  139   1HG2  VAL  17          1HG2      VAL  17  -2.682  -1.830  -5.169
  140   2HG2  VAL  17          2HG2      VAL  17  -3.574  -3.317  -4.768
  141   3HG2  VAL  17          3HG2      VAL  17  -2.084  -2.908  -3.884
  142    H    GLU  18           H        GLU  18   0.335  -4.812  -7.740
  143    HA   GLU  18           HA       GLU  18   0.485  -7.408  -6.951
  144   1HB   GLU  18          1HB       GLU  18   1.089  -5.872  -9.287
  145   2HB   GLU  18          2HB       GLU  18   2.477  -6.902  -8.996
  146   1HG   GLU  18          1HG       GLU  18   0.972  -8.186 -10.367
  147   2HG   GLU  18          2HG       GLU  18   0.865  -8.871  -8.757
  148    H    GLU  19           H        GLU  19   3.101  -4.910  -7.033
  149    HA   GLU  19           HA       GLU  19   5.218  -6.475  -6.438
  150   1HB   GLU  19          1HB       GLU  19   5.636  -4.191  -6.914
  151   2HB   GLU  19          2HB       GLU  19   4.509  -3.626  -5.696
  152   1HG   GLU  19          1HG       GLU  19   6.759  -3.271  -4.846
  153   2HG   GLU  19          2HG       GLU  19   6.031  -4.558  -3.906
  154    H    ILE  20           H        ILE  20   2.572  -5.403  -4.308
  155    HA   ILE  20           HA       ILE  20   3.879  -6.108  -1.891
  156    HB   ILE  20           HB       ILE  20   0.906  -5.956  -2.257
  157   1HG1  ILE  20          1HG1      ILE  20   1.415  -4.054  -3.468
  158   2HG1  ILE  20          2HG1      ILE  20   1.276  -3.424  -1.838
  159   1HG2  ILE  20          1HG2      ILE  20   2.858  -5.364  -0.034
  160   2HG2  ILE  20          2HG2      ILE  20   1.190  -4.744  -0.022
  161   3HG2  ILE  20          3HG2      ILE  20   1.487  -6.499  -0.051
  162   1HD1  ILE  20          1HD1      ILE  20   3.687  -3.690  -3.571
  163   2HD1  ILE  20          2HD1      ILE  20   3.317  -2.488  -2.312
  164   3HD1  ILE  20          3HD1      ILE  20   3.933  -4.095  -1.855
  165    H    LYS  21           H        LYS  21   1.550  -7.740  -4.117
  166    HA   LYS  21           HA       LYS  21   1.276 -10.032  -2.509
  167   1HB   LYS  21          1HB       LYS  21   0.791  -9.547  -5.461
  168   2HB   LYS  21          2HB       LYS  21   0.366 -11.031  -4.632
  169   1HG   LYS  21          1HG       LYS  21  -1.256  -9.955  -3.259
  170   2HG   LYS  21          2HG       LYS  21  -0.573  -8.364  -3.531
  171   1HD   LYS  21          1HD       LYS  21  -1.805  -8.042  -5.422
  172   2HD   LYS  21          2HD       LYS  21  -1.385  -9.618  -6.062
  173   1HE   LYS  21          1HE       LYS  21  -3.354  -9.461  -3.770
  174   2HE   LYS  21          2HE       LYS  21  -3.904  -9.049  -5.382
  175   1HZ   LYS  21          1HZ       LYS  21  -4.234 -11.332  -5.097
  176   2HZ   LYS  21          2HZ       LYS  21  -2.939 -11.215  -6.085
  177   3HZ   LYS  21          3HZ       LYS  21  -2.732 -11.591  -4.510
  178    H    LYS  22           H        LYS  22   3.634  -8.984  -4.974
  179    HA   LYS  22           HA       LYS  22   4.796 -11.523  -5.348
  180   1HB   LYS  22          1HB       LYS  22   4.971  -9.090  -6.578
  181   2HB   LYS  22          2HB       LYS  22   6.497  -9.133  -5.720
  182   1HG   LYS  22          1HG       LYS  22   6.043 -11.744  -6.880
  183   2HG   LYS  22          2HG       LYS  22   5.769 -10.540  -8.124
  184   1HD   LYS  22          1HD       LYS  22   8.130  -9.806  -6.591
  185   2HD   LYS  22          2HD       LYS  22   8.279 -11.473  -7.111
  186   1HE   LYS  22          1HE       LYS  22   7.368  -9.361  -9.090
  187   2HE   LYS  22          2HE       LYS  22   9.073  -9.522  -8.717
  188   1HZ   LYS  22          1HZ       LYS  22   7.316 -11.404 -10.043
  189   2HZ   LYS  22          2HZ       LYS  22   8.858 -10.998 -10.394
  190   3HZ   LYS  22          3HZ       LYS  22   8.543 -12.015  -9.156
  191    H    VAL  23           H        VAL  23   5.355  -8.818  -3.052
  192    HA   VAL  23           HA       VAL  23   7.669 -10.066  -1.932
  193    HB   VAL  23           HB       VAL  23   6.064  -7.612  -1.546
  194   1HG1  VAL  23          1HG1      VAL  23   5.922  -8.364   0.715
  195   2HG1  VAL  23          2HG1      VAL  23   7.622  -8.894   0.717
  196   3HG1  VAL  23          3HG1      VAL  23   7.230  -7.158   0.654
  197   1HG2  VAL  23          1HG2      VAL  23   9.019  -7.813  -1.111
  198   2HG2  VAL  23          2HG2      VAL  23   8.385  -8.067  -2.754
  199   3HG2  VAL  23          3HG2      VAL  23   8.062  -6.538  -1.902
  200    H    ALA  24           H        ALA  24   4.152  -9.991  -1.315
  201    HA   ALA  24           HA       ALA  24   4.350 -11.197   1.252
  202   1HB   ALA  24          1HB       ALA  24   1.924 -11.307  -0.546
  203   2HB   ALA  24          2HB       ALA  24   2.007 -11.120   1.222
  204   3HB   ALA  24          3HB       ALA  24   2.454  -9.762   0.162
  205    H    GLN  25           H        GLN  25   3.570 -12.377  -2.087
  206    HA   GLN  25           HA       GLN  25   3.134 -14.994  -1.351
  207   1HB   GLN  25          1HB       GLN  25   3.139 -15.471  -3.660
  208   2HB   GLN  25          2HB       GLN  25   2.700 -13.775  -3.605
  209   1HG   GLN  25          1HG       GLN  25   4.409 -13.479  -5.090
  210   2HG   GLN  25          2HG       GLN  25   5.454 -13.590  -3.688
  211   1HE2  GLN  25          1HE2      GLN  25   4.514 -14.958  -6.639
  212   2HE2  GLN  25          2HE2      GLN  25   5.458 -16.410  -6.605
  213    H    GLU  26           H        GLU  26   6.057 -13.135  -1.394
  214    HA   GLU  26           HA       GLU  26   7.719 -15.453  -1.752
  215   1HB   GLU  26          1HB       GLU  26   8.063 -12.526  -1.809
  216   2HB   GLU  26          2HB       GLU  26   9.360 -13.330  -0.947
  217   1HG   GLU  26          1HG       GLU  26   9.165 -14.993  -3.107
  218   2HG   GLU  26          2HG       GLU  26   8.607 -13.504  -3.843
  219    H    ASN  27           H        ASN  27   5.969 -13.981   0.768
  220    HA   ASN  27           HA       ASN  27   7.829 -15.104   2.714
  221   1HB   ASN  27          1HB       ASN  27   6.198 -12.581   2.692
  222   2HB   ASN  27          2HB       ASN  27   6.244 -13.435   4.222
  223   1HD2  ASN  27          1HD2      ASN  27   7.714 -11.158   2.357
  224   2HD2  ASN  27          2HD2      ASN  27   9.298 -11.120   3.057
  225    H    ASN  28           H        ASN  28   5.019 -15.652   1.034
  226    HA   ASN  28           HA       ASN  28   3.293 -16.938   1.292
  227   1HB   ASN  28          1HB       ASN  28   5.180 -18.232   2.779
  228   2HB   ASN  28          2HB       ASN  28   4.031 -17.889   4.057
  229   1HD2  ASN  28          1HD2      ASN  28   4.735 -19.703   1.222
  230   2HD2  ASN  28          2HD2      ASN  28   3.337 -20.725   1.199
  231    H    ILE  29           H        ILE  29   3.026 -14.233   2.098
  232    HA   ILE  29           HA       ILE  29   1.534 -14.337   4.610
  233    HB   ILE  29           HB       ILE  29   2.372 -11.921   3.009
  234   1HG1  ILE  29          1HG1      ILE  29   3.823 -13.199   5.346
  235   2HG1  ILE  29          2HG1      ILE  29   4.334 -13.299   3.672
  236   1HG2  ILE  29          1HG2      ILE  29   0.813 -12.345   5.439
  237   2HG2  ILE  29          2HG2      ILE  29   2.198 -11.255   5.692
  238   3HG2  ILE  29          3HG2      ILE  29   0.998 -10.891   4.428
  239   1HD1  ILE  29          1HD1      ILE  29   5.101 -11.315   5.437
  240   2HD1  ILE  29          2HD1      ILE  29   5.158 -11.169   3.664
  241   3HD1  ILE  29          3HD1      ILE  29   3.763 -10.529   4.565
  242    H    GLU  30           H        GLU  30  -0.667 -13.879   4.723
  243    HA   GLU  30           HA       GLU  30  -1.939 -13.696   2.105
  244   1HB   GLU  30          1HB       GLU  30  -2.328 -15.531   4.270
  245   2HB   GLU  30          2HB       GLU  30  -3.774 -14.545   4.178
  246   1HG   GLU  30          1HG       GLU  30  -4.027 -15.065   1.774
  247   2HG   GLU  30          2HG       GLU  30  -2.514 -15.950   1.775
  248    H    ASN  31           H        ASN  31  -0.974 -11.747   4.523
  249    HA   ASN  31           HA       ASN  31  -3.170  -9.959   4.049
  250   1HB   ASN  31          1HB       ASN  31  -2.525 -11.184   6.725
  251   2HB   ASN  31          2HB       ASN  31  -2.884  -9.469   6.725
  252   1HD2  ASN  31          1HD2      ASN  31  -4.105 -12.635   6.538
  253   2HD2  ASN  31          2HD2      ASN  31  -5.783 -12.285   6.290
  254    HA   PRO  32           HA       PRO  32   1.083  -8.214   4.336
  255   1HB   PRO  32          1HB       PRO  32   1.332  -7.305   1.771
  256   2HB   PRO  32          2HB       PRO  32   1.947  -8.858   2.301
  257   1HG   PRO  32          1HG       PRO  32  -0.449  -8.271   0.672
  258   2HG   PRO  32          2HG       PRO  32   0.411  -9.787   0.853
  259   1HD   PRO  32          1HD       PRO  32  -2.079  -9.069   2.082
  260   2HD   PRO  32          2HD       PRO  32  -1.162 -10.537   2.353
  261    H    ILE  33           H        ILE  33   1.257  -6.356   5.403
  262    HA   ILE  33           HA       ILE  33  -0.763  -4.369   4.695
  263    HB   ILE  33           HB       ILE  33   0.869  -4.946   7.140
  264   1HG1  ILE  33          1HG1      ILE  33  -1.885  -4.208   7.559
  265   2HG1  ILE  33          2HG1      ILE  33  -1.798  -5.434   6.310
  266   1HG2  ILE  33          1HG2      ILE  33   1.225  -2.748   7.406
  267   2HG2  ILE  33          2HG2      ILE  33   0.010  -2.296   6.186
  268   3HG2  ILE  33          3HG2      ILE  33  -0.500  -2.693   7.844
  269   1HD1  ILE  33          1HD1      ILE  33  -0.164  -5.765   8.839
  270   2HD1  ILE  33          2HD1      ILE  33  -1.896  -6.175   8.834
  271   3HD1  ILE  33          3HD1      ILE  33  -0.780  -7.015   7.731
  272    H    LEU  34           H        LEU  34  -0.048  -3.188   2.966
  273    HA   LEU  34           HA       LEU  34   2.749  -2.405   2.917
  274   1HB   LEU  34          1HB       LEU  34   2.229  -3.058   0.821
  275   2HB   LEU  34          2HB       LEU  34   0.536  -2.633   0.972
  276    HG   LEU  34           HG       LEU  34   1.379  -0.169   0.874
  277   1HD1  LEU  34          1HD1      LEU  34   3.473   0.313   0.160
  278   2HD1  LEU  34          2HD1      LEU  34   3.838  -1.231   0.969
  279   3HD1  LEU  34          3HD1      LEU  34   3.618  -1.181  -0.796
  280   1HD2  LEU  34          1HD2      LEU  34   1.773  -1.331  -1.799
  281   2HD2  LEU  34          2HD2      LEU  34   0.303  -1.888  -0.962
  282   3HD2  LEU  34          3HD2      LEU  34   0.577  -0.147  -1.217
  283    H    ARG  35           H        ARG  35   3.378  -0.606   3.968
  284    HA   ARG  35           HA       ARG  35   1.341   1.411   4.393
  285   1HB   ARG  35          1HB       ARG  35   2.664   2.176   6.258
  286   2HB   ARG  35          2HB       ARG  35   2.687   0.426   6.348
  287   1HG   ARG  35          1HG       ARG  35   4.887   0.638   4.886
  288   2HG   ARG  35          2HG       ARG  35   4.893   2.299   5.443
  289   1HD   ARG  35          1HD       ARG  35   4.411   0.329   7.614
  290   2HD   ARG  35          2HD       ARG  35   5.968   0.139   6.832
  291    HE   ARG  35           HE       ARG  35   5.468   2.930   7.395
  292   1HH1  ARG  35          2HH2      ARG  35   6.383  -0.092   8.948
  293   2HH1  ARG  35          1HH2      ARG  35   7.241   0.682  10.238
  294   1HH2  ARG  35          2HH1      ARG  35   6.601   3.952   9.096
  295   2HH2  ARG  35          1HH1      ARG  35   7.366   2.998  10.323
  296    H    ILE  36           H        ILE  36   1.414   3.291   3.193
  297    HA   ILE  36           HA       ILE  36   3.751   3.720   1.531
  298    HB   ILE  36           HB       ILE  36   0.920   4.663   1.560
  299   1HG1  ILE  36          1HG1      ILE  36   1.534   4.155  -1.008
  300   2HG1  ILE  36          2HG1      ILE  36   2.744   3.144  -0.242
  301   1HG2  ILE  36          1HG2      ILE  36   3.130   6.051   0.019
  302   2HG2  ILE  36          2HG2      ILE  36   1.384   6.375  -0.097
  303   3HG2  ILE  36          3HG2      ILE  36   2.256   6.728   1.414
  304   1HD1  ILE  36          1HD1      ILE  36  -0.277   3.011   0.072
  305   2HD1  ILE  36          2HD1      ILE  36   0.836   1.733  -0.474
  306   3HD1  ILE  36          3HD1      ILE  36   0.818   2.227   1.236
  307    H    ARG  37           H        ARG  37   5.434   4.777   2.441
  308    HA   ARG  37           HA       ARG  37   4.718   7.070   4.085
  309   1HB   ARG  37          1HB       ARG  37   6.551   6.614   5.572
  310   2HB   ARG  37          2HB       ARG  37   5.764   5.067   5.328
  311   1HG   ARG  37          1HG       ARG  37   7.558   5.029   3.246
  312   2HG   ARG  37          2HG       ARG  37   8.450   5.999   4.401
  313   1HD   ARG  37          1HD       ARG  37   7.183   3.645   5.662
  314   2HD   ARG  37          2HD       ARG  37   8.289   3.195   4.380
  315    HE   ARG  37           HE       ARG  37   9.558   5.195   5.977
  316   1HH1  ARG  37          2HH2      ARG  37   8.502   1.847   6.214
  317   2HH1  ARG  37          1HH2      ARG  37   9.699   1.419   7.390
  318   1HH2  ARG  37          2HH1      ARG  37  11.138   4.631   7.529
  319   2HH2  ARG  37          1HH1      ARG  37  11.208   3.013   8.143
  320    H    VAL  38           H        VAL  38   6.335   8.881   4.014
  321    HA   VAL  38           HA       VAL  38   7.312   9.219   1.348
  322    HB   VAL  38           HB       VAL  38   7.497  10.944   3.825
  323   1HG1  VAL  38          1HG1      VAL  38   9.185  11.788   2.463
  324   2HG1  VAL  38          2HG1      VAL  38   8.311  11.402   0.961
  325   3HG1  VAL  38          3HG1      VAL  38   7.776  12.762   1.977
  326   1HG2  VAL  38          1HG2      VAL  38   5.685  11.536   1.514
  327   2HG2  VAL  38          2HG2      VAL  38   5.200  10.284   2.682
  328   3HG2  VAL  38          3HG2      VAL  38   5.512  11.946   3.237
  329    H    VAL  39           H        VAL  39   9.575   9.823   0.835
  330    HA   VAL  39           HA       VAL  39  11.475   8.646   2.735
  331    HB   VAL  39           HB       VAL  39  11.316   8.202  -0.251
  332   1HG1  VAL  39          1HG1      VAL  39  13.449   7.492  -0.297
  333   2HG1  VAL  39          2HG1      VAL  39  13.638   8.413   1.215
  334   3HG1  VAL  39          3HG1      VAL  39  13.308   6.664   1.272
  335   1HG2  VAL  39          1HG2      VAL  39  11.499   5.803   1.326
  336   2HG2  VAL  39          2HG2      VAL  39  10.154   6.803   1.925
  337   3HG2  VAL  39          3HG2      VAL  39  10.211   6.322   0.212
  338    HA   PRO  40           HA       PRO  40  13.391  12.478   2.025
  339   1HB   PRO  40          1HB       PRO  40  15.634  12.091   3.538
  340   2HB   PRO  40          2HB       PRO  40  14.100  12.605   4.212
  341   1HG   PRO  40          1HG       PRO  40  15.386   9.946   4.346
  342   2HG   PRO  40          2HG       PRO  40  14.099  10.595   5.343
  343   1HD   PRO  40          1HD       PRO  40  13.826   8.705   3.202
  344   2HD   PRO  40          2HD       PRO  40  12.529   9.440   4.123
  345    H    GLY  41           H        GLY  41  13.462  11.614  -0.282
  346   1HA   GLY  41          1HA       GLY  41  16.316  11.598  -0.996
  347   2HA   GLY  41          2HA       GLY  41  15.277  10.314  -1.582
  348    H    GLY  42           H        GLY  42  12.968  11.344  -2.416
  349   1HA   GLY  42          1HA       GLY  42  13.448  12.537  -4.832
  350   2HA   GLY  42          2HA       GLY  42  11.926  12.602  -3.964
  351    H    CYS  43           H        CYS  43  14.571  14.424  -5.169
  352    HA   CYS  43           HA       CYS  43  14.442  16.540  -3.272
  353   1HB   CYS  43          1HB       CYS  43  16.393  15.842  -4.881
  354   2HB   CYS  43          2HB       CYS  43  15.564  16.853  -6.048
  355    HG   CYS  43           HG       CYS  43  15.257  18.592  -3.653
  356    H    SER  44           H        SER  44  13.088  15.769  -6.527
  357    HA   SER  44           HA       SER  44  11.654  18.276  -6.485
  358   1HB   SER  44          1HB       SER  44  11.912  16.105  -8.611
  359   2HB   SER  44          2HB       SER  44  10.947  17.554  -8.815
  360    HG   SER  44           HG       SER  44  13.752  17.231  -8.851
  361    H    GLY  45           H        GLY  45  11.154  14.706  -6.470
  362   1HA   GLY  45          1HA       GLY  45   8.404  15.183  -5.515
  363   2HA   GLY  45          2HA       GLY  45   8.714  14.050  -6.816
  364    H    PHE  46           H        PHE  46   8.569  14.490  -3.404
  365    HA   PHE  46           HA       PHE  46  10.384  12.486  -2.613
  366   1HB   PHE  46          1HB       PHE  46   7.825  13.669  -1.378
  367   2HB   PHE  46          2HB       PHE  46   8.959  12.683  -0.478
  368    HD1  PHE  46           1HD      PHE  46  11.511  13.584  -0.744
  369    HD2  PHE  46           2HD      PHE  46   7.996  15.939  -1.070
  370    HE1  PHE  46           1HE      PHE  46  12.832  15.636  -0.160
  371    HE2  PHE  46           2HE      PHE  46   9.317  17.991  -0.485
  372    HZ   PHE  46           HZ       PHE  46  11.720  17.815  -0.037
  373    H    GLN  47           H        GLN  47   9.995  10.628  -3.961
  374    HA   GLN  47           HA       GLN  47   7.422   9.506  -4.108
  375   1HB   GLN  47          1HB       GLN  47   8.786   7.478  -4.993
  376   2HB   GLN  47          2HB       GLN  47   8.843   8.969  -5.912
  377   1HG   GLN  47          1HG       GLN  47  10.906   8.734  -3.765
  378   2HG   GLN  47          2HG       GLN  47  11.069   7.582  -5.076
  379   1HE2  GLN  47          1HE2      GLN  47  10.635   8.612  -7.317
  380   2HE2  GLN  47          2HE2      GLN  47  11.482  10.085  -7.653
  381    H    TYR  48           H        TYR  48   6.489   7.774  -2.956
  382    HA   TYR  48           HA       TYR  48   7.629   7.334  -0.346
  383   1HB   TYR  48          1HB       TYR  48   5.134   6.493  -1.935
  384   2HB   TYR  48          2HB       TYR  48   5.411   5.891  -0.312
  385    HD1  TYR  48           1HD      TYR  48   5.478   9.219  -2.066
  386    HD2  TYR  48           2HD      TYR  48   4.266   6.983   1.374
  387    HE1  TYR  48           1HE      TYR  48   4.370  11.293  -1.100
  388    HE2  TYR  48           2HE      TYR  48   3.161   9.064   2.329
  389    HH   TYR  48           HH       TYR  48   3.803  12.104   1.239
  390    H    ALA  49           H        ALA  49   8.291   5.328   0.531
  391    HA   ALA  49           HA       ALA  49   9.196   3.452  -1.497
  392   1HB   ALA  49          1HB       ALA  49   9.860   4.059   1.383
  393   2HB   ALA  49          2HB       ALA  49  10.301   2.481   0.687
  394   3HB   ALA  49          3HB       ALA  49  10.936   3.980  -0.033
  395    H    MET  50           H        MET  50   8.909   1.080  -1.104
  396    HA   MET  50           HA       MET  50   6.266   0.653   0.047
  397   1HB   MET  50          1HB       MET  50   6.536   0.158  -2.401
  398   2HB   MET  50          2HB       MET  50   7.855  -0.938  -2.043
  399   1HG   MET  50          1HG       MET  50   5.524  -1.649  -0.435
  400   2HG   MET  50          2HG       MET  50   5.070  -1.552  -2.125
  401   1HE   MET  50          1HE       MET  50   5.190  -4.413  -0.337
  402   2HE   MET  50          2HE       MET  50   6.856  -5.015  -0.164
  403   3HE   MET  50          3HE       MET  50   6.383  -3.476   0.594
  404    H    GLY  51           H        GLY  51   5.883  -1.200   1.408
  405   1HA   GLY  51          1HA       GLY  51   7.874  -3.099   2.037
  406   2HA   GLY  51          2HA       GLY  51   7.917  -1.805   3.218
  407    H    PHE  52           H        PHE  52   7.269  -4.185   4.272
  408    HA   PHE  52           HA       PHE  52   4.340  -4.106   4.481
  409   1HB   PHE  52          1HB       PHE  52   5.139  -6.580   5.431
  410   2HB   PHE  52          2HB       PHE  52   4.697  -6.301   3.759
  411    HD1  PHE  52           1HD      PHE  52   6.659  -5.500   2.200
  412    HD2  PHE  52           2HD      PHE  52   7.211  -7.498   5.903
  413    HE1  PHE  52           1HE      PHE  52   8.954  -6.212   1.474
  414    HE2  PHE  52           2HE      PHE  52   9.506  -8.210   5.176
  415    HZ   PHE  52           HZ       PHE  52  10.350  -7.559   2.970
  416    H    ASP  53           H        ASP  53   3.522  -3.568   6.453
  417    HA   ASP  53           HA       ASP  53   5.404  -3.195   8.574
  418   1HB   ASP  53          1HB       ASP  53   3.043  -1.938   7.774
  419   2HB   ASP  53          2HB       ASP  53   2.516  -2.855   9.172
  420    H    ASP  54           H        ASP  54   4.308  -3.841  10.917
  421    HA   ASP  54           HA       ASP  54   3.964  -6.679  10.725
  422   1HB   ASP  54          1HB       ASP  54   5.129  -4.908  12.581
  423   2HB   ASP  54          2HB       ASP  54   3.686  -5.467  13.402
  424    H    THR  55           H        THR  55   2.167  -3.690  11.515
  425    HA   THR  55           HA       THR  55  -0.338  -4.988  11.227
  426    HB   THR  55           HB       THR  55   0.132  -5.815  13.491
  427    HG1  THR  55           1HG      THR  55  -1.444  -3.356  13.672
  428   1HG2  THR  55          1HG2      THR  55   1.779  -4.313  14.409
  429   2HG2  THR  55          2HG2      THR  55   0.793  -2.882  14.022
  430   3HG2  THR  55          3HG2      THR  55   0.293  -3.980  15.331
  431    H    VAL  56           H        VAL  56  -2.173  -3.362  11.857
  432    HA   VAL  56           HA       VAL  56  -1.426  -0.910  10.557
  433    HB   VAL  56           HB       VAL  56  -3.886  -2.379  11.269
  434   1HG1  VAL  56          1HG1      VAL  56  -5.285  -0.299  10.899
  435   2HG1  VAL  56          2HG1      VAL  56  -4.452  -0.398  12.469
  436   3HG1  VAL  56          3HG1      VAL  56  -3.806   0.649  11.184
  437   1HG2  VAL  56          1HG2      VAL  56  -4.488  -1.941   9.037
  438   2HG2  VAL  56          2HG2      VAL  56  -3.405  -0.534   8.925
  439   3HG2  VAL  56          3HG2      VAL  56  -2.725  -2.178   8.982
  440    H    GLU  57           H        GLU  57  -1.903   1.242  11.468
  441    HA   GLU  57           HA       GLU  57  -1.089   1.281  14.215
  442   1HB   GLU  57          1HB       GLU  57  -1.724   3.722  12.530
  443   2HB   GLU  57          2HB       GLU  57  -0.600   3.588  13.868
  444   1HG   GLU  57          1HG       GLU  57   0.812   2.017  12.479
  445   2HG   GLU  57          2HG       GLU  57  -0.286   2.259  11.135
  446    H    GLU  58           H        GLU  58  -2.215   3.130  15.625
  447    HA   GLU  58           HA       GLU  58  -4.966   2.353  15.709
  448   1HB   GLU  58          1HB       GLU  58  -3.168   2.809  17.669
  449   2HB   GLU  58          2HB       GLU  58  -3.841   4.424  17.574
  450   1HG   GLU  58          1HG       GLU  58  -6.039   2.555  17.493
  451   2HG   GLU  58          2HG       GLU  58  -4.985   2.078  18.810
  452    H    GLY  59           H        GLY  59  -4.014   4.008  13.418
  453   1HA   GLY  59          1HA       GLY  59  -6.145   5.749  13.146
  454   2HA   GLY  59          2HA       GLY  59  -4.828   6.705  13.796
  455    H    ASP  60           H        ASP  60  -4.988   3.943  11.428
  456    HA   ASP  60           HA       ASP  60  -3.475   5.664   9.625
  457   1HB   ASP  60          1HB       ASP  60  -2.748   3.189  10.631
  458   2HB   ASP  60          2HB       ASP  60  -3.515   2.724   9.125
  459    H    HIS  61           H        HIS  61  -3.882   4.964   7.194
  460    HA   HIS  61           HA       HIS  61  -6.713   4.935   6.814
  461   1HB   HIS  61          1HB       HIS  61  -5.488   6.396   5.421
  462   2HB   HIS  61          2HB       HIS  61  -4.321   5.161   4.991
  463    HD1  HIS  61           1HD      HIS  61  -8.159   5.161   4.746
  464    HD2  HIS  61           2HD      HIS  61  -4.754   4.623   2.356
  465    HE1  HIS  61           1HE      HIS  61  -9.008   4.549   2.419
  466    H    VAL  62           H        VAL  62  -7.930   3.121   6.729
  467    HA   VAL  62           HA       VAL  62  -6.560   0.608   6.177
  468    HB   VAL  62           HB       VAL  62  -8.739   1.498   7.847
  469   1HG1  VAL  62          1HG1      VAL  62 -10.360   0.702   6.368
  470   2HG1  VAL  62          2HG1      VAL  62  -9.344  -0.654   5.824
  471   3HG1  VAL  62          3HG1      VAL  62 -10.082  -0.689   7.443
  472   1HG2  VAL  62          1HG2      VAL  62  -8.285  -0.609   9.009
  473   2HG2  VAL  62          2HG2      VAL  62  -7.297  -1.167   7.638
  474   3HG2  VAL  62          3HG2      VAL  62  -6.768   0.231   8.605
  475    H    PHE  63           H        PHE  63  -6.308   0.411   3.969
  476    HA   PHE  63           HA       PHE  63  -8.772   0.724   2.401
  477   1HB   PHE  63          1HB       PHE  63  -6.208   1.927   2.189
  478   2HB   PHE  63          2HB       PHE  63  -6.138   0.635   1.008
  479    HD1  PHE  63           1HD      PHE  63  -9.132   2.624   1.929
  480    HD2  PHE  63           2HD      PHE  63  -6.161   1.850  -1.000
  481    HE1  PHE  63           1HE      PHE  63 -10.378   4.056   0.287
  482    HE2  PHE  63           2HE      PHE  63  -7.406   3.283  -2.642
  483    HZ   PHE  63           HZ       PHE  63  -9.500   4.369  -1.979
  484    H    GLU  64           H        GLU  64  -9.640  -1.257   1.990
  485    HA   GLU  64           HA       GLU  64  -7.969  -3.551   2.008
  486   1HB   GLU  64          1HB       GLU  64 -10.914  -3.249   1.271
  487   2HB   GLU  64          2HB       GLU  64 -10.093  -4.774   1.536
  488   1HG   GLU  64          1HG       GLU  64  -9.492  -3.942   3.881
  489   2HG   GLU  64          2HG       GLU  64 -10.528  -2.559   3.590
  490    H    TYR  65           H        TYR  65  -6.932  -4.479   0.286
  491    HA   TYR  65           HA       TYR  65  -7.679  -3.482  -2.375
  492   1HB   TYR  65          1HB       TYR  65  -5.181  -4.278  -0.865
  493   2HB   TYR  65          2HB       TYR  65  -5.202  -4.732  -2.557
  494    HD1  TYR  65           1HD      TYR  65  -4.634  -2.075  -0.212
  495    HD2  TYR  65           2HD      TYR  65  -5.603  -2.882  -4.300
  496    HE1  TYR  65           1HE      TYR  65  -3.892   0.269  -0.858
  497    HE2  TYR  65           2HE      TYR  65  -4.858  -0.535  -4.932
  498    HH   TYR  65           HH       TYR  65  -4.585   1.596  -3.927
  499    H    ASP  66           H        ASP  66  -6.361  -5.403  -3.932
  500    HA   ASP  66           HA       ASP  66  -8.294  -7.399  -3.959
  501   1HB   ASP  66          1HB       ASP  66  -6.848  -6.536  -5.897
  502   2HB   ASP  66          2HB       ASP  66  -5.530  -7.492  -5.249
  503    H    GLY  67           H        GLY  67  -7.930  -8.021  -1.545
  504   1HA   GLY  67          1HA       GLY  67  -7.385  -9.745  -0.174
  505   2HA   GLY  67          2HA       GLY  67  -6.363 -10.427  -1.423
  506    H    VAL  68           H        VAL  68  -6.059  -7.028  -0.366
  507    HA   VAL  68           HA       VAL  68  -3.837  -7.686   1.369
  508    HB   VAL  68           HB       VAL  68  -3.509  -6.033  -1.143
  509   1HG1  VAL  68          1HG1      VAL  68  -1.536  -6.652   1.082
  510   2HG1  VAL  68          2HG1      VAL  68  -1.143  -5.834  -0.450
  511   3HG1  VAL  68          3HG1      VAL  68  -2.253  -5.066   0.711
  512   1HG2  VAL  68          1HG2      VAL  68  -2.512  -8.778  -0.350
  513   2HG2  VAL  68          2HG2      VAL  68  -3.438  -8.306  -1.795
  514   3HG2  VAL  68          3HG2      VAL  68  -1.737  -7.810  -1.627
  515    H    LYS  69           H        LYS  69  -3.057  -5.698   2.539
  516    HA   LYS  69           HA       LYS  69  -5.166  -3.655   2.587
  517   1HB   LYS  69          1HB       LYS  69  -4.953  -5.493   4.527
  518   2HB   LYS  69          2HB       LYS  69  -3.751  -4.364   5.117
  519   1HG   LYS  69          1HG       LYS  69  -5.655  -2.555   4.579
  520   2HG   LYS  69          2HG       LYS  69  -6.716  -3.943   4.718
  521   1HD   LYS  69          1HD       LYS  69  -4.653  -3.586   6.878
  522   2HD   LYS  69          2HD       LYS  69  -5.984  -2.446   6.857
  523   1HE   LYS  69          1HE       LYS  69  -7.302  -4.868   6.476
  524   2HE   LYS  69          2HE       LYS  69  -5.988  -5.337   7.536
  525   1HZ   LYS  69          1HZ       LYS  69  -8.166  -3.501   8.042
  526   2HZ   LYS  69          2HZ       LYS  69  -7.489  -4.610   9.032
  527   3HZ   LYS  69          3HZ       LYS  69  -6.739  -3.184   8.769
  528    H    VAL  70           H        VAL  70  -4.423  -1.516   3.364
  529    HA   VAL  70           HA       VAL  70  -1.529  -1.172   3.233
  530    HB   VAL  70           HB       VAL  70  -3.568  -0.077   1.340
  531   1HG1  VAL  70          1HG1      VAL  70  -1.016   1.362   2.141
  532   2HG1  VAL  70          2HG1      VAL  70  -2.019   1.762   0.726
  533   3HG1  VAL  70          3HG1      VAL  70  -2.684   1.941   2.368
  534   1HG2  VAL  70          1HG2      VAL  70  -1.392  -1.850   1.173
  535   2HG2  VAL  70          2HG2      VAL  70  -2.345  -1.175  -0.170
  536   3HG2  VAL  70          3HG2      VAL  70  -0.855  -0.359   0.361
  537    H    VAL  71           H        VAL  71  -0.834   0.921   4.154
  538    HA   VAL  71           HA       VAL  71  -2.886   2.355   5.620
  539    HB   VAL  71           HB       VAL  71  -2.205   1.845   7.715
  540   1HG1  VAL  71          1HG1      VAL  71  -1.639  -0.580   7.916
  541   2HG1  VAL  71          2HG1      VAL  71  -2.995  -0.251   6.811
  542   3HG1  VAL  71          3HG1      VAL  71  -1.383  -0.627   6.155
  543   1HG2  VAL  71          1HG2      VAL  71   0.083   1.041   8.319
  544   2HG2  VAL  71          2HG2      VAL  71   0.545   1.194   6.607
  545   3HG2  VAL  71          3HG2      VAL  71   0.069   2.638   7.533
  546    H    ILE  72           H        ILE  72  -2.536   4.407   4.945
  547    HA   ILE  72           HA       ILE  72   0.210   5.186   4.355
  548    HB   ILE  72           HB       ILE  72  -2.240   6.841   3.845
  549   1HG1  ILE  72          1HG1      ILE  72  -1.207   4.762   1.907
  550   2HG1  ILE  72          2HG1      ILE  72  -2.532   4.443   3.008
  551   1HG2  ILE  72          1HG2      ILE  72   0.588   6.963   3.191
  552   2HG2  ILE  72          2HG2      ILE  72  -0.432   7.034   1.734
  553   3HG2  ILE  72          3HG2      ILE  72  -0.677   8.208   3.050
  554   1HD1  ILE  72          1HD1      ILE  72  -3.352   5.211   0.788
  555   2HD1  ILE  72          2HD1      ILE  72  -3.808   6.352   2.076
  556   3HD1  ILE  72          3HD1      ILE  72  -2.451   6.733   0.988
  557    H    ASP  73           H        ASP  73   0.921   7.402   5.091
  558    HA   ASP  73           HA       ASP  73   0.475   7.540   7.880
  559   1HB   ASP  73          1HB       ASP  73   2.141   9.042   5.853
  560   2HB   ASP  73          2HB       ASP  73   1.917   9.757   7.437
  561    HA   PRO  74           HA       PRO  74  -2.578  10.687   7.726
  562   1HB   PRO  74          1HB       PRO  74  -2.327  11.812  10.204
  563   2HB   PRO  74          2HB       PRO  74  -3.194  10.317   9.914
  564   1HG   PRO  74          1HG       PRO  74  -0.526  10.708  11.127
  565   2HG   PRO  74          2HG       PRO  74  -1.576   9.307  11.211
  566   1HD   PRO  74          1HD       PRO  74   0.766   9.600   9.582
  567   2HD   PRO  74          2HD       PRO  74  -0.349   8.248   9.582
  568    H    PHE  75           H        PHE  75   0.700  11.506   8.277
  569    HA   PHE  75           HA       PHE  75   0.118  14.307   7.753
  570   1HB   PHE  75          1HB       PHE  75   2.241  12.596   8.961
  571   2HB   PHE  75          2HB       PHE  75   2.911  13.836   7.921
  572    HD1  PHE  75           1HD      PHE  75   1.534  16.217   8.329
  573    HD2  PHE  75           2HD      PHE  75   2.251  13.161  11.185
  574    HE1  PHE  75           1HE      PHE  75   1.306  17.895  10.182
  575    HE2  PHE  75           2HE      PHE  75   2.022  14.838  13.038
  576    HZ   PHE  75           HZ       PHE  75   1.553  17.185  12.514
  577    H    SER  76           H        SER  76   1.285  11.373   6.186
  578    HA   SER  76           HA       SER  76   2.460  12.903   4.047
  579   1HB   SER  76          1HB       SER  76   2.128   9.894   4.037
  580   2HB   SER  76          2HB       SER  76   3.379  10.858   3.277
  581    HG   SER  76           HG       SER  76   3.315  11.220   6.039
  582    H    MET  77           H        MET  77  -0.501  11.194   4.919
  583    HA   MET  77           HA       MET  77  -1.443  10.563   2.416
  584   1HB   MET  77          1HB       MET  77  -2.526  11.008   5.161
  585   2HB   MET  77          2HB       MET  77  -3.713  11.280   3.900
  586   1HG   MET  77          1HG       MET  77  -2.079   8.738   4.346
  587   2HG   MET  77          2HG       MET  77  -3.806   8.926   4.574
  588   1HE   MET  77          1HE       MET  77  -3.936  11.098   1.919
  589   2HE   MET  77          2HE       MET  77  -4.723   9.977   0.783
  590   3HE   MET  77          3HE       MET  77  -5.270  10.060   2.475
  591    HA   PRO  78           HA       PRO  78  -3.266  14.955   2.384
  592   1HB   PRO  78          1HB       PRO  78  -2.264  16.826   4.105
  593   2HB   PRO  78          2HB       PRO  78  -3.727  15.916   4.424
  594   1HG   PRO  78          1HG       PRO  78  -1.041  15.584   5.613
  595   2HG   PRO  78          2HG       PRO  78  -2.582  14.997   6.203
  596   1HD   PRO  78          1HD       PRO  78  -0.554  13.461   4.879
  597   2HD   PRO  78          2HD       PRO  78  -2.142  12.902   5.365
  598    H    TYR  79           H        TYR  79  -0.234  13.891   2.159
  599    HA   TYR  79           HA       TYR  79   0.755  16.343   0.913
  600   1HB   TYR  79          1HB       TYR  79   1.783  14.196   2.513
  601   2HB   TYR  79          2HB       TYR  79   2.424  13.887   0.912
  602    HD1  TYR  79           1HD      TYR  79   2.753  15.838   3.912
  603    HD2  TYR  79           2HD      TYR  79   3.743  15.758  -0.249
  604    HE1  TYR  79           1HE      TYR  79   4.589  17.551   4.309
  605    HE2  TYR  79           2HE      TYR  79   5.576  17.471   0.162
  606    HH   TYR  79           HH       TYR  79   5.868  19.102   3.211
  607    H    VAL  80           H        VAL  80  -0.644  13.220   0.179
  608    HA   VAL  80           HA       VAL  80  -0.228  13.783  -2.649
  609    HB   VAL  80           HB       VAL  80   0.614  11.671  -3.170
  610   1HG1  VAL  80          1HG1      VAL  80   2.718  11.652  -2.159
  611   2HG1  VAL  80          2HG1      VAL  80   2.165  13.324  -1.899
  612   3HG1  VAL  80          3HG1      VAL  80   2.074  12.140  -0.573
  613   1HG2  VAL  80          1HG2      VAL  80  -0.753  10.844  -0.762
  614   2HG2  VAL  80          2HG2      VAL  80  -0.168   9.861  -2.126
  615   3HG2  VAL  80          3HG2      VAL  80   0.917  10.228  -0.764
  616    H    ASN  81           H        ASN  81  -2.508  14.356  -1.135
  617    HA   ASN  81           HA       ASN  81  -4.331  12.439  -0.741
  618   1HB   ASN  81          1HB       ASN  81  -6.023  14.162  -1.011
  619   2HB   ASN  81          2HB       ASN  81  -4.589  14.965  -0.402
  620   1HD2  ASN  81          1HD2      ASN  81  -3.147  15.983  -1.952
  621   2HD2  ASN  81          2HD2      ASN  81  -3.791  16.711  -3.386
  622    H    GLY  82           H        GLY  82  -5.756  11.190  -2.064
  623   1HA   GLY  82          1HA       GLY  82  -6.189   9.980  -3.941
  624   2HA   GLY  82          2HA       GLY  82  -6.707  11.549  -4.524
  625    H    ALA  83           H        ALA  83  -3.304  10.778  -3.713
  626    HA   ALA  83           HA       ALA  83  -2.491  11.587  -6.329
  627   1HB   ALA  83          1HB       ALA  83  -1.185  12.156  -4.339
  628   2HB   ALA  83          2HB       ALA  83  -0.974  10.431  -3.955
  629   3HB   ALA  83          3HB       ALA  83  -0.222  11.116  -5.415
  630    H    GLU  84           H        GLU  84  -0.544   9.996  -7.230
  631    HA   GLU  84           HA       GLU  84  -1.702   7.326  -7.294
  632   1HB   GLU  84          1HB       GLU  84  -2.221   8.878  -9.350
  633   2HB   GLU  84          2HB       GLU  84  -0.546   8.604  -9.788
  634   1HG   GLU  84          1HG       GLU  84  -0.946   6.124  -9.712
  635   2HG   GLU  84          2HG       GLU  84  -2.627   6.417  -9.314
  636    H    LEU  85           H        LEU  85  -0.177   6.006  -6.399
  637    HA   LEU  85           HA       LEU  85   2.624   6.727  -6.766
  638   1HB   LEU  85          1HB       LEU  85   2.465   6.326  -4.570
  639   2HB   LEU  85          2HB       LEU  85   1.033   5.329  -4.733
  640    HG   LEU  85           HG       LEU  85   2.473   3.438  -5.489
  641   1HD1  LEU  85          1HD1      LEU  85   4.339   4.960  -6.293
  642   2HD1  LEU  85          2HD1      LEU  85   4.837   5.090  -4.589
  643   3HD1  LEU  85          3HD1      LEU  85   4.830   3.503  -5.396
  644   1HD2  LEU  85          1HD2      LEU  85   3.644   4.183  -2.871
  645   2HD2  LEU  85          2HD2      LEU  85   1.868   4.212  -2.978
  646   3HD2  LEU  85          3HD2      LEU  85   2.759   2.721  -3.367
  647    H    ASP  86           H        ASP  86   3.473   5.996  -8.651
  648    HA   ASP  86           HA       ASP  86   2.539   3.428  -9.599
  649   1HB   ASP  86          1HB       ASP  86   2.894   5.692 -10.982
  650   2HB   ASP  86          2HB       ASP  86   4.560   5.152 -11.049
  651    H    TYR  87           H        TYR  87   3.727   1.787  -8.552
  652    HA   TYR  87           HA       TYR  87   6.520   2.221  -7.947
  653   1HB   TYR  87          1HB       TYR  87   4.554   0.981  -6.630
  654   2HB   TYR  87          2HB       TYR  87   4.832  -0.334  -7.755
  655    HD1  TYR  87           1HD      TYR  87   6.818  -1.727  -7.602
  656    HD2  TYR  87           2HD      TYR  87   6.263   1.585  -4.950
  657    HE1  TYR  87           1HE      TYR  87   8.683  -2.599  -6.110
  658    HE2  TYR  87           2HE      TYR  87   8.130   0.701  -3.468
  659    HH   TYR  87           HH       TYR  87  10.306  -1.574  -4.476
  660    H    VAL  88           H        VAL  88   8.204   1.619  -9.217
  661    HA   VAL  88           HA       VAL  88   7.588   0.135 -11.628
  662    HB   VAL  88           HB       VAL  88  10.008   1.623 -10.610
  663   1HG1  VAL  88          1HG1      VAL  88   9.731  -0.271 -12.907
  664   2HG1  VAL  88          2HG1      VAL  88  10.688   1.210 -13.153
  665   3HG1  VAL  88          3HG1      VAL  88  11.132   0.068 -11.862
  666   1HG2  VAL  88          1HG2      VAL  88   8.721   2.324 -13.184
  667   2HG2  VAL  88          2HG2      VAL  88   7.734   2.607 -11.730
  668   3HG2  VAL  88          3HG2      VAL  88   9.335   3.370 -11.882
  669    H    VAL  89           H        VAL  89   8.429  -1.905 -12.155
  670    HA   VAL  89           HA       VAL  89   9.896  -3.234  -9.989
  671    HB   VAL  89           HB       VAL  89   7.693  -4.484 -11.636
  672   1HG1  VAL  89          1HG1      VAL  89   8.468  -6.405 -10.814
  673   2HG1  VAL  89          2HG1      VAL  89   9.726  -5.540  -9.898
  674   3HG1  VAL  89          3HG1      VAL  89   8.126  -5.818  -9.169
  675   1HG2  VAL  89          1HG2      VAL  89   7.476  -3.629  -8.738
  676   2HG2  VAL  89          2HG2      VAL  89   6.913  -2.621 -10.093
  677   3HG2  VAL  89          3HG2      VAL  89   6.188  -4.222  -9.813
  678    H    ASP  90           H        ASP  90  11.890  -3.685 -10.764
  679    HA   ASP  90           HA       ASP  90  12.104  -5.179 -13.148
  680   1HB   ASP  90          1HB       ASP  90  12.043  -2.522 -13.673
  681   2HB   ASP  90          2HB       ASP  90  13.735  -2.648 -13.238
  682    H    PHE  91           H        PHE  91  14.986  -4.120 -13.485
  683    HA   PHE  91           HA       PHE  91  16.278  -5.875 -11.809
  684   1HB   PHE  91          1HB       PHE  91  16.825  -3.723 -13.735
  685   2HB   PHE  91          2HB       PHE  91  17.983  -3.623 -12.424
  686    HD1  PHE  91           1HD      PHE  91  19.287  -5.760 -11.838
  687    HD2  PHE  91           2HD      PHE  91  17.127  -5.274 -15.457
  688    HE1  PHE  91           1HE      PHE  91  20.640  -7.593 -12.891
  689    HE2  PHE  91           2HE      PHE  91  18.479  -7.107 -16.511
  690    HZ   PHE  91           HZ       PHE  91  20.220  -8.244 -15.215
  691    H    MET  92           H        MET  92  14.846  -2.822 -11.044
  692    HA   MET  92           HA       MET  92  16.675  -2.245  -8.923
  693   1HB   MET  92          1HB       MET  92  14.374  -0.970 -10.303
  694   2HB   MET  92          2HB       MET  92  14.344  -0.690  -8.573
  695   1HG   MET  92          1HG       MET  92  16.393   0.480  -8.581
  696   2HG   MET  92          2HG       MET  92  16.959  -0.303 -10.042
  697   1HE   MET  92          1HE       MET  92  15.714   1.508 -12.902
  698   2HE   MET  92          2HE       MET  92  16.242  -0.035 -12.189
  699   3HE   MET  92          3HE       MET  92  14.506   0.312 -12.374
  700    H    GLY  93           H        GLY  93  14.667  -4.735  -9.196
  701   1HA   GLY  93          1HA       GLY  93  13.377  -5.975  -7.826
  702   2HA   GLY  93          2HA       GLY  93  14.449  -5.400  -6.564
  703    H    GLY  94           H        GLY  94  12.550  -3.025  -8.366
  704   1HA   GLY  94          1HA       GLY  94  10.285  -2.423  -7.753
  705   2HA   GLY  94          2HA       GLY  94  10.665  -2.835  -6.093
  706    H    GLY  95           H        GLY  95  10.265  -0.266  -8.186
  707   1HA   GLY  95          1HA       GLY  95  12.195   1.434  -6.725
  708   2HA   GLY  95          2HA       GLY  95  11.622   1.728  -8.355
  709    H    PHE  96           H        PHE  96  11.269   3.881  -6.912
  710    HA   PHE  96           HA       PHE  96   8.452   3.771  -6.100
  711   1HB   PHE  96          1HB       PHE  96  10.582   5.650  -4.959
  712   2HB   PHE  96          2HB       PHE  96   9.029   5.252  -4.251
  713    HD1  PHE  96           1HD      PHE  96   8.917   2.399  -4.157
  714    HD2  PHE  96           2HD      PHE  96  12.279   4.924  -3.586
  715    HE1  PHE  96           1HE      PHE  96  10.010   0.627  -2.755
  716    HE2  PHE  96           2HE      PHE  96  13.372   3.152  -2.184
  717    HZ   PHE  96           HZ       PHE  96  12.224   1.024  -1.785
  718    H    THR  97           H        THR  97   7.238   4.979  -7.470
  719    HA   THR  97           HA       THR  97   8.345   7.537  -8.361
  720    HB   THR  97           HB       THR  97   7.562   5.152 -10.038
  721    HG1  THR  97           1HG      THR  97   9.339   7.487 -10.145
  722   1HG2  THR  97          1HG2      THR  97   7.581   7.194 -11.876
  723   2HG2  THR  97          2HG2      THR  97   6.083   6.479 -11.236
  724   3HG2  THR  97          3HG2      THR  97   6.720   7.985 -10.534
  725    H    ILE  98           H        ILE  98   6.963   9.178  -8.083
  726    HA   ILE  98           HA       ILE  98   4.145   8.432  -7.709
  727    HB   ILE  98           HB       ILE  98   5.742  10.616  -6.367
  728   1HG1  ILE  98          1HG1      ILE  98   6.312   8.470  -5.442
  729   2HG1  ILE  98          2HG1      ILE  98   5.291   9.327  -4.304
  730   1HG2  ILE  98          1HG2      ILE  98   3.662  11.587  -6.516
  731   2HG2  ILE  98          2HG2      ILE  98   2.805  10.027  -6.473
  732   3HG2  ILE  98          3HG2      ILE  98   3.518  10.692  -4.984
  733   1HD1  ILE  98          1HD1      ILE  98   3.299   8.060  -5.418
  734   2HD1  ILE  98          2HD1      ILE  98   4.552   7.002  -6.111
  735   3HD1  ILE  98          3HD1      ILE  98   4.378   7.138  -4.345
  736    H    ARG  99           H        ARG  99   2.749   9.245  -9.178
  737    HA   ARG  99           HA       ARG  99   3.665  11.606 -10.613
  738   1HB   ARG  99          1HB       ARG  99   3.198   9.015 -11.688
  739   2HB   ARG  99          2HB       ARG  99   1.798   9.954 -12.165
  740   1HG   ARG  99          1HG       ARG  99   3.133  10.648 -13.892
  741   2HG   ARG  99          2HG       ARG  99   3.785  11.765 -12.710
  742   1HD   ARG  99          1HD       ARG  99   5.423   9.785 -12.092
  743   2HD   ARG  99          2HD       ARG  99   4.951   9.121 -13.644
  744    HE   ARG  99           HE       ARG  99   5.639  11.874 -14.017
  745   1HH1  ARG  99          2HH2      ARG  99   7.162   8.794 -13.256
  746   2HH1  ARG  99          1HH2      ARG  99   8.693   9.239 -13.934
  747   1HH2  ARG  99          2HH1      ARG  99   7.658  12.461 -14.912
  748   2HH2  ARG  99          1HH1      ARG  99   8.977  11.338 -14.882
  749    H    ASN 100           H        ASN 100   2.375  13.183  -9.630
  750    HA   ASN 100           HA       ASN 100  -0.211  12.633  -8.735
  751   1HB   ASN 100          1HB       ASN 100   1.510  15.080  -9.105
  752   2HB   ASN 100          2HB       ASN 100  -0.213  15.356  -8.944
  753   1HD2  ASN 100          1HD2      ASN 100   0.233  16.429  -6.981
  754   2HD2  ASN 100          2HD2      ASN 100   0.511  15.563  -5.507
  755    HA   PRO 101           HA       PRO 101  -2.446  13.444 -12.420
  756   1HB   PRO 101          1HB       PRO 101  -4.846  14.341 -11.471
  757   2HB   PRO 101          2HB       PRO 101  -4.409  12.644 -11.521
  758   1HG   PRO 101          1HG       PRO 101  -4.524  14.460  -9.191
  759   2HG   PRO 101          2HG       PRO 101  -4.511  12.708  -9.218
  760   1HD   PRO 101          1HD       PRO 101  -2.311  14.431  -8.570
  761   2HD   PRO 101          2HD       PRO 101  -2.268  12.685  -8.710
  Start of MODEL   18
    1    H    MET   1           H        MET   1 -18.826   7.734  19.473
    2    HA   MET   1           HA       MET   1 -19.736   5.039  19.243
    3   1HB   MET   1          1HB       MET   1 -20.692   6.800  17.332
    4   2HB   MET   1          2HB       MET   1 -19.188   6.312  16.576
    5   1HG   MET   1          1HG       MET   1 -19.926   4.165  16.181
    6   2HG   MET   1          2HG       MET   1 -20.747   4.050  17.724
    7   1HE   MET   1          1HE       MET   1 -22.556   2.798  16.789
    8   2HE   MET   1          2HE       MET   1 -23.449   3.992  17.762
    9   3HE   MET   1          3HE       MET   1 -24.024   3.562  16.134
   10    H    GLN   2           H        GLN   2 -18.076   3.614  18.281
   11    HA   GLN   2           HA       GLN   2 -15.542   4.324  19.076
   12   1HB   GLN   2          1HB       GLN   2 -16.691   2.117  17.368
   13   2HB   GLN   2          2HB       GLN   2 -14.949   2.288  17.457
   14   1HG   GLN   2          1HG       GLN   2 -15.956   2.532  20.139
   15   2HG   GLN   2          2HG       GLN   2 -16.754   1.150  19.417
   16   1HE2  GLN   2          1HE2      GLN   2 -15.773  -0.645  19.913
   17   2HE2  GLN   2          2HE2      GLN   2 -14.066  -0.936  19.968
   18    H    GLU   3           H        GLU   3 -14.389   6.016  18.227
   19    HA   GLU   3           HA       GLU   3 -14.676   6.590  15.431
   20   1HB   GLU   3          1HB       GLU   3 -13.681   7.993  17.844
   21   2HB   GLU   3          2HB       GLU   3 -12.740   8.325  16.404
   22   1HG   GLU   3          1HG       GLU   3 -14.647   9.161  15.208
   23   2HG   GLU   3          2HG       GLU   3 -15.778   8.457  16.346
   24    H    GLN   4           H        GLN   4 -13.330   5.818  13.860
   25    HA   GLN   4           HA       GLN   4 -10.735   4.847  14.779
   26   1HB   GLN   4          1HB       GLN   4 -12.508   3.740  12.557
   27   2HB   GLN   4          2HB       GLN   4 -10.880   3.184  12.888
   28   1HG   GLN   4          1HG       GLN   4 -12.047   3.051  15.409
   29   2HG   GLN   4          2HG       GLN   4 -13.397   2.642  14.369
   30   1HE2  GLN   4          1HE2      GLN   4 -10.875   1.431  16.064
   31   2HE2  GLN   4          2HE2      GLN   4 -10.600  -0.072  15.248
   32    H    ALA   5           H        ALA   5  -9.153   4.654  12.737
   33    HA   ALA   5           HA       ALA   5  -8.636   7.221  11.875
   34   1HB   ALA   5          1HB       ALA   5  -7.489   4.642  11.688
   35   2HB   ALA   5          2HB       ALA   5  -7.637   5.230  10.015
   36   3HB   ALA   5          3HB       ALA   5  -6.748   6.191  11.221
   37    H    GLN   6           H        GLN   6  -8.522   7.922   9.482
   38    HA   GLN   6           HA       GLN   6 -11.109   7.267   8.320
   39   1HB   GLN   6          1HB       GLN   6 -11.048   9.595   8.745
   40   2HB   GLN   6          2HB       GLN   6  -9.370   9.744   8.264
   41   1HG   GLN   6          1HG       GLN   6  -9.918   9.454   5.917
   42   2HG   GLN   6          2HG       GLN   6 -11.553   8.946   6.292
   43   1HE2  GLN   6          1HE2      GLN   6 -10.310  11.216   4.734
   44   2HE2  GLN   6          2HE2      GLN   6 -11.104  12.652   5.290
   45    H    GLN   7           H        GLN   7 -11.280   6.830   6.032
   46    HA   GLN   7           HA       GLN   7  -8.820   5.723   5.005
   47   1HB   GLN   7          1HB       GLN   7 -10.244   4.530   3.415
   48   2HB   GLN   7          2HB       GLN   7 -10.894   4.338   5.031
   49   1HG   GLN   7          1HG       GLN   7 -12.274   6.555   4.340
   50   2HG   GLN   7          2HG       GLN   7 -11.977   5.944   2.724
   51   1HE2  GLN   7          1HE2      GLN   7 -13.645   5.528   5.706
   52   2HE2  GLN   7          2HE2      GLN   7 -14.647   4.183   5.271
   53    H    PHE   8           H        PHE   8  -7.557   7.281   4.027
   54    HA   PHE   8           HA       PHE   8  -8.718   9.483   2.666
   55   1HB   PHE   8          1HB       PHE   8  -5.883   8.407   2.307
   56   2HB   PHE   8          2HB       PHE   8  -6.390  10.083   2.381
   57    HD1  PHE   8           1HD      PHE   8  -8.198   9.477   4.921
   58    HD2  PHE   8           2HD      PHE   8  -4.123   8.812   3.942
   59    HE1  PHE   8           1HE      PHE   8  -7.602   9.550   7.358
   60    HE2  PHE   8           2HE      PHE   8  -3.526   8.884   6.379
   61    HZ   PHE   8           HZ       PHE   8  -5.273   9.252   8.058
   62    H    ILE   9           H        ILE   9  -8.253  10.030   0.347
   63    HA   ILE   9           HA       ILE   9  -8.893   7.744  -1.280
   64    HB   ILE   9           HB       ILE   9  -8.631  10.694  -1.856
   65   1HG1  ILE   9          1HG1      ILE   9 -10.526  10.056  -0.419
   66   2HG1  ILE   9          2HG1      ILE   9 -11.044  10.679  -1.973
   67   1HG2  ILE   9          1HG2      ILE   9  -8.826   8.390  -3.677
   68   2HG2  ILE   9          2HG2      ILE   9 -10.044   9.659  -3.951
   69   3HG2  ILE   9          3HG2      ILE   9  -8.312  10.066  -3.984
   70   1HD1  ILE   9          1HD1      ILE   9 -11.058   8.154  -2.722
   71   2HD1  ILE   9          2HD1      ILE   9 -11.082   7.821  -0.974
   72   3HD1  ILE   9          3HD1      ILE   9 -12.394   8.766  -1.717
   73    H    PHE  10           H        PHE  10  -7.361   6.422  -2.084
   74    HA   PHE  10           HA       PHE  10  -5.053   7.588  -3.329
   75   1HB   PHE  10          1HB       PHE  10  -4.600   7.276  -0.777
   76   2HB   PHE  10          2HB       PHE  10  -4.793   5.554  -1.039
   77    HD1  PHE  10           1HD      PHE  10  -2.906   4.293  -1.462
   78    HD2  PHE  10           2HD      PHE  10  -2.833   8.435  -2.382
   79    HE1  PHE  10           1HE      PHE  10  -0.478   4.114  -2.075
   80    HE2  PHE  10           2HE      PHE  10  -0.405   8.256  -2.994
   81    HZ   PHE  10           HZ       PHE  10   0.743   6.098  -2.833
   82    H    LYS  11           H        LYS  11  -4.455   6.361  -5.080
   83    HA   LYS  11           HA       LYS  11  -5.417   3.588  -5.107
   84   1HB   LYS  11          1HB       LYS  11  -5.610   5.657  -7.311
   85   2HB   LYS  11          2HB       LYS  11  -5.819   3.939  -7.578
   86   1HG   LYS  11          1HG       LYS  11  -7.420   4.747  -5.288
   87   2HG   LYS  11          2HG       LYS  11  -7.765   5.814  -6.635
   88   1HD   LYS  11          1HD       LYS  11  -8.357   3.955  -8.079
   89   2HD   LYS  11          2HD       LYS  11  -7.715   2.782  -6.947
   90   1HE   LYS  11          1HE       LYS  11  -9.472   3.655  -5.257
   91   2HE   LYS  11          2HE       LYS  11 -10.196   4.520  -6.598
   92   1HZ   LYS  11          1HZ       LYS  11 -10.878   2.612  -7.547
   93   2HZ   LYS  11          2HZ       LYS  11  -9.625   1.716  -7.005
   94   3HZ   LYS  11          3HZ       LYS  11 -10.863   2.081  -6.003
   95    H    VAL  12           H        VAL  12  -3.825   2.125  -5.420
   96    HA   VAL  12           HA       VAL  12  -1.268   3.180  -6.390
   97    HB   VAL  12           HB       VAL  12  -1.746   1.965  -4.074
   98   1HG1  VAL  12          1HG1      VAL  12  -1.366  -0.385  -4.090
   99   2HG1  VAL  12          2HG1      VAL  12  -2.633  -0.074  -5.301
  100   3HG1  VAL  12          3HG1      VAL  12  -0.959  -0.381  -5.823
  101   1HG2  VAL  12          1HG2      VAL  12   0.398   2.805  -4.434
  102   2HG2  VAL  12          2HG2      VAL  12   0.685   1.056  -4.277
  103   3HG2  VAL  12          3HG2      VAL  12   0.656   1.812  -5.888
  104    H    THR  13           H        THR  13  -0.272   2.297  -8.196
  105    HA   THR  13           HA       THR  13  -1.875   1.115 -10.128
  106    HB   THR  13           HB       THR  13   0.429   0.689 -11.203
  107    HG1  THR  13           1HG      THR  13   2.154   0.991  -9.808
  108   1HG2  THR  13          1HG2      THR  13   0.986   3.027 -11.464
  109   2HG2  THR  13          2HG2      THR  13  -0.782   2.984 -11.266
  110   3HG2  THR  13          3HG2      THR  13   0.256   3.445  -9.896
  111    H    ASP  14           H        ASP  14  -2.027  -0.982 -11.013
  112    HA   ASP  14           HA       ASP  14  -2.367  -2.957  -9.197
  113   1HB   ASP  14          1HB       ASP  14  -2.236  -2.707 -12.117
  114   2HB   ASP  14          2HB       ASP  14  -1.620  -4.264 -11.604
  115    H    LYS  15           H        LYS  15   0.549  -1.921 -10.988
  116    HA   LYS  15           HA       LYS  15   2.093  -4.225 -10.531
  117   1HB   LYS  15          1HB       LYS  15   2.340  -1.920 -12.016
  118   2HB   LYS  15          2HB       LYS  15   3.533  -1.665 -10.758
  119   1HG   LYS  15          1HG       LYS  15   4.563  -3.870 -11.244
  120   2HG   LYS  15          2HG       LYS  15   3.332  -4.204 -12.445
  121   1HD   LYS  15          1HD       LYS  15   4.204  -1.807 -13.398
  122   2HD   LYS  15          2HD       LYS  15   5.671  -2.327 -12.592
  123   1HE   LYS  15          1HE       LYS  15   5.980  -4.160 -14.013
  124   2HE   LYS  15          2HE       LYS  15   4.266  -4.354 -14.320
  125   1HZ   LYS  15          1HZ       LYS  15   4.298  -2.493 -15.743
  126   2HZ   LYS  15          2HZ       LYS  15   5.815  -2.068 -15.314
  127   3HZ   LYS  15          3HZ       LYS  15   5.563  -3.427 -16.183
  128    H    ALA  16           H        ALA  16   1.520  -1.199  -8.678
  129    HA   ALA  16           HA       ALA  16   3.506  -1.699  -6.747
  130   1HB   ALA  16          1HB       ALA  16   2.323   0.060  -5.486
  131   2HB   ALA  16          2HB       ALA  16   2.505   0.517  -7.196
  132   3HB   ALA  16          3HB       ALA  16   0.936  -0.070  -6.595
  133    H    VAL  17           H        VAL  17  -0.059  -2.347  -6.873
  134    HA   VAL  17           HA       VAL  17  -0.145  -3.535  -4.324
  135    HB   VAL  17           HB       VAL  17  -1.899  -3.070  -6.611
  136   1HG1  VAL  17          1HG1      VAL  17  -2.030  -5.498  -6.686
  137   2HG1  VAL  17          2HG1      VAL  17  -2.338  -5.564  -4.935
  138   3HG1  VAL  17          3HG1      VAL  17  -3.541  -4.832  -6.023
  139   1HG2  VAL  17          1HG2      VAL  17  -3.143  -3.439  -3.995
  140   2HG2  VAL  17          2HG2      VAL  17  -1.738  -2.349  -3.927
  141   3HG2  VAL  17          3HG2      VAL  17  -3.082  -1.999  -5.040
  142    H    GLU  18           H        GLU  18  -0.017  -4.932  -7.674
  143    HA   GLU  18           HA       GLU  18  -0.014  -7.550  -6.935
  144   1HB   GLU  18          1HB       GLU  18  -0.175  -6.630  -9.276
  145   2HB   GLU  18          2HB       GLU  18   1.549  -6.320  -9.247
  146   1HG   GLU  18          1HG       GLU  18   1.920  -8.792  -8.763
  147   2HG   GLU  18          2HG       GLU  18   0.199  -9.046  -8.980
  148    H    GLU  19           H        GLU  19   2.607  -5.146  -6.811
  149    HA   GLU  19           HA       GLU  19   4.706  -6.955  -6.584
  150   1HB   GLU  19          1HB       GLU  19   5.251  -4.700  -7.121
  151   2HB   GLU  19          2HB       GLU  19   4.322  -4.056  -5.782
  152   1HG   GLU  19          1HG       GLU  19   6.674  -3.914  -5.187
  153   2HG   GLU  19          2HG       GLU  19   5.942  -5.146  -4.178
  154    H    ILE  20           H        ILE  20   2.397  -5.570  -4.231
  155    HA   ILE  20           HA       ILE  20   3.810  -6.397  -1.932
  156    HB   ILE  20           HB       ILE  20   0.839  -5.982  -2.098
  157   1HG1  ILE  20          1HG1      ILE  20   1.466  -4.110  -3.299
  158   2HG1  ILE  20          2HG1      ILE  20   1.481  -3.509  -1.653
  159   1HG2  ILE  20          1HG2      ILE  20   2.117  -4.698   0.106
  160   2HG2  ILE  20          2HG2      ILE  20   0.966  -6.055   0.113
  161   3HG2  ILE  20          3HG2      ILE  20   2.714  -6.372   0.006
  162   1HD1  ILE  20          1HD1      ILE  20   4.047  -4.393  -1.791
  163   2HD1  ILE  20          2HD1      ILE  20   3.771  -4.027  -3.511
  164   3HD1  ILE  20          3HD1      ILE  20   3.566  -2.752  -2.285
  165    H    LYS  21           H        LYS  21   1.530  -7.954  -4.180
  166    HA   LYS  21           HA       LYS  21   0.973 -10.151  -2.476
  167   1HB   LYS  21          1HB       LYS  21   0.644  -9.754  -5.464
  168   2HB   LYS  21          2HB       LYS  21   0.062 -11.154  -4.585
  169   1HG   LYS  21          1HG       LYS  21  -1.195  -9.497  -3.047
  170   2HG   LYS  21          2HG       LYS  21  -0.795  -8.252  -4.213
  171   1HD   LYS  21          1HD       LYS  21  -1.824 -10.436  -5.735
  172   2HD   LYS  21          2HD       LYS  21  -2.883 -10.283  -4.347
  173   1HE   LYS  21          1HE       LYS  21  -3.912  -8.609  -5.501
  174   2HE   LYS  21          2HE       LYS  21  -2.523  -7.623  -5.089
  175   1HZ   LYS  21          1HZ       LYS  21  -1.906  -9.230  -7.291
  176   2HZ   LYS  21          2HZ       LYS  21  -3.302  -8.436  -7.592
  177   3HZ   LYS  21          3HZ       LYS  21  -1.955  -7.600  -7.200
  178    H    LYS  22           H        LYS  22   3.395  -9.431  -5.031
  179    HA   LYS  22           HA       LYS  22   4.430 -12.063  -5.087
  180   1HB   LYS  22          1HB       LYS  22   4.924 -10.943  -7.018
  181   2HB   LYS  22          2HB       LYS  22   5.154  -9.403  -6.215
  182   1HG   LYS  22          1HG       LYS  22   7.376  -9.840  -5.689
  183   2HG   LYS  22          2HG       LYS  22   7.113 -11.563  -5.508
  184   1HD   LYS  22          1HD       LYS  22   8.367 -11.436  -7.507
  185   2HD   LYS  22          2HD       LYS  22   6.722 -11.587  -8.093
  186   1HE   LYS  22          1HE       LYS  22   6.887  -9.597  -9.168
  187   2HE   LYS  22          2HE       LYS  22   7.242  -8.780  -7.659
  188   1HZ   LYS  22          1HZ       LYS  22   8.960  -9.015  -9.657
  189   2HZ   LYS  22          2HZ       LYS  22   9.411  -8.789  -8.104
  190   3HZ   LYS  22          3HZ       LYS  22   9.422 -10.290  -8.747
  191    H    VAL  23           H        VAL  23   5.481  -8.988  -3.477
  192    HA   VAL  23           HA       VAL  23   7.743  -9.976  -2.267
  193    HB   VAL  23           HB       VAL  23   5.784  -7.794  -1.705
  194   1HG1  VAL  23          1HG1      VAL  23   6.300  -8.596   0.536
  195   2HG1  VAL  23          2HG1      VAL  23   8.042  -8.571   0.173
  196   3HG1  VAL  23          3HG1      VAL  23   7.125  -7.047   0.240
  197   1HG2  VAL  23          1HG2      VAL  23   7.301  -6.525  -2.751
  198   2HG2  VAL  23          2HG2      VAL  23   8.630  -7.149  -1.744
  199   3HG2  VAL  23          3HG2      VAL  23   8.123  -8.038  -3.200
  200    H    ALA  24           H        ALA  24   4.292 -10.195  -1.270
  201    HA   ALA  24           HA       ALA  24   4.895 -11.390   1.236
  202   1HB   ALA  24          1HB       ALA  24   2.810 -10.472   1.340
  203   2HB   ALA  24          2HB       ALA  24   2.509 -10.700  -0.400
  204   3HB   ALA  24          3HB       ALA  24   2.304 -12.064   0.725
  205    H    GLN  25           H        GLN  25   4.104 -12.562  -2.073
  206    HA   GLN  25           HA       GLN  25   3.680 -15.191  -1.439
  207   1HB   GLN  25          1HB       GLN  25   4.518 -13.672  -3.875
  208   2HB   GLN  25          2HB       GLN  25   4.824 -15.397  -3.908
  209   1HG   GLN  25          1HG       GLN  25   2.150 -14.813  -2.838
  210   2HG   GLN  25          2HG       GLN  25   2.363 -14.111  -4.430
  211   1HE2  GLN  25          1HE2      GLN  25   1.009 -16.583  -3.106
  212   2HE2  GLN  25          2HE2      GLN  25   1.343 -17.881  -4.203
  213    H    GLU  26           H        GLU  26   6.600 -13.306  -1.277
  214    HA   GLU  26           HA       GLU  26   8.258 -15.663  -1.443
  215   1HB   GLU  26          1HB       GLU  26   8.650 -13.004  -2.171
  216   2HB   GLU  26          2HB       GLU  26   9.548 -13.115  -0.670
  217   1HG   GLU  26          1HG       GLU  26  10.736 -15.151  -1.557
  218   2HG   GLU  26          2HG       GLU  26   9.869 -14.980  -3.070
  219    H    ASN  27           H        ASN  27   6.564 -13.733   0.886
  220    HA   ASN  27           HA       ASN  27   8.303 -14.730   2.994
  221   1HB   ASN  27          1HB       ASN  27   6.526 -12.328   2.675
  222   2HB   ASN  27          2HB       ASN  27   6.545 -13.043   4.276
  223   1HD2  ASN  27          1HD2      ASN  27   8.091 -11.005   2.100
  224   2HD2  ASN  27          2HD2      ASN  27   9.590 -10.750   2.928
  225    H    ASN  28           H        ASN  28   5.900 -15.947   1.287
  226    HA   ASN  28           HA       ASN  28   4.217 -17.282   1.583
  227   1HB   ASN  28          1HB       ASN  28   6.052 -18.088   3.453
  228   2HB   ASN  28          2HB       ASN  28   4.712 -17.718   4.520
  229   1HD2  ASN  28          1HD2      ASN  28   5.337 -20.188   4.636
  230   2HD2  ASN  28          2HD2      ASN  28   4.303 -21.246   3.735
  231    H    ILE  29           H        ILE  29   3.861 -14.394   2.161
  232    HA   ILE  29           HA       ILE  29   1.908 -14.431   4.336
  233    HB   ILE  29           HB       ILE  29   3.388 -12.228   2.913
  234   1HG1  ILE  29          1HG1      ILE  29   3.301 -13.035   5.835
  235   2HG1  ILE  29          2HG1      ILE  29   4.560 -13.499   4.708
  236   1HG2  ILE  29          1HG2      ILE  29   1.046 -12.008   4.816
  237   2HG2  ILE  29          2HG2      ILE  29   2.166 -10.673   4.457
  238   3HG2  ILE  29          3HG2      ILE  29   1.175 -11.376   3.157
  239   1HD1  ILE  29          1HD1      ILE  29   4.745 -10.906   4.230
  240   2HD1  ILE  29          2HD1      ILE  29   3.907 -10.751   5.793
  241   3HD1  ILE  29          3HD1      ILE  29   5.480 -11.580   5.705
  242    H    GLU  30           H        GLU  30  -0.256 -13.673   4.007
  243    HA   GLU  30           HA       GLU  30  -0.995 -13.562   1.190
  244   1HB   GLU  30          1HB       GLU  30  -1.699 -15.596   3.073
  245   2HB   GLU  30          2HB       GLU  30  -3.152 -14.658   2.789
  246   1HG   GLU  30          1HG       GLU  30  -3.064 -15.042   0.408
  247   2HG   GLU  30          2HG       GLU  30  -1.415 -15.630   0.485
  248    H    ASN  31           H        ASN  31  -0.603 -11.744   3.823
  249    HA   ASN  31           HA       ASN  31  -2.808 -10.055   3.092
  250   1HB   ASN  31          1HB       ASN  31  -3.052  -9.693   5.760
  251   2HB   ASN  31          2HB       ASN  31  -3.996 -10.902   4.912
  252   1HD2  ASN  31          1HD2      ASN  31  -1.936 -10.313   7.444
  253   2HD2  ASN  31          2HD2      ASN  31  -1.427 -11.923   7.830
  254    HA   PRO  32           HA       PRO  32   1.221  -8.090   4.148
  255   1HB   PRO  32          1HB       PRO  32   1.799  -6.998   1.711
  256   2HB   PRO  32          2HB       PRO  32   2.428  -8.546   2.241
  257   1HG   PRO  32          1HG       PRO  32   0.277  -7.989   0.292
  258   2HG   PRO  32          2HG       PRO  32   1.198  -9.462   0.519
  259   1HD   PRO  32          1HD       PRO  32  -1.494  -8.971   1.380
  260   2HD   PRO  32          2HD       PRO  32  -0.533 -10.399   1.707
  261    H    ILE  33           H        ILE  33   1.513  -6.070   4.977
  262    HA   ILE  33           HA       ILE  33  -0.727  -4.292   4.337
  263    HB   ILE  33           HB       ILE  33   0.905  -4.803   6.780
  264   1HG1  ILE  33          1HG1      ILE  33  -1.936  -4.017   6.938
  265   2HG1  ILE  33          2HG1      ILE  33  -1.640  -5.473   6.009
  266   1HG2  ILE  33          1HG2      ILE  33  -0.026  -2.135   5.864
  267   2HG2  ILE  33          2HG2      ILE  33  -0.347  -2.564   7.561
  268   3HG2  ILE  33          3HG2      ILE  33   1.320  -2.583   6.939
  269   1HD1  ILE  33          1HD1      ILE  33  -0.133  -6.225   7.999
  270   2HD1  ILE  33          2HD1      ILE  33  -0.929  -4.919   8.909
  271   3HD1  ILE  33          3HD1      ILE  33  -1.896  -6.254   8.238
  272    H    LEU  34           H        LEU  34  -0.269  -2.764   2.853
  273    HA   LEU  34           HA       LEU  34   2.510  -1.957   2.550
  274   1HB   LEU  34          1HB       LEU  34   1.251  -2.679   0.585
  275   2HB   LEU  34          2HB       LEU  34   0.061  -1.423   0.862
  276    HG   LEU  34           HG       LEU  34   1.820   0.297   0.505
  277   1HD1  LEU  34          1HD1      LEU  34   3.986  -0.178   0.449
  278   2HD1  LEU  34          2HD1      LEU  34   3.583  -1.865   0.850
  279   3HD1  LEU  34          3HD1      LEU  34   3.745  -1.369  -0.852
  280   1HD2  LEU  34          1HD2      LEU  34   0.829   0.246  -1.490
  281   2HD2  LEU  34          2HD2      LEU  34   2.216  -0.726  -2.037
  282   3HD2  LEU  34          3HD2      LEU  34   0.726  -1.531  -1.489
  283    H    ARG  35           H        ARG  35   3.224  -0.307   3.783
  284    HA   ARG  35           HA       ARG  35   1.244   1.660   4.565
  285   1HB   ARG  35          1HB       ARG  35   2.473   0.634   6.432
  286   2HB   ARG  35          2HB       ARG  35   4.013   0.993   5.677
  287   1HG   ARG  35          1HG       ARG  35   2.726   3.496   5.785
  288   2HG   ARG  35          2HG       ARG  35   2.278   2.736   7.299
  289   1HD   ARG  35          1HD       ARG  35   5.163   2.825   6.306
  290   2HD   ARG  35          2HD       ARG  35   4.476   4.087   7.308
  291    HE   ARG  35           HE       ARG  35   5.308   1.456   8.193
  292   1HH1  ARG  35          2HH2      ARG  35   2.951   3.995   8.813
  293   2HH1  ARG  35          1HH2      ARG  35   2.719   3.551  10.471
  294   1HH2  ARG  35          2HH1      ARG  35   5.002   0.870  10.380
  295   2HH2  ARG  35          1HH1      ARG  35   3.894   1.761  11.368
  296    H    ILE  36           H        ILE  36   1.331   3.731   3.708
  297    HA   ILE  36           HA       ILE  36   3.531   4.294   1.897
  298    HB   ILE  36           HB       ILE  36   0.741   5.242   2.269
  299   1HG1  ILE  36          1HG1      ILE  36   1.068   5.219  -0.340
  300   2HG1  ILE  36          2HG1      ILE  36   2.489   4.263   0.031
  301   1HG2  ILE  36          1HG2      ILE  36   1.612   7.380   2.369
  302   2HG2  ILE  36          2HG2      ILE  36   3.004   6.981   1.335
  303   3HG2  ILE  36          3HG2      ILE  36   1.384   7.150   0.619
  304   1HD1  ILE  36          1HD1      ILE  36   1.076   2.480   0.080
  305   2HD1  ILE  36          2HD1      ILE  36   0.550   3.101   1.663
  306   3HD1  ILE  36          3HD1      ILE  36  -0.361   3.523   0.194
  307    H    ARG  37           H        ARG  37   5.299   5.343   2.613
  308    HA   ARG  37           HA       ARG  37   4.838   7.315   4.701
  309   1HB   ARG  37          1HB       ARG  37   6.162   4.970   5.176
  310   2HB   ARG  37          2HB       ARG  37   7.507   5.933   4.598
  311   1HG   ARG  37          1HG       ARG  37   6.514   7.755   6.293
  312   2HG   ARG  37          2HG       ARG  37   5.788   6.350   7.048
  313   1HD   ARG  37          1HD       ARG  37   7.768   6.041   8.126
  314   2HD   ARG  37          2HD       ARG  37   8.431   5.523   6.588
  315    HE   ARG  37           HE       ARG  37   9.647   7.509   6.509
  316   1HH1  ARG  37          2HH2      ARG  37   6.859   7.992   8.600
  317   2HH1  ARG  37          1HH2      ARG  37   7.319   9.598   9.057
  318   1HH2  ARG  37          2HH1      ARG  37  10.255   9.628   7.111
  319   2HH2  ARG  37          1HH1      ARG  37   9.264  10.535   8.204
  320    H    VAL  38           H        VAL  38   6.459   9.120   4.699
  321    HA   VAL  38           HA       VAL  38   7.384   9.609   1.975
  322    HB   VAL  38           HB       VAL  38   7.366  11.607   4.214
  323   1HG1  VAL  38          1HG1      VAL  38   8.389  12.439   2.254
  324   2HG1  VAL  38          2HG1      VAL  38   7.153  11.715   1.198
  325   3HG1  VAL  38          3HG1      VAL  38   6.738  13.103   2.233
  326   1HG2  VAL  38          1HG2      VAL  38   4.981  12.126   3.093
  327   2HG2  VAL  38          2HG2      VAL  38   5.004  10.357   2.894
  328   3HG2  VAL  38          3HG2      VAL  38   5.171  11.073   4.516
  329    H    VAL  39           H        VAL  39   9.485   9.305   1.466
  330    HA   VAL  39           HA       VAL  39  11.475   9.848   3.515
  331    HB   VAL  39           HB       VAL  39  10.997   7.496   3.795
  332   1HG1  VAL  39          1HG1      VAL  39  11.969   6.447   1.285
  333   2HG1  VAL  39          2HG1      VAL  39  10.428   6.137   2.120
  334   3HG1  VAL  39          3HG1      VAL  39  10.573   7.515   1.004
  335   1HG2  VAL  39          1HG2      VAL  39  13.618   8.144   2.426
  336   2HG2  VAL  39          2HG2      VAL  39  13.275   8.035   4.169
  337   3HG2  VAL  39          3HG2      VAL  39  13.287   6.561   3.171
  338    HA   PRO  40           HA       PRO  40  13.358  11.551   0.008
  339   1HB   PRO  40          1HB       PRO  40  15.841  12.074   1.021
  340   2HB   PRO  40          2HB       PRO  40  14.460  13.119   1.284
  341   1HG   PRO  40          1HG       PRO  40  15.745  11.238   3.167
  342   2HG   PRO  40          2HG       PRO  40  14.666  12.574   3.515
  343   1HD   PRO  40          1HD       PRO  40  13.999   9.784   3.513
  344   2HD   PRO  40          2HD       PRO  40  12.895  11.125   3.746
  345    H    GLY  41           H        GLY  41  13.215   9.830  -1.446
  346   1HA   GLY  41          1HA       GLY  41  14.620   7.541  -1.475
  347   2HA   GLY  41          2HA       GLY  41  14.267   8.468  -2.920
  348    H    GLY  42           H        GLY  42  15.833  10.582  -3.074
  349   1HA   GLY  42          1HA       GLY  42  18.204  11.078  -2.236
  350   2HA   GLY  42          2HA       GLY  42  18.560   9.482  -2.866
  351    H    CYS  43           H        CYS  43  19.787   9.850  -4.688
  352    HA   CYS  43           HA       CYS  43  19.385  12.072  -6.351
  353   1HB   CYS  43          1HB       CYS  43  20.998  10.973  -7.855
  354   2HB   CYS  43          2HB       CYS  43  21.557  10.997  -6.195
  355    HG   CYS  43           HG       CYS  43  22.252   8.708  -6.628
  356    H    SER  44           H        SER  44  18.127   8.737  -6.210
  357    HA   SER  44           HA       SER  44  17.222   8.503  -8.788
  358   1HB   SER  44          1HB       SER  44  16.650   7.249  -6.163
  359   2HB   SER  44          2HB       SER  44  15.307   7.163  -7.285
  360    HG   SER  44           HG       SER  44  16.586   6.053  -8.786
  361    H    GLY  45           H        GLY  45  15.804  10.127  -5.914
  362   1HA   GLY  45          1HA       GLY  45  14.496  12.150  -6.752
  363   2HA   GLY  45          2HA       GLY  45  13.489  10.955  -7.545
  364    H    PHE  46           H        PHE  46  12.645  12.847  -5.473
  365    HA   PHE  46           HA       PHE  46  12.448  11.358  -3.034
  366   1HB   PHE  46          1HB       PHE  46  10.838  13.794  -3.973
  367   2HB   PHE  46          2HB       PHE  46  11.251  13.382  -2.320
  368    HD1  PHE  46           1HD      PHE  46  14.002  13.059  -2.111
  369    HD2  PHE  46           2HD      PHE  46  11.933  15.648  -4.763
  370    HE1  PHE  46           1HE      PHE  46  16.027  14.535  -2.251
  371    HE2  PHE  46           2HE      PHE  46  13.959  17.124  -4.902
  372    HZ   PHE  46           HZ       PHE  46  15.981  16.550  -3.645
  373    H    GLN  47           H        GLN  47  11.276   9.448  -3.314
  374    HA   GLN  47           HA       GLN  47   8.483   9.898  -3.965
  375   1HB   GLN  47          1HB       GLN  47  10.242   7.693  -5.122
  376   2HB   GLN  47          2HB       GLN  47   8.492   7.677  -5.210
  377   1HG   GLN  47          1HG       GLN  47   8.441   9.238  -6.879
  378   2HG   GLN  47          2HG       GLN  47   9.630  10.256  -6.090
  379   1HE2  GLN  47          1HE2      GLN  47  10.531  10.606  -8.165
  380   2HE2  GLN  47          2HE2      GLN  47  11.607   9.461  -8.894
  381    H    TYR  48           H        TYR  48   7.017   8.265  -3.009
  382    HA   TYR  48           HA       TYR  48   7.990   7.429  -0.446
  383   1HB   TYR  48          1HB       TYR  48   5.365   6.807  -1.925
  384   2HB   TYR  48          2HB       TYR  48   5.585   6.856  -0.187
  385    HD1  TYR  48           1HD      TYR  48   5.075   8.849  -3.218
  386    HD2  TYR  48           2HD      TYR  48   5.753   9.010   1.003
  387    HE1  TYR  48           1HE      TYR  48   4.351  11.286  -3.188
  388    HE2  TYR  48           2HE      TYR  48   5.027  11.447   1.019
  389    HH   TYR  48           HH       TYR  48   4.337  13.142  -1.993
  390    H    ALA  49           H        ALA  49   9.001   5.532  -0.041
  391    HA   ALA  49           HA       ALA  49   8.939   3.459  -2.032
  392   1HB   ALA  49          1HB       ALA  49  10.893   2.862  -1.070
  393   2HB   ALA  49          2HB       ALA  49  10.758   4.372  -0.136
  394   3HB   ALA  49          3HB       ALA  49  10.178   2.839   0.560
  395    H    MET  50           H        MET  50   8.396   1.174  -1.459
  396    HA   MET  50           HA       MET  50   6.087   1.195   0.317
  397   1HB   MET  50          1HB       MET  50   6.867  -0.374  -2.173
  398   2HB   MET  50          2HB       MET  50   5.698  -1.066  -1.066
  399   1HG   MET  50          1HG       MET  50   4.053   0.445  -1.638
  400   2HG   MET  50          2HG       MET  50   5.176   1.785  -1.759
  401   1HE   MET  50          1HE       MET  50   4.028  -1.516  -4.361
  402   2HE   MET  50          2HE       MET  50   5.790  -1.545  -4.609
  403   3HE   MET  50          3HE       MET  50   5.121  -1.656  -2.963
  404    H    GLY  51           H        GLY  51   5.639  -1.250   1.148
  405   1HA   GLY  51          1HA       GLY  51   7.876  -2.897   1.668
  406   2HA   GLY  51          2HA       GLY  51   7.609  -1.827   3.031
  407    H    PHE  52           H        PHE  52   7.223  -4.122   4.007
  408    HA   PHE  52           HA       PHE  52   4.338  -4.557   3.933
  409   1HB   PHE  52          1HB       PHE  52   5.068  -7.094   4.116
  410   2HB   PHE  52          2HB       PHE  52   5.130  -6.345   2.533
  411    HD1  PHE  52           1HD      PHE  52   7.460  -5.182   1.976
  412    HD2  PHE  52           2HD      PHE  52   6.915  -8.280   4.824
  413    HE1  PHE  52           1HE      PHE  52   9.889  -5.785   1.784
  414    HE2  PHE  52           2HE      PHE  52   9.344  -8.883   4.633
  415    HZ   PHE  52           HZ       PHE  52  10.802  -7.629   3.115
  416    H    ASP  53           H        ASP  53   3.484  -4.660   5.965
  417    HA   ASP  53           HA       ASP  53   5.378  -5.273   8.097
  418   1HB   ASP  53          1HB       ASP  53   3.022  -3.328   8.164
  419   2HB   ASP  53          2HB       ASP  53   4.035  -3.717   9.540
  420    H    ASP  54           H        ASP  54   3.895  -5.780  10.240
  421    HA   ASP  54           HA       ASP  54   1.574  -7.295   9.367
  422   1HB   ASP  54          1HB       ASP  54   3.667  -8.288  11.357
  423   2HB   ASP  54          2HB       ASP  54   2.229  -9.159  10.864
  424    H    THR  55           H        THR  55   0.825  -5.034  10.342
  425    HA   THR  55           HA       THR  55  -0.354  -5.458  12.812
  426    HB   THR  55           HB       THR  55   2.428  -4.770  13.027
  427    HG1  THR  55           1HG      THR  55   0.223  -4.547  14.944
  428   1HG2  THR  55          1HG2      THR  55   2.354  -2.718  14.326
  429   2HG2  THR  55          2HG2      THR  55   1.552  -2.355  12.779
  430   3HG2  THR  55          3HG2      THR  55   0.577  -2.657  14.237
  431    H    VAL  56           H        VAL  56  -1.329  -3.349  13.707
  432    HA   VAL  56           HA       VAL  56  -1.634  -1.409  11.537
  433    HB   VAL  56           HB       VAL  56  -3.574  -3.332  12.429
  434   1HG1  VAL  56          1HG1      VAL  56  -5.485  -1.795  12.790
  435   2HG1  VAL  56          2HG1      VAL  56  -4.266  -1.687  14.083
  436   3HG1  VAL  56          3HG1      VAL  56  -4.351  -0.424  12.832
  437   1HG2  VAL  56          1HG2      VAL  56  -4.884  -2.286  10.532
  438   2HG2  VAL  56          2HG2      VAL  56  -3.541  -1.134  10.342
  439   3HG2  VAL  56          3HG2      VAL  56  -3.259  -2.877  10.108
  440    H    GLU  57           H        GLU  57  -2.426   0.709  12.301
  441    HA   GLU  57           HA       GLU  57  -1.494   1.125  15.012
  442   1HB   GLU  57          1HB       GLU  57  -2.174   3.286  12.987
  443   2HB   GLU  57          2HB       GLU  57  -1.144   3.420  14.398
  444   1HG   GLU  57          1HG       GLU  57  -0.103   1.281  12.773
  445   2HG   GLU  57          2HG       GLU  57  -0.416   2.640  11.711
  446    H    GLU  58           H        GLU  58  -2.730   3.058  16.181
  447    HA   GLU  58           HA       GLU  58  -5.463   2.196  16.255
  448   1HB   GLU  58          1HB       GLU  58  -3.927   2.662  18.292
  449   2HB   GLU  58          2HB       GLU  58  -4.193   4.363  17.968
  450   1HG   GLU  58          1HG       GLU  58  -6.238   4.294  18.947
  451   2HG   GLU  58          2HG       GLU  58  -6.749   2.985  17.901
  452    H    GLY  59           H        GLY  59  -4.357   3.765  13.910
  453   1HA   GLY  59          1HA       GLY  59  -6.531   5.337  13.309
  454   2HA   GLY  59          2HA       GLY  59  -5.392   6.421  14.082
  455    H    ASP  60           H        ASP  60  -5.424   3.764  11.594
  456    HA   ASP  60           HA       ASP  60  -3.584   5.439  10.072
  457   1HB   ASP  60          1HB       ASP  60  -3.019   2.940  11.079
  458   2HB   ASP  60          2HB       ASP  60  -3.677   2.502   9.516
  459    H    HIS  61           H        HIS  61  -4.014   5.523   7.752
  460    HA   HIS  61           HA       HIS  61  -6.718   5.226   7.069
  461   1HB   HIS  61          1HB       HIS  61  -5.579   6.944   5.982
  462   2HB   HIS  61          2HB       HIS  61  -4.200   5.935   5.593
  463    HD1  HIS  61           1HD      HIS  61  -7.447   4.347   4.785
  464    HD2  HIS  61           2HD      HIS  61  -4.677   6.845   2.866
  465    HE1  HIS  61           1HE      HIS  61  -8.011   4.262   2.298
  466    H    VAL  62           H        VAL  62  -6.983   2.919   7.760
  467    HA   VAL  62           HA       VAL  62  -5.676   0.914   6.204
  468    HB   VAL  62           HB       VAL  62  -6.629   0.874   8.630
  469   1HG1  VAL  62          1HG1      VAL  62  -9.065  -0.147   7.143
  470   2HG1  VAL  62          2HG1      VAL  62  -8.856   0.058   8.899
  471   3HG1  VAL  62          3HG1      VAL  62  -8.954   1.486   7.841
  472   1HG2  VAL  62          1HG2      VAL  62  -7.314  -1.616   7.114
  473   2HG2  VAL  62          2HG2      VAL  62  -5.640  -1.013   7.045
  474   3HG2  VAL  62          3HG2      VAL  62  -6.379  -1.409   8.615
  475    H    PHE  63           H        PHE  63  -6.100   0.738   4.057
  476    HA   PHE  63           HA       PHE  63  -8.916   0.999   3.268
  477   1HB   PHE  63          1HB       PHE  63  -6.806   2.536   2.472
  478   2HB   PHE  63          2HB       PHE  63  -6.540   1.191   1.380
  479    HD1  PHE  63           1HD      PHE  63  -7.081   2.066  -0.711
  480    HD2  PHE  63           2HD      PHE  63  -9.779   2.627   2.515
  481    HE1  PHE  63           1HE      PHE  63  -8.779   3.017  -2.296
  482    HE2  PHE  63           2HE      PHE  63 -11.477   3.578   0.930
  483    HZ   PHE  63           HZ       PHE  63 -10.957   3.761  -1.457
  484    H    GLU  64           H        GLU  64  -9.805  -0.566   1.853
  485    HA   GLU  64           HA       GLU  64  -8.366  -3.051   1.923
  486   1HB   GLU  64          1HB       GLU  64 -11.186  -2.351   0.995
  487   2HB   GLU  64          2HB       GLU  64 -10.536  -3.978   1.011
  488   1HG   GLU  64          1HG       GLU  64 -10.252  -3.927   3.434
  489   2HG   GLU  64          2HG       GLU  64 -10.617  -2.214   3.499
  490    H    TYR  65           H        TYR  65  -7.649  -4.224   0.095
  491    HA   TYR  65           HA       TYR  65  -7.914  -2.812  -2.470
  492   1HB   TYR  65          1HB       TYR  65  -5.569  -3.853  -0.848
  493   2HB   TYR  65          2HB       TYR  65  -5.470  -4.099  -2.581
  494    HD1  TYR  65           1HD      TYR  65  -5.443  -1.611   0.119
  495    HD2  TYR  65           2HD      TYR  65  -5.251  -2.194  -4.115
  496    HE1  TYR  65           1HE      TYR  65  -4.586   0.764  -0.176
  497    HE2  TYR  65           2HE      TYR  65  -4.394   0.183  -4.396
  498    HH   TYR  65           HH       TYR  65  -4.315   2.204  -3.323
  499    H    ASP  66           H        ASP  66  -6.542  -4.651  -4.069
  500    HA   ASP  66           HA       ASP  66  -8.521  -6.570  -4.404
  501   1HB   ASP  66          1HB       ASP  66  -6.653  -5.556  -6.023
  502   2HB   ASP  66          2HB       ASP  66  -5.718  -6.936  -5.485
  503    H    GLY  67           H        GLY  67  -8.393  -7.394  -2.032
  504   1HA   GLY  67          1HA       GLY  67  -7.963  -9.129  -0.660
  505   2HA   GLY  67          2HA       GLY  67  -7.059  -9.897  -1.950
  506    H    VAL  68           H        VAL  68  -6.453  -6.646  -0.496
  507    HA   VAL  68           HA       VAL  68  -4.183  -7.681   0.963
  508    HB   VAL  68           HB       VAL  68  -3.853  -5.659  -1.262
  509   1HG1  VAL  68          1HG1      VAL  68  -1.344  -6.259  -0.625
  510   2HG1  VAL  68          2HG1      VAL  68  -2.245  -4.985   0.231
  511   3HG1  VAL  68          3HG1      VAL  68  -2.081  -6.601   0.959
  512   1HG2  VAL  68          1HG2      VAL  68  -2.994  -8.561  -1.051
  513   2HG2  VAL  68          2HG2      VAL  68  -4.101  -7.838  -2.243
  514   3HG2  VAL  68          3HG2      VAL  68  -2.370  -7.422  -2.268
  515    H    LYS  69           H        LYS  69  -3.378  -6.133   2.538
  516    HA   LYS  69           HA       LYS  69  -5.381  -4.060   3.070
  517   1HB   LYS  69          1HB       LYS  69  -4.127  -6.076   4.705
  518   2HB   LYS  69          2HB       LYS  69  -3.733  -4.490   5.336
  519   1HG   LYS  69          1HG       LYS  69  -6.359  -4.059   4.864
  520   2HG   LYS  69          2HG       LYS  69  -6.428  -5.801   5.038
  521   1HD   LYS  69          1HD       LYS  69  -5.079  -5.480   7.235
  522   2HD   LYS  69          2HD       LYS  69  -5.431  -3.771   7.079
  523   1HE   LYS  69          1HE       LYS  69  -7.947  -4.811   6.701
  524   2HE   LYS  69          2HE       LYS  69  -7.267  -6.033   7.758
  525   1HZ   LYS  69          1HZ       LYS  69  -7.837  -4.597   9.335
  526   2HZ   LYS  69          2HZ       LYS  69  -6.478  -3.783   8.938
  527   3HZ   LYS  69          3HZ       LYS  69  -7.919  -3.312   8.331
  528    H    VAL  70           H        VAL  70  -4.746  -1.916   3.487
  529    HA   VAL  70           HA       VAL  70  -1.895  -1.353   3.200
  530    HB   VAL  70           HB       VAL  70  -4.130  -0.419   1.432
  531   1HG1  VAL  70          1HG1      VAL  70  -1.622   1.120   2.140
  532   2HG1  VAL  70          2HG1      VAL  70  -2.496   1.365   0.609
  533   3HG1  VAL  70          3HG1      VAL  70  -3.312   1.679   2.159
  534   1HG2  VAL  70          1HG2      VAL  70  -1.803  -2.069   1.160
  535   2HG2  VAL  70          2HG2      VAL  70  -3.047  -1.681  -0.052
  536   3HG2  VAL  70          3HG2      VAL  70  -1.614  -0.639   0.117
  537    H    VAL  71           H        VAL  71  -1.300   0.785   4.053
  538    HA   VAL  71           HA       VAL  71  -3.378   2.104   5.598
  539    HB   VAL  71           HB       VAL  71  -2.436   1.801   7.663
  540   1HG1  VAL  71          1HG1      VAL  71  -1.638  -0.801   6.320
  541   2HG1  VAL  71          2HG1      VAL  71  -2.108  -0.557   8.020
  542   3HG1  VAL  71          3HG1      VAL  71  -3.313  -0.353   6.725
  543   1HG2  VAL  71          1HG2      VAL  71  -0.047   0.768   7.873
  544   2HG2  VAL  71          2HG2      VAL  71   0.142   1.309   6.188
  545   3HG2  VAL  71          3HG2      VAL  71  -0.225   2.491   7.467
  546    H    ILE  72           H        ILE  72  -2.810   4.300   6.167
  547    HA   ILE  72           HA       ILE  72  -0.283   5.261   5.103
  548    HB   ILE  72           HB       ILE  72  -2.885   6.503   4.226
  549   1HG1  ILE  72          1HG1      ILE  72  -1.135   4.622   2.615
  550   2HG1  ILE  72          2HG1      ILE  72  -2.660   4.172   3.352
  551   1HG2  ILE  72          1HG2      ILE  72  -1.622   8.145   3.439
  552   2HG2  ILE  72          2HG2      ILE  72  -0.200   7.389   4.197
  553   3HG2  ILE  72          3HG2      ILE  72  -0.631   6.989   2.517
  554   1HD1  ILE  72          1HD1      ILE  72  -2.895   6.659   1.794
  555   2HD1  ILE  72          2HD1      ILE  72  -2.334   5.288   0.808
  556   3HD1  ILE  72          3HD1      ILE  72  -3.867   5.171   1.705
  557    H    ASP  73           H        ASP  73   0.417   7.214   6.088
  558    HA   ASP  73           HA       ASP  73  -0.764   7.595   8.641
  559   1HB   ASP  73          1HB       ASP  73   1.759   8.090   7.374
  560   2HB   ASP  73          2HB       ASP  73   1.173   9.647   7.924
  561    HA   PRO  74           HA       PRO  74  -2.982  11.249   7.653
  562   1HB   PRO  74          1HB       PRO  74  -2.694  12.836   9.859
  563   2HB   PRO  74          2HB       PRO  74  -3.805  11.483   9.791
  564   1HG   PRO  74          1HG       PRO  74  -1.202  11.675  11.178
  565   2HG   PRO  74          2HG       PRO  74  -2.500  10.527  11.435
  566   1HD   PRO  74          1HD       PRO  74  -0.038  10.050  10.042
  567   2HD   PRO  74          2HD       PRO  74  -1.385   8.940  10.200
  568    H    PHE  75           H        PHE  75   0.347  11.592   8.358
  569    HA   PHE  75           HA       PHE  75   0.432  14.313   7.459
  570   1HB   PHE  75          1HB       PHE  75   2.055  12.353   8.841
  571   2HB   PHE  75          2HB       PHE  75   2.964  12.827   7.419
  572    HD1  PHE  75           1HD      PHE  75   1.781  13.845  10.684
  573    HD2  PHE  75           2HD      PHE  75   3.609  15.208   7.105
  574    HE1  PHE  75           1HE      PHE  75   2.552  15.920  11.867
  575    HE2  PHE  75           2HE      PHE  75   4.380  17.283   8.288
  576    HZ   PHE  75           HZ       PHE  75   3.842  17.614  10.656
  577    H    SER  76           H        SER  76   0.283  11.209   5.961
  578    HA   SER  76           HA       SER  76   1.828  12.041   3.686
  579   1HB   SER  76          1HB       SER  76   0.370   9.494   4.457
  580   2HB   SER  76          2HB       SER  76   0.955   9.726   2.822
  581    HG   SER  76           HG       SER  76   2.683   8.770   3.785
  582    H    MET  77           H        MET  77  -1.447  12.136   4.860
  583    HA   MET  77           HA       MET  77  -2.872  11.872   2.529
  584   1HB   MET  77          1HB       MET  77  -3.323  12.616   5.237
  585   2HB   MET  77          2HB       MET  77  -3.899  13.991   4.317
  586   1HG   MET  77          1HG       MET  77  -4.732  11.102   3.762
  587   2HG   MET  77          2HG       MET  77  -5.667  12.219   4.737
  588   1HE   MET  77          1HE       MET  77  -3.954  12.280   0.904
  589   2HE   MET  77          2HE       MET  77  -4.709  10.830   1.607
  590   3HE   MET  77          3HE       MET  77  -5.546  11.735   0.323
  591    HA   PRO  78           HA       PRO  78  -2.221  16.534   1.916
  592   1HB   PRO  78          1HB       PRO  78  -0.376  17.866   3.430
  593   2HB   PRO  78          2HB       PRO  78  -2.086  17.831   3.813
  594   1HG   PRO  78          1HG       PRO  78   0.135  16.372   5.110
  595   2HG   PRO  78          2HG       PRO  78  -1.477  16.686   5.721
  596   1HD   PRO  78          1HD       PRO  78  -0.501  14.212   4.648
  597   2HD   PRO  78          2HD       PRO  78  -2.143  14.561   5.151
  598    H    TYR  79           H        TYR  79  -0.115  14.104   1.892
  599    HA   TYR  79           HA       TYR  79   1.758  15.608   0.194
  600   1HB   TYR  79          1HB       TYR  79   1.874  13.422   2.251
  601   2HB   TYR  79          2HB       TYR  79   2.824  13.075   0.820
  602    HD1  TYR  79           1HD      TYR  79   5.061  13.652   0.929
  603    HD2  TYR  79           2HD      TYR  79   2.225  16.012   3.094
  604    HE1  TYR  79           1HE      TYR  79   6.946  15.095   1.839
  605    HE2  TYR  79           2HE      TYR  79   4.119  17.447   3.997
  606    HH   TYR  79           HH       TYR  79   7.494  16.672   3.224
  607    H    VAL  80           H        VAL  80  -0.533  12.914   0.443
  608    HA   VAL  80           HA       VAL  80  -0.085  12.421  -2.411
  609    HB   VAL  80           HB       VAL  80  -0.266  10.069  -2.100
  610   1HG1  VAL  80          1HG1      VAL  80   1.673   9.742  -0.320
  611   2HG1  VAL  80          2HG1      VAL  80   1.975  10.529  -1.887
  612   3HG1  VAL  80          3HG1      VAL  80   1.750  11.517  -0.424
  613   1HG2  VAL  80          1HG2      VAL  80  -0.156   9.520   0.622
  614   2HG2  VAL  80          2HG2      VAL  80  -1.368  10.818   0.502
  615   3HG2  VAL  80          3HG2      VAL  80  -1.571   9.322  -0.440
  616    H    ASN  81           H        ASN  81  -1.924  14.274  -1.510
  617    HA   ASN  81           HA       ASN  81  -4.371  13.251  -0.787
  618   1HB   ASN  81          1HB       ASN  81  -5.281  15.418  -1.683
  619   2HB   ASN  81          2HB       ASN  81  -3.852  15.666  -0.700
  620   1HD2  ASN  81          1HD2      ASN  81  -5.330  16.126  -3.700
  621   2HD2  ASN  81          2HD2      ASN  81  -3.997  16.777  -4.594
  622    H    GLY  82           H        GLY  82  -5.254  11.535  -2.008
  623   1HA   GLY  82          1HA       GLY  82  -6.223  10.474  -3.735
  624   2HA   GLY  82          2HA       GLY  82  -6.408  12.034  -4.513
  625    H    ALA  83           H        ALA  83  -3.120  11.411  -3.665
  626    HA   ALA  83           HA       ALA  83  -2.405  11.212  -6.422
  627   1HB   ALA  83          1HB       ALA  83  -0.248  11.641  -5.665
  628   2HB   ALA  83          2HB       ALA  83  -1.217  12.373  -4.365
  629   3HB   ALA  83          3HB       ALA  83  -0.494  10.763  -4.137
  630    H    GLU  84           H        GLU  84  -1.101   9.454  -7.356
  631    HA   GLU  84           HA       GLU  84  -1.805   6.919  -6.094
  632   1HB   GLU  84          1HB       GLU  84  -1.414   7.593  -9.043
  633   2HB   GLU  84          2HB       GLU  84  -1.664   5.968  -8.434
  634   1HG   GLU  84          1HG       GLU  84  -3.897   6.341  -8.582
  635   2HG   GLU  84          2HG       GLU  84  -3.739   7.457  -7.240
  636    H    LEU  85           H        LEU  85  -0.203   5.251  -5.986
  637    HA   LEU  85           HA       LEU  85   2.513   6.282  -6.368
  638   1HB   LEU  85          1HB       LEU  85   2.566   5.737  -4.203
  639   2HB   LEU  85          2HB       LEU  85   1.181   4.669  -4.317
  640    HG   LEU  85           HG       LEU  85   2.639   2.898  -5.264
  641   1HD1  LEU  85          1HD1      LEU  85   5.211   3.611  -4.583
  642   2HD1  LEU  85          2HD1      LEU  85   4.537   3.567  -6.230
  643   3HD1  LEU  85          3HD1      LEU  85   4.570   5.098  -5.322
  644   1HD2  LEU  85          1HD2      LEU  85   4.147   3.363  -2.840
  645   2HD2  LEU  85          2HD2      LEU  85   2.429   3.766  -2.609
  646   3HD2  LEU  85          3HD2      LEU  85   2.894   2.149  -3.190
  647    H    ASP  86           H        ASP  86   3.322   5.713  -8.321
  648    HA   ASP  86           HA       ASP  86   2.469   3.182  -9.416
  649   1HB   ASP  86          1HB       ASP  86   2.578   5.428 -10.719
  650   2HB   ASP  86          2HB       ASP  86   4.320   5.238 -10.692
  651    H    TYR  87           H        TYR  87   3.732   1.547  -8.418
  652    HA   TYR  87           HA       TYR  87   6.540   2.022  -7.934
  653   1HB   TYR  87          1HB       TYR  87   4.806   0.742  -6.470
  654   2HB   TYR  87          2HB       TYR  87   4.764  -0.486  -7.720
  655    HD1  TYR  87           1HD      TYR  87   7.072   1.219  -5.330
  656    HD2  TYR  87           2HD      TYR  87   6.333  -2.246  -7.730
  657    HE1  TYR  87           1HE      TYR  87   9.045   0.038  -4.246
  658    HE2  TYR  87           2HE      TYR  87   8.310  -3.414  -6.638
  659    HH   TYR  87           HH       TYR  87  10.550  -1.708  -4.671
  660    H    VAL  88           H        VAL  88   8.044   1.752  -9.501
  661    HA   VAL  88           HA       VAL  88   7.394   0.289 -11.869
  662    HB   VAL  88           HB       VAL  88   9.855   1.712 -10.857
  663   1HG1  VAL  88          1HG1      VAL  88  10.657  -0.083 -12.258
  664   2HG1  VAL  88          2HG1      VAL  88   9.442   0.288 -13.506
  665   3HG1  VAL  88          3HG1      VAL  88  10.756   1.441 -13.173
  666   1HG2  VAL  88          1HG2      VAL  88   8.404   3.388 -11.456
  667   2HG2  VAL  88          2HG2      VAL  88   9.174   3.076 -13.031
  668   3HG2  VAL  88          3HG2      VAL  88   7.572   2.389 -12.672
  669    H    VAL  89           H        VAL  89   8.517  -1.610 -12.662
  670    HA   VAL  89           HA       VAL  89   9.801  -3.155 -10.522
  671    HB   VAL  89           HB       VAL  89   7.816  -4.178 -12.562
  672   1HG1  VAL  89          1HG1      VAL  89   8.679  -5.750 -10.166
  673   2HG1  VAL  89          2HG1      VAL  89   8.157  -6.306 -11.775
  674   3HG1  VAL  89          3HG1      VAL  89   9.793  -5.641 -11.549
  675   1HG2  VAL  89          1HG2      VAL  89   7.502  -3.656  -9.587
  676   2HG2  VAL  89          2HG2      VAL  89   6.654  -2.834 -10.919
  677   3HG2  VAL  89          3HG2      VAL  89   6.337  -4.554 -10.590
  678    H    ASP  90           H        ASP  90  11.827  -3.771 -11.066
  679    HA   ASP  90           HA       ASP  90  12.372  -4.658 -13.689
  680   1HB   ASP  90          1HB       ASP  90  13.654  -2.063 -12.710
  681   2HB   ASP  90          2HB       ASP  90  14.223  -2.971 -14.097
  682    H    PHE  91           H        PHE  91  15.159  -4.609 -13.698
  683    HA   PHE  91           HA       PHE  91  16.758  -5.946 -12.868
  684   1HB   PHE  91          1HB       PHE  91  16.724  -3.435 -11.833
  685   2HB   PHE  91          2HB       PHE  91  16.439  -4.291 -10.330
  686    HD1  PHE  91           1HD      PHE  91  18.688  -4.888 -13.261
  687    HD2  PHE  91           2HD      PHE  91  18.348  -4.404  -9.059
  688    HE1  PHE  91           1HE      PHE  91  21.155  -5.281 -13.017
  689    HE2  PHE  91           2HE      PHE  91  20.815  -4.797  -8.814
  690    HZ   PHE  91           HZ       PHE  91  22.189  -5.231 -10.796
  691    H    MET  92           H        MET  92  17.141  -6.000  -9.751
  692    HA   MET  92           HA       MET  92  15.603  -8.424  -9.462
  693   1HB   MET  92          1HB       MET  92  18.155  -7.339  -8.498
  694   2HB   MET  92          2HB       MET  92  17.202  -7.900  -7.138
  695   1HG   MET  92          1HG       MET  92  17.276 -10.125  -7.814
  696   2HG   MET  92          2HG       MET  92  17.291  -9.725  -9.520
  697   1HE   MET  92          1HE       MET  92  20.649 -11.645  -9.099
  698   2HE   MET  92          2HE       MET  92  19.253 -11.940  -8.034
  699   3HE   MET  92          3HE       MET  92  19.000 -11.639  -9.770
  700    H    GLY  93           H        GLY  93  14.292  -5.731  -9.349
  701   1HA   GLY  93          1HA       GLY  93  12.630  -6.174  -7.113
  702   2HA   GLY  93          2HA       GLY  93  13.775  -4.902  -6.735
  703    H    GLY  94           H        GLY  94  13.360  -2.830  -7.431
  704   1HA   GLY  94          1HA       GLY  94  12.249  -2.061  -9.828
  705   2HA   GLY  94          2HA       GLY  94  10.886  -2.300  -8.752
  706    H    GLY  95           H        GLY  95  10.786   0.165  -9.298
  707   1HA   GLY  95          1HA       GLY  95  12.167   1.582  -7.115
  708   2HA   GLY  95          2HA       GLY  95  12.234   2.210  -8.750
  709    H    PHE  96           H        PHE  96  10.679   2.626  -5.877
  710    HA   PHE  96           HA       PHE  96   7.976   2.763  -6.722
  711   1HB   PHE  96          1HB       PHE  96   7.868   4.086  -4.493
  712   2HB   PHE  96          2HB       PHE  96   8.539   2.473  -4.363
  713    HD1  PHE  96           1HD      PHE  96  10.835   2.130  -3.768
  714    HD2  PHE  96           2HD      PHE  96   9.358   6.059  -4.396
  715    HE1  PHE  96           1HE      PHE  96  12.912   3.078  -2.725
  716    HE2  PHE  96           2HE      PHE  96  11.435   7.006  -3.352
  717    HZ   PHE  96           HZ       PHE  96  13.187   5.505  -2.529
  718    H    THR  97           H        THR  97   7.093   4.269  -8.050
  719    HA   THR  97           HA       THR  97   8.249   6.976  -7.949
  720    HB   THR  97           HB       THR  97   7.531   5.183 -10.304
  721    HG1  THR  97           1HG      THR  97   9.695   6.237 -10.849
  722   1HG2  THR  97          1HG2      THR  97   6.548   7.105 -11.204
  723   2HG2  THR  97          2HG2      THR  97   7.421   8.189 -10.094
  724   3HG2  THR  97          3HG2      THR  97   8.256   7.501 -11.508
  725    H    ILE  98           H        ILE  98   6.809   8.728  -8.198
  726    HA   ILE  98           HA       ILE  98   3.981   8.017  -8.225
  727    HB   ILE  98           HB       ILE  98   5.301   9.687  -6.083
  728   1HG1  ILE  98          1HG1      ILE  98   3.924   7.742  -4.783
  729   2HG1  ILE  98          2HG1      ILE  98   4.401   6.863  -6.222
  730   1HG2  ILE  98          1HG2      ILE  98   2.661   9.236  -5.361
  731   2HG2  ILE  98          2HG2      ILE  98   3.353  10.759  -5.968
  732   3HG2  ILE  98          3HG2      ILE  98   2.569   9.627  -7.095
  733   1HD1  ILE  98          1HD1      ILE  98   6.487   8.556  -4.855
  734   2HD1  ILE  98          2HD1      ILE  98   6.019   7.013  -4.101
  735   3HD1  ILE  98          3HD1      ILE  98   6.679   7.031  -5.754
  736    H    ARG  99           H        ARG  99   2.624   9.668  -9.064
  737    HA   ARG  99           HA       ARG  99   4.140  11.896 -10.167
  738   1HB   ARG  99          1HB       ARG  99   3.110   9.946 -11.721
  739   2HB   ARG  99          2HB       ARG  99   1.644  10.889 -11.542
  740   1HG   ARG  99          1HG       ARG  99   3.129  12.946 -12.211
  741   2HG   ARG  99          2HG       ARG  99   4.292  11.755 -12.760
  742   1HD   ARG  99          1HD       ARG  99   2.977  12.250 -14.694
  743   2HD   ARG  99          2HD       ARG  99   2.372  10.703 -14.137
  744    HE   ARG  99           HE       ARG  99   0.756  12.514 -12.807
  745   1HH1  ARG  99          2HH2      ARG  99   1.611  12.043 -16.188
  746   2HH1  ARG  99          1HH2      ARG  99   0.109  12.665 -16.787
  747   1HH2  ARG  99          2HH1      ARG  99  -1.226  13.334 -13.597
  748   2HH2  ARG  99          1HH1      ARG  99  -1.515  13.404 -15.303
  749    H    ASN 100           H        ASN 100   2.903  13.939 -10.414
  750    HA   ASN 100           HA       ASN 100   0.447  13.936  -8.853
  751   1HB   ASN 100          1HB       ASN 100   2.903  15.699  -8.572
  752   2HB   ASN 100          2HB       ASN 100   1.332  16.370  -8.181
  753   1HD2  ASN 100          1HD2      ASN 100   2.343  16.556  -6.054
  754   2HD2  ASN 100          2HD2      ASN 100   2.253  15.230  -4.944
  755    HA   PRO 101           HA       PRO 101  -0.737  16.169 -12.471
  756   1HB   PRO 101          1HB       PRO 101  -3.346  16.647 -11.812
  757   2HB   PRO 101          2HB       PRO 101  -2.799  15.146 -12.531
  758   1HG   PRO 101          1HG       PRO 101  -3.570  15.686  -9.729
  759   2HG   PRO 101          2HG       PRO 101  -3.436  14.145 -10.553
  760   1HD   PRO 101          1HD       PRO 101  -1.565  15.263  -8.688
  761   2HD   PRO 101          2HD       PRO 101  -1.376  13.778  -9.599
  Start of MODEL   19
    1    H    MET   1           H        MET   1 -13.508  -0.427  22.378
    2    HA   MET   1           HA       MET   1 -15.154  -1.099  20.132
    3   1HB   MET   1          1HB       MET   1 -15.894   0.940  22.246
    4   2HB   MET   1          2HB       MET   1 -16.241   1.356  20.579
    5   1HG   MET   1          1HG       MET   1 -17.455  -0.883  20.354
    6   2HG   MET   1          2HG       MET   1 -17.235  -1.115  22.077
    7   1HE   MET   1          1HE       MET   1 -21.020  -0.137  21.668
    8   2HE   MET   1          2HE       MET   1 -20.114  -0.791  20.282
    9   3HE   MET   1          3HE       MET   1 -19.846  -1.453  21.912
   10    H    GLN   2           H        GLN   2 -13.379  -0.838  18.753
   11    HA   GLN   2           HA       GLN   2 -12.706   1.848  18.176
   12   1HB   GLN   2          1HB       GLN   2 -11.137   0.855  20.154
   13   2HB   GLN   2          2HB       GLN   2 -10.248   0.239  18.775
   14   1HG   GLN   2          1HG       GLN   2  -9.397   2.293  18.322
   15   2HG   GLN   2          2HG       GLN   2 -11.000   2.999  18.259
   16   1HE2  GLN   2          1HE2      GLN   2 -11.912   3.937  20.062
   17   2HE2  GLN   2          2HE2      GLN   2 -11.010   4.365  21.477
   18    H    GLU   3           H        GLU   3 -12.443   1.973  15.978
   19    HA   GLU   3           HA       GLU   3 -11.226  -0.254  14.631
   20   1HB   GLU   3          1HB       GLU   3 -14.042  -0.084  14.767
   21   2HB   GLU   3          2HB       GLU   3 -13.645   0.532  13.176
   22   1HG   GLU   3          1HG       GLU   3 -12.310  -1.504  12.688
   23   2HG   GLU   3          2HG       GLU   3 -12.608  -2.111  14.305
   24    H    GLN   4           H        GLN   4 -10.621   0.300  12.360
   25    HA   GLN   4           HA       GLN   4  -9.828   3.014  12.252
   26   1HB   GLN   4          1HB       GLN   4  -8.411   1.130  11.430
   27   2HB   GLN   4          2HB       GLN   4  -9.581   0.799  10.169
   28   1HG   GLN   4          1HG       GLN   4  -7.707   2.171   9.299
   29   2HG   GLN   4          2HG       GLN   4  -9.223   3.044   9.191
   30   1HE2  GLN   4          1HE2      GLN   4  -8.399   5.064   9.249
   31   2HE2  GLN   4          2HE2      GLN   4  -7.616   5.777  10.620
   32    H    ALA   5           H        ALA   5 -11.968   4.066  12.268
   33    HA   ALA   5           HA       ALA   5 -13.757   3.582  10.099
   34   1HB   ALA   5          1HB       ALA   5 -15.045   4.437  11.743
   35   2HB   ALA   5          2HB       ALA   5 -13.643   5.142  12.583
   36   3HB   ALA   5          3HB       ALA   5 -14.421   6.030  11.251
   37    H    GLN   6           H        GLN   6 -14.472   5.498   8.664
   38    HA   GLN   6           HA       GLN   6 -14.037   6.987   7.142
   39   1HB   GLN   6          1HB       GLN   6 -13.233   8.498   8.866
   40   2HB   GLN   6          2HB       GLN   6 -11.678   7.692   8.935
   41   1HG   GLN   6          1HG       GLN   6 -10.976   8.566   6.848
   42   2HG   GLN   6          2HG       GLN   6 -12.616   8.862   6.303
   43   1HE2  GLN   6          1HE2      GLN   6 -13.308  10.854   6.349
   44   2HE2  GLN   6          2HE2      GLN   6 -12.714  12.152   7.329
   45    H    GLN   7           H        GLN   7 -13.194   6.797   5.068
   46    HA   GLN   7           HA       GLN   7 -10.780   5.170   4.874
   47   1HB   GLN   7          1HB       GLN   7 -11.699   4.121   2.858
   48   2HB   GLN   7          2HB       GLN   7 -12.805   3.895   4.198
   49   1HG   GLN   7          1HG       GLN   7 -13.876   6.174   3.280
   50   2HG   GLN   7          2HG       GLN   7 -13.085   5.699   1.790
   51   1HE2  GLN   7          1HE2      GLN   7 -15.207   5.532   0.911
   52   2HE2  GLN   7          2HE2      GLN   7 -16.169   4.111   1.145
   53    H    PHE   8           H        PHE   8  -9.120   6.418   4.136
   54    HA   PHE   8           HA       PHE   8  -9.621   8.884   2.835
   55   1HB   PHE   8          1HB       PHE   8  -7.230   9.071   3.031
   56   2HB   PHE   8          2HB       PHE   8  -7.649   8.020   4.370
   57    HD1  PHE   8           1HD      PHE   8  -8.142   5.497   2.727
   58    HD2  PHE   8           2HD      PHE   8  -5.007   8.357   2.674
   59    HE1  PHE   8           1HE      PHE   8  -6.565   3.752   1.851
   60    HE2  PHE   8           2HE      PHE   8  -3.430   6.611   1.798
   61    HZ   PHE   8           HZ       PHE   8  -4.228   4.330   1.397
   62    H    ILE   9           H        ILE   9  -8.805   9.516   0.680
   63    HA   ILE   9           HA       ILE   9  -9.395   7.429  -1.231
   64    HB   ILE   9           HB       ILE   9  -8.811  10.370  -1.598
   65   1HG1  ILE   9          1HG1      ILE   9 -10.873   9.656  -0.220
   66   2HG1  ILE   9          2HG1      ILE   9 -11.087  10.805  -1.526
   67   1HG2  ILE   9          1HG2      ILE   9 -10.030   9.920  -3.807
   68   2HG2  ILE   9          2HG2      ILE   9  -8.344   9.369  -3.662
   69   3HG2  ILE   9          3HG2      ILE   9  -9.677   8.201  -3.506
   70   1HD1  ILE   9          1HD1      ILE   9 -11.590   7.799  -1.718
   71   2HD1  ILE   9          2HD1      ILE   9 -12.840   9.061  -1.600
   72   3HD1  ILE   9          3HD1      ILE   9 -11.806   8.966  -3.045
   73    H    PHE  10           H        PHE  10  -7.950   6.513  -2.686
   74    HA   PHE  10           HA       PHE  10  -5.289   7.551  -2.885
   75   1HB   PHE  10          1HB       PHE  10  -5.517   6.091  -0.710
   76   2HB   PHE  10          2HB       PHE  10  -5.785   4.729  -1.779
   77    HD1  PHE  10           1HD      PHE  10  -3.919   3.374  -1.657
   78    HD2  PHE  10           2HD      PHE  10  -3.371   7.568  -1.996
   79    HE1  PHE  10           1HE      PHE  10  -1.439   3.035  -1.848
   80    HE2  PHE  10           2HE      PHE  10  -0.891   7.229  -2.187
   81    HZ   PHE  10           HZ       PHE  10   0.045   4.967  -2.111
   82    H    LYS  11           H        LYS  11  -4.156   6.688  -4.697
   83    HA   LYS  11           HA       LYS  11  -5.613   4.650  -6.210
   84   1HB   LYS  11          1HB       LYS  11  -4.634   7.299  -7.317
   85   2HB   LYS  11          2HB       LYS  11  -5.223   5.963  -8.285
   86   1HG   LYS  11          1HG       LYS  11  -7.034   6.757  -6.054
   87   2HG   LYS  11          2HG       LYS  11  -6.808   7.992  -7.277
   88   1HD   LYS  11          1HD       LYS  11  -8.083   6.863  -8.784
   89   2HD   LYS  11          2HD       LYS  11  -7.188   5.377  -8.534
   90   1HE   LYS  11          1HE       LYS  11  -8.532   4.862  -6.518
   91   2HE   LYS  11          2HE       LYS  11  -9.373   6.393  -6.654
   92   1HZ   LYS  11          1HZ       LYS  11  -9.757   5.360  -9.067
   93   2HZ   LYS  11          2HZ       LYS  11  -9.727   3.994  -8.173
   94   3HZ   LYS  11          3HZ       LYS  11 -10.800   5.174  -7.824
   95    H    VAL  12           H        VAL  12  -4.276   2.961  -6.518
   96    HA   VAL  12           HA       VAL  12  -1.453   3.583  -7.008
   97    HB   VAL  12           HB       VAL  12  -2.307   2.610  -4.645
   98   1HG1  VAL  12          1HG1      VAL  12  -2.072   0.232  -4.503
   99   2HG1  VAL  12          2HG1      VAL  12  -3.234   0.572  -5.807
  100   3HG1  VAL  12          3HG1      VAL  12  -1.559   0.119  -6.204
  101   1HG2  VAL  12          1HG2      VAL  12   0.038   1.574  -4.476
  102   2HG2  VAL  12          2HG2      VAL  12   0.254   2.091  -6.165
  103   3HG2  VAL  12          3HG2      VAL  12  -0.069   3.299  -4.899
  104    H    THR  13           H        THR  13  -0.588   2.541  -8.763
  105    HA   THR  13           HA       THR  13  -2.305   1.272 -10.570
  106    HB   THR  13           HB       THR  13   0.082   0.633 -11.549
  107    HG1  THR  13           1HG      THR  13   1.049   0.966  -9.371
  108   1HG2  THR  13          1HG2      THR  13  -0.889   2.536 -12.595
  109   2HG2  THR  13          2HG2      THR  13  -1.005   3.430 -11.060
  110   3HG2  THR  13          3HG2      THR  13   0.577   3.216 -11.848
  111    H    ASP  14           H        ASP  14  -1.812  -0.973 -11.537
  112    HA   ASP  14           HA       ASP  14  -2.415  -2.802  -9.523
  113   1HB   ASP  14          1HB       ASP  14  -2.030  -2.796 -12.460
  114   2HB   ASP  14          2HB       ASP  14  -1.561  -4.314 -11.721
  115    H    LYS  15           H        LYS  15   0.561  -1.661 -11.072
  116    HA   LYS  15           HA       LYS  15   2.184  -3.889 -10.507
  117   1HB   LYS  15          1HB       LYS  15   2.430  -1.547 -11.941
  118   2HB   LYS  15          2HB       LYS  15   3.507  -1.263 -10.590
  119   1HG   LYS  15          1HG       LYS  15   4.489  -3.608 -11.043
  120   2HG   LYS  15          2HG       LYS  15   3.574  -3.607 -12.537
  121   1HD   LYS  15          1HD       LYS  15   4.725  -1.263 -12.953
  122   2HD   LYS  15          2HD       LYS  15   5.863  -1.789 -11.728
  123   1HE   LYS  15          1HE       LYS  15   6.968  -2.793 -13.460
  124   2HE   LYS  15          2HE       LYS  15   5.747  -4.042 -13.322
  125   1HZ   LYS  15          1HZ       LYS  15   5.813  -3.296 -15.543
  126   2HZ   LYS  15          2HZ       LYS  15   4.414  -2.737 -14.911
  127   3HZ   LYS  15          3HZ       LYS  15   5.677  -1.724 -15.120
  128    H    ALA  16           H        ALA  16   1.467  -0.820  -8.737
  129    HA   ALA  16           HA       ALA  16   3.248  -1.256  -6.642
  130   1HB   ALA  16          1HB       ALA  16   0.580   0.126  -6.315
  131   2HB   ALA  16          2HB       ALA  16   2.164   0.561  -5.628
  132   3HB   ALA  16          3HB       ALA  16   1.840   0.827  -7.358
  133    H    VAL  17           H        VAL  17  -0.265  -2.093  -7.002
  134    HA   VAL  17           HA       VAL  17  -0.507  -3.279  -4.488
  135    HB   VAL  17           HB       VAL  17  -2.016  -3.089  -6.998
  136   1HG1  VAL  17          1HG1      VAL  17  -2.178  -5.418  -7.054
  137   2HG1  VAL  17          2HG1      VAL  17  -2.191  -5.561  -5.280
  138   3HG1  VAL  17          3HG1      VAL  17  -3.623  -4.937  -6.133
  139   1HG2  VAL  17          1HG2      VAL  17  -2.226  -1.969  -4.558
  140   2HG2  VAL  17          2HG2      VAL  17  -3.611  -2.176  -5.657
  141   3HG2  VAL  17          3HG2      VAL  17  -3.335  -3.344  -4.343
  142    H    GLU  18           H        GLU  18   0.406  -4.603  -7.721
  143    HA   GLU  18           HA       GLU  18   0.460  -7.247  -6.958
  144   1HB   GLU  18          1HB       GLU  18   1.492  -5.604  -9.188
  145   2HB   GLU  18          2HB       GLU  18   2.469  -7.026  -8.880
  146   1HG   GLU  18          1HG       GLU  18   0.031  -8.196  -8.734
  147   2HG   GLU  18          2HG       GLU  18  -0.402  -6.846  -9.764
  148    H    GLU  19           H        GLU  19   2.956  -4.659  -6.739
  149    HA   GLU  19           HA       GLU  19   5.100  -6.209  -6.091
  150   1HB   GLU  19          1HB       GLU  19   5.219  -3.784  -6.551
  151   2HB   GLU  19          2HB       GLU  19   4.369  -3.433  -5.059
  152   1HG   GLU  19          1HG       GLU  19   6.489  -3.216  -4.204
  153   2HG   GLU  19          2HG       GLU  19   6.394  -4.959  -4.053
  154    H    ILE  20           H        ILE  20   2.240  -5.396  -4.185
  155    HA   ILE  20           HA       ILE  20   3.453  -6.122  -1.686
  156    HB   ILE  20           HB       ILE  20   0.506  -5.874  -2.147
  157   1HG1  ILE  20          1HG1      ILE  20   1.096  -3.979  -3.341
  158   2HG1  ILE  20          2HG1      ILE  20   0.904  -3.355  -1.714
  159   1HG2  ILE  20          1HG2      ILE  20   2.426  -5.563   0.118
  160   2HG2  ILE  20          2HG2      ILE  20   0.956  -4.559   0.109
  161   3HG2  ILE  20          3HG2      ILE  20   0.822  -6.333   0.065
  162   1HD1  ILE  20          1HD1      ILE  20   3.571  -4.126  -1.706
  163   2HD1  ILE  20          2HD1      ILE  20   3.343  -3.556  -3.377
  164   3HD1  ILE  20          3HD1      ILE  20   2.985  -2.473  -2.010
  165    H    LYS  21           H        LYS  21   1.440  -7.629  -4.232
  166    HA   LYS  21           HA       LYS  21   0.843  -9.942  -2.717
  167   1HB   LYS  21          1HB       LYS  21   0.682  -9.222  -5.643
  168   2HB   LYS  21          2HB       LYS  21   0.319 -10.841  -5.082
  169   1HG   LYS  21          1HG       LYS  21  -1.740 -10.180  -4.407
  170   2HG   LYS  21          2HG       LYS  21  -1.034  -8.991  -3.331
  171   1HD   LYS  21          1HD       LYS  21  -2.394  -7.708  -4.805
  172   2HD   LYS  21          2HD       LYS  21  -0.767  -7.472  -5.411
  173   1HE   LYS  21          1HE       LYS  21  -1.479  -8.214  -7.434
  174   2HE   LYS  21          2HE       LYS  21  -1.671  -9.807  -6.730
  175   1HZ   LYS  21          1HZ       LYS  21  -3.900  -9.041  -5.995
  176   2HZ   LYS  21          2HZ       LYS  21  -3.703  -7.701  -6.908
  177   3HZ   LYS  21          3HZ       LYS  21  -3.729  -9.174  -7.614
  178    H    LYS  22           H        LYS  22   3.251  -9.238  -5.343
  179    HA   LYS  22           HA       LYS  22   4.446 -11.730  -5.327
  180   1HB   LYS  22          1HB       LYS  22   6.427 -10.456  -6.279
  181   2HB   LYS  22          2HB       LYS  22   4.904 -10.298  -7.132
  182   1HG   LYS  22          1HG       LYS  22   4.790  -8.059  -6.727
  183   2HG   LYS  22          2HG       LYS  22   5.150  -8.267  -5.024
  184   1HD   LYS  22          1HD       LYS  22   7.146  -8.095  -7.323
  185   2HD   LYS  22          2HD       LYS  22   6.946  -6.956  -6.006
  186   1HE   LYS  22          1HE       LYS  22   7.432  -9.198  -4.541
  187   2HE   LYS  22          2HE       LYS  22   8.284  -9.647  -6.006
  188   1HZ   LYS  22          1HZ       LYS  22   9.278  -8.089  -4.085
  189   2HZ   LYS  22          2HZ       LYS  22   9.837  -8.129  -5.618
  190   3HZ   LYS  22          3HZ       LYS  22   8.784  -6.967  -5.163
  191    H    VAL  23           H        VAL  23   4.903  -8.881  -3.204
  192    HA   VAL  23           HA       VAL  23   7.223  -9.877  -1.942
  193    HB   VAL  23           HB       VAL  23   5.165  -7.774  -1.331
  194   1HG1  VAL  23          1HG1      VAL  23   7.473  -8.633   0.442
  195   2HG1  VAL  23          2HG1      VAL  23   6.623  -7.076   0.591
  196   3HG1  VAL  23          3HG1      VAL  23   5.741  -8.600   0.851
  197   1HG2  VAL  23          1HG2      VAL  23   7.072  -7.569  -3.080
  198   2HG2  VAL  23          2HG2      VAL  23   6.818  -6.236  -1.928
  199   3HG2  VAL  23          3HG2      VAL  23   8.139  -7.400  -1.665
  200    H    ALA  24           H        ALA  24   3.781  -9.656  -0.775
  201    HA   ALA  24           HA       ALA  24   4.131 -11.151   1.504
  202   1HB   ALA  24          1HB       ALA  24   2.031 -10.329   1.583
  203   2HB   ALA  24          2HB       ALA  24   1.933 -10.199  -0.190
  204   3HB   ALA  24          3HB       ALA  24   1.555 -11.743   0.612
  205    H    GLN  25           H        GLN  25   3.177 -12.253  -1.820
  206    HA   GLN  25           HA       GLN  25   2.800 -14.865  -1.291
  207   1HB   GLN  25          1HB       GLN  25   3.752 -13.316  -3.672
  208   2HB   GLN  25          2HB       GLN  25   3.974 -15.053  -3.737
  209   1HG   GLN  25          1HG       GLN  25   1.497 -15.274  -3.053
  210   2HG   GLN  25          2HG       GLN  25   1.355 -13.548  -3.322
  211   1HE2  GLN  25          1HE2      GLN  25   0.801 -16.430  -4.666
  212   2HE2  GLN  25          2HE2      GLN  25   0.935 -16.077  -6.356
  213    H    GLU  26           H        GLU  26   5.902 -13.100  -1.640
  214    HA   GLU  26           HA       GLU  26   7.409 -15.515  -1.552
  215   1HB   GLU  26          1HB       GLU  26   7.920 -13.022  -2.533
  216   2HB   GLU  26          2HB       GLU  26   8.726 -12.890  -0.983
  217   1HG   GLU  26          1HG       GLU  26   9.228 -15.414  -2.527
  218   2HG   GLU  26          2HG       GLU  26   9.915 -13.948  -3.197
  219    H    ASN  27           H        ASN  27   5.972 -13.294   0.732
  220    HA   ASN  27           HA       ASN  27   7.767 -14.153   2.822
  221   1HB   ASN  27          1HB       ASN  27   5.332 -12.391   3.262
  222   2HB   ASN  27          2HB       ASN  27   6.857 -12.375   4.125
  223   1HD2  ASN  27          1HD2      ASN  27   8.524 -12.552   1.786
  224   2HD2  ASN  27          2HD2      ASN  27   8.493 -11.017   0.984
  225    H    ASN  28           H        ASN  28   5.097 -15.357   1.234
  226    HA   ASN  28           HA       ASN  28   3.588 -16.853   1.663
  227   1HB   ASN  28          1HB       ASN  28   5.676 -17.622   3.287
  228   2HB   ASN  28          2HB       ASN  28   4.422 -17.410   4.493
  229   1HD2  ASN  28          1HD2      ASN  28   5.246 -18.999   1.455
  230   2HD2  ASN  28          2HD2      ASN  28   4.194 -20.366   1.612
  231    H    ILE  29           H        ILE  29   3.288 -13.975   2.531
  232    HA   ILE  29           HA       ILE  29   1.505 -14.271   4.831
  233    HB   ILE  29           HB       ILE  29   2.734 -11.825   3.556
  234   1HG1  ILE  29          1HG1      ILE  29   3.349 -13.214   6.182
  235   2HG1  ILE  29          2HG1      ILE  29   4.348 -13.263   4.743
  236   1HG2  ILE  29          1HG2      ILE  29   0.902 -10.841   4.444
  237   2HG2  ILE  29          2HG2      ILE  29   0.600 -12.170   5.590
  238   3HG2  ILE  29          3HG2      ILE  29   1.854 -10.957   5.943
  239   1HD1  ILE  29          1HD1      ILE  29   5.348 -11.521   5.956
  240   2HD1  ILE  29          2HD1      ILE  29   4.240 -10.621   4.892
  241   3HD1  ILE  29          3HD1      ILE  29   3.790 -10.932   6.586
  242    H    GLU  30           H        GLU  30  -0.684 -13.615   4.734
  243    HA   GLU  30           HA       GLU  30  -1.624 -13.306   1.989
  244   1HB   GLU  30          1HB       GLU  30  -2.324 -15.227   3.980
  245   2HB   GLU  30          2HB       GLU  30  -3.711 -14.169   3.818
  246   1HG   GLU  30          1HG       GLU  30  -4.016 -14.684   1.531
  247   2HG   GLU  30          2HG       GLU  30  -2.350 -15.181   1.312
  248    H    ASN  31           H        ASN  31  -0.899 -11.506   4.605
  249    HA   ASN  31           HA       ASN  31  -3.035  -9.660   3.999
  250   1HB   ASN  31          1HB       ASN  31  -3.393 -11.113   6.223
  251   2HB   ASN  31          2HB       ASN  31  -2.212 -10.010   6.900
  252   1HD2  ASN  31          1HD2      ASN  31  -5.163 -10.456   7.282
  253   2HD2  ASN  31          2HD2      ASN  31  -5.898  -8.894   7.142
  254    HA   PRO  32           HA       PRO  32   1.191  -7.902   4.390
  255   1HB   PRO  32          1HB       PRO  32   1.419  -6.853   1.877
  256   2HB   PRO  32          2HB       PRO  32   2.038  -8.433   2.316
  257   1HG   PRO  32          1HG       PRO  32  -0.371  -7.758   0.741
  258   2HG   PRO  32          2HG       PRO  32   0.490  -9.282   0.832
  259   1HD   PRO  32          1HD       PRO  32  -1.990  -8.633   2.119
  260   2HD   PRO  32          2HD       PRO  32  -1.071 -10.113   2.301
  261    H    ILE  33           H        ILE  33   1.435  -6.074   5.501
  262    HA   ILE  33           HA       ILE  33  -0.566  -4.028   4.863
  263    HB   ILE  33           HB       ILE  33   0.883  -4.788   7.379
  264   1HG1  ILE  33          1HG1      ILE  33  -1.765  -4.254   7.947
  265   2HG1  ILE  33          2HG1      ILE  33  -1.861  -4.935   6.335
  266   1HG2  ILE  33          1HG2      ILE  33  -0.509  -2.642   8.201
  267   2HG2  ILE  33          2HG2      ILE  33   1.203  -2.575   7.718
  268   3HG2  ILE  33          3HG2      ILE  33  -0.065  -2.096   6.566
  269   1HD1  ILE  33          1HD1      ILE  33  -0.034  -6.638   7.528
  270   2HD1  ILE  33          2HD1      ILE  33  -1.106  -6.234   8.891
  271   3HD1  ILE  33          3HD1      ILE  33  -1.782  -6.950   7.408
  272    H    LEU  34           H        LEU  34   0.395  -2.895   3.182
  273    HA   LEU  34           HA       LEU  34   3.162  -2.078   3.532
  274   1HB   LEU  34          1HB       LEU  34   1.207  -2.088   1.259
  275   2HB   LEU  34          2HB       LEU  34   2.618  -1.050   1.198
  276    HG   LEU  34           HG       LEU  34   2.623  -3.482   0.164
  277   1HD1  LEU  34          1HD1      LEU  34   5.190  -3.248   1.424
  278   2HD1  LEU  34          2HD1      LEU  34   4.718  -2.895  -0.255
  279   3HD1  LEU  34          3HD1      LEU  34   4.593  -1.628   0.989
  280   1HD2  LEU  34          1HD2      LEU  34   3.615  -5.146   1.666
  281   2HD2  LEU  34          2HD2      LEU  34   3.445  -4.017   3.032
  282   3HD2  LEU  34          3HD2      LEU  34   1.996  -4.646   2.213
  283    H    ARG  35           H        ARG  35   3.594  -0.276   4.676
  284    HA   ARG  35           HA       ARG  35   1.486   1.701   4.814
  285   1HB   ARG  35          1HB       ARG  35   2.365   0.967   6.981
  286   2HB   ARG  35          2HB       ARG  35   4.016   1.257   6.471
  287   1HG   ARG  35          1HG       ARG  35   2.713   3.727   6.034
  288   2HG   ARG  35          2HG       ARG  35   2.045   3.151   7.548
  289   1HD   ARG  35          1HD       ARG  35   5.045   3.244   6.976
  290   2HD   ARG  35          2HD       ARG  35   4.178   4.547   7.765
  291    HE   ARG  35           HE       ARG  35   3.437   2.445   9.322
  292   1HH1  ARG  35          2HH2      ARG  35   6.598   3.391   8.099
  293   2HH1  ARG  35          1HH2      ARG  35   7.460   2.714   9.440
  294   1HH2  ARG  35          2HH1      ARG  35   4.575   1.552  11.091
  295   2HH2  ARG  35          1HH1      ARG  35   6.302   1.661  11.153
  296    H    ILE  36           H        ILE  36   1.731   3.766   3.919
  297    HA   ILE  36           HA       ILE  36   4.102   4.154   2.299
  298    HB   ILE  36           HB       ILE  36   1.402   5.461   2.469
  299   1HG1  ILE  36          1HG1      ILE  36   1.395   3.442   1.205
  300   2HG1  ILE  36          2HG1      ILE  36   1.339   4.771   0.065
  301   1HG2  ILE  36          1HG2      ILE  36   2.509   6.711   0.349
  302   2HG2  ILE  36          2HG2      ILE  36   2.445   7.402   1.988
  303   3HG2  ILE  36          3HG2      ILE  36   3.927   6.598   1.419
  304   1HD1  ILE  36          1HD1      ILE  36   3.649   2.926   0.710
  305   2HD1  ILE  36          2HD1      ILE  36   2.986   3.382  -0.877
  306   3HD1  ILE  36          3HD1      ILE  36   3.970   4.544   0.044
  307    H    ARG  37           H        ARG  37   5.849   5.197   3.072
  308    HA   ARG  37           HA       ARG  37   5.316   7.252   5.062
  309   1HB   ARG  37          1HB       ARG  37   6.456   4.996   5.844
  310   2HB   ARG  37          2HB       ARG  37   7.886   5.625   5.049
  311   1HG   ARG  37          1HG       ARG  37   8.154   7.366   6.581
  312   2HG   ARG  37          2HG       ARG  37   6.438   7.488   6.915
  313   1HD   ARG  37          1HD       ARG  37   6.464   5.699   8.453
  314   2HD   ARG  37          2HD       ARG  37   7.883   4.961   7.736
  315    HE   ARG  37           HE       ARG  37   8.849   7.383   8.659
  316   1HH1  ARG  37          2HH2      ARG  37   7.045   4.760  10.158
  317   2HH1  ARG  37          1HH2      ARG  37   7.707   5.034  11.735
  318   1HH2  ARG  37          2HH1      ARG  37   9.723   7.746  10.739
  319   2HH2  ARG  37          1HH1      ARG  37   9.240   6.745  12.068
  320    H    VAL  38           H        VAL  38   5.856   9.223   4.178
  321    HA   VAL  38           HA       VAL  38   7.117   9.631   1.815
  322    HB   VAL  38           HB       VAL  38   7.175  11.396   4.272
  323   1HG1  VAL  38          1HG1      VAL  38   7.241  13.243   2.536
  324   2HG1  VAL  38          2HG1      VAL  38   8.731  12.284   2.701
  325   3HG1  VAL  38          3HG1      VAL  38   7.629  11.988   1.335
  326   1HG2  VAL  38          1HG2      VAL  38   4.981  11.693   4.017
  327   2HG2  VAL  38          2HG2      VAL  38   5.213  12.161   2.316
  328   3HG2  VAL  38          3HG2      VAL  38   4.977  10.449   2.743
  329    H    VAL  39           H        VAL  39   9.191   9.654   1.032
  330    HA   VAL  39           HA       VAL  39  11.321   9.339   3.031
  331    HB   VAL  39           HB       VAL  39  10.907   7.871   0.423
  332   1HG1  VAL  39          1HG1      VAL  39  13.254   8.522   0.593
  333   2HG1  VAL  39          2HG1      VAL  39  13.337   7.867   2.246
  334   3HG1  VAL  39          3HG1      VAL  39  13.075   6.773   0.867
  335   1HG2  VAL  39          1HG2      VAL  39  10.651   7.180   3.306
  336   2HG2  VAL  39          2HG2      VAL  39   9.765   6.562   1.891
  337   3HG2  VAL  39          3HG2      VAL  39  11.399   5.956   2.252
  338    HA   PRO  40           HA       PRO  40  12.223  12.908   0.457
  339   1HB   PRO  40          1HB       PRO  40  12.996  14.583   2.472
  340   2HB   PRO  40          2HB       PRO  40  11.358  14.520   1.855
  341   1HG   PRO  40          1HG       PRO  40  12.427  13.435   4.388
  342   2HG   PRO  40          2HG       PRO  40  10.762  13.759   3.949
  343   1HD   PRO  40          1HD       PRO  40  12.045  11.195   4.041
  344   2HD   PRO  40          2HD       PRO  40  10.415  11.533   3.492
  345    H    GLY  41           H        GLY  41  13.831  11.367  -0.362
  346   1HA   GLY  41          1HA       GLY  41  16.442  12.415   0.235
  347   2HA   GLY  41          2HA       GLY  41  16.203  10.786   0.834
  348    H    GLY  42           H        GLY  42  17.960  11.843  -1.389
  349   1HA   GLY  42          1HA       GLY  42  18.641  10.393  -3.155
  350   2HA   GLY  42          2HA       GLY  42  16.960  10.036  -3.498
  351    H    CYS  43           H        CYS  43  18.296  10.754  -5.685
  352    HA   CYS  43           HA       CYS  43  18.570  13.515  -6.086
  353   1HB   CYS  43          1HB       CYS  43  18.761  11.066  -7.711
  354   2HB   CYS  43          2HB       CYS  43  18.195  12.460  -8.609
  355    HG   CYS  43           HG       CYS  43  20.486  13.001  -9.072
  356    H    SER  44           H        SER  44  15.888  11.190  -6.237
  357    HA   SER  44           HA       SER  44  14.211  13.264  -7.396
  358   1HB   SER  44          1HB       SER  44  14.391  10.786  -8.297
  359   2HB   SER  44          2HB       SER  44  13.334  10.400  -6.954
  360    HG   SER  44           HG       SER  44  11.666  11.382  -7.920
  361    H    GLY  45           H        GLY  45  14.426  10.840  -4.711
  362   1HA   GLY  45          1HA       GLY  45  13.297  10.675  -2.760
  363   2HA   GLY  45          2HA       GLY  45  13.625  12.393  -2.648
  364    H    PHE  46           H        PHE  46  11.621  12.776  -1.515
  365    HA   PHE  46           HA       PHE  46   9.539  13.524  -1.465
  366   1HB   PHE  46          1HB       PHE  46  10.289  13.959  -4.066
  367   2HB   PHE  46          2HB       PHE  46   9.052  12.753  -4.360
  368    HD1  PHE  46           1HD      PHE  46   6.779  13.343  -4.360
  369    HD2  PHE  46           2HD      PHE  46   9.632  16.059  -2.781
  370    HE1  PHE  46           1HE      PHE  46   5.013  15.121  -4.227
  371    HE2  PHE  46           2HE      PHE  46   7.866  17.837  -2.648
  372    HZ   PHE  46           HZ       PHE  46   5.577  17.347  -3.372
  373    H    GLN  47           H        GLN  47   9.590  10.814  -3.899
  374    HA   GLN  47           HA       GLN  47   7.171   9.769  -3.053
  375   1HB   GLN  47          1HB       GLN  47   7.933   7.704  -4.302
  376   2HB   GLN  47          2HB       GLN  47   8.042   9.188  -5.226
  377   1HG   GLN  47          1HG       GLN  47  10.099   7.869  -5.526
  378   2HG   GLN  47          2HG       GLN  47  10.471   9.362  -4.686
  379   1HE2  GLN  47          1HE2      GLN  47  12.146   8.854  -3.460
  380   2HE2  GLN  47          2HE2      GLN  47  12.204   7.601  -2.265
  381    H    TYR  48           H        TYR  48   6.892   7.487  -2.079
  382    HA   TYR  48           HA       TYR  48   8.841   7.157   0.102
  383   1HB   TYR  48          1HB       TYR  48   6.519   6.047   1.024
  384   2HB   TYR  48          2HB       TYR  48   6.834   7.761   1.203
  385    HD1  TYR  48           1HD      TYR  48   5.338   5.363  -1.268
  386    HD2  TYR  48           2HD      TYR  48   5.226   9.273   0.466
  387    HE1  TYR  48           1HE      TYR  48   3.229   5.895  -2.584
  388    HE2  TYR  48           2HE      TYR  48   3.118   9.791  -0.856
  389    HH   TYR  48           HH       TYR  48   1.161   7.946  -1.919
  390    H    ALA  49           H        ALA  49   9.473   5.042   0.664
  391    HA   ALA  49           HA       ALA  49   9.096   3.125  -1.464
  392   1HB   ALA  49          1HB       ALA  49  11.295   3.717  -0.235
  393   2HB   ALA  49          2HB       ALA  49  10.654   2.738   1.106
  394   3HB   ALA  49          3HB       ALA  49  10.930   1.993  -0.487
  395    H    MET  50           H        MET  50   8.485   0.840  -0.963
  396    HA   MET  50           HA       MET  50   6.363   0.883   1.025
  397   1HB   MET  50          1HB       MET  50   6.792  -0.361  -1.653
  398   2HB   MET  50          2HB       MET  50   6.082  -1.460  -0.487
  399   1HG   MET  50          1HG       MET  50   4.185  -0.023  -0.117
  400   2HG   MET  50          2HG       MET  50   4.971   1.349  -0.873
  401   1HE   MET  50          1HE       MET  50   2.535   1.519  -2.367
  402   2HE   MET  50          2HE       MET  50   1.883   0.039  -3.112
  403   3HE   MET  50          3HE       MET  50   2.112   0.121  -1.349
  404    H    GLY  51           H        GLY  51   5.966  -1.183   2.267
  405   1HA   GLY  51          1HA       GLY  51   7.836  -3.255   2.419
  406   2HA   GLY  51          2HA       GLY  51   8.312  -2.028   3.576
  407    H    PHE  52           H        PHE  52   6.976  -4.873   3.699
  408    HA   PHE  52           HA       PHE  52   4.452  -4.305   4.932
  409   1HB   PHE  52          1HB       PHE  52   4.603  -6.825   5.336
  410   2HB   PHE  52          2HB       PHE  52   4.848  -6.389   3.656
  411    HD1  PHE  52           1HD      PHE  52   6.471  -7.612   6.703
  412    HD2  PHE  52           2HD      PHE  52   7.016  -6.642   2.608
  413    HE1  PHE  52           1HE      PHE  52   8.667  -8.827   6.707
  414    HE2  PHE  52           2HE      PHE  52   9.213  -7.857   2.612
  415    HZ   PHE  52           HZ       PHE  52  10.012  -8.935   4.662
  416    H    ASP  53           H        ASP  53   4.012  -4.038   7.089
  417    HA   ASP  53           HA       ASP  53   6.326  -4.138   8.831
  418   1HB   ASP  53          1HB       ASP  53   4.406  -2.206   8.508
  419   2HB   ASP  53          2HB       ASP  53   3.684  -3.123   9.815
  420    H    ASP  54           H        ASP  54   5.496  -4.707  11.290
  421    HA   ASP  54           HA       ASP  54   4.875  -7.366  11.281
  422   1HB   ASP  54          1HB       ASP  54   5.174  -5.205  13.247
  423   2HB   ASP  54          2HB       ASP  54   3.947  -6.346  13.759
  424    H    THR  55           H        THR  55   2.815  -4.425  11.758
  425    HA   THR  55           HA       THR  55   0.501  -5.764  10.790
  426    HB   THR  55           HB       THR  55   0.758  -6.639  13.202
  427    HG1  THR  55           1HG      THR  55  -1.393  -6.723  12.672
  428   1HG2  THR  55          1HG2      THR  55   0.112  -3.694  13.729
  429   2HG2  THR  55          2HG2      THR  55  -0.202  -4.989  14.909
  430   3HG2  THR  55          3HG2      THR  55   1.466  -4.630  14.404
  431    H    VAL  56           H        VAL  56  -1.525  -4.186  11.428
  432    HA   VAL  56           HA       VAL  56  -0.717  -1.700  10.249
  433    HB   VAL  56           HB       VAL  56  -2.866  -3.209   9.946
  434   1HG1  VAL  56          1HG1      VAL  56  -3.695  -3.089  12.208
  435   2HG1  VAL  56          2HG1      VAL  56  -3.654  -1.310  12.179
  436   3HG1  VAL  56          3HG1      VAL  56  -4.808  -2.191  11.149
  437   1HG2  VAL  56          1HG2      VAL  56  -3.594  -1.558   8.586
  438   2HG2  VAL  56          2HG2      VAL  56  -3.607  -0.346   9.890
  439   3HG2  VAL  56          3HG2      VAL  56  -2.082  -0.751   9.067
  440    H    GLU  57           H        GLU  57  -1.252   0.432  11.185
  441    HA   GLU  57           HA       GLU  57  -0.502   0.438  13.938
  442   1HB   GLU  57          1HB       GLU  57  -1.250   2.867  12.272
  443   2HB   GLU  57          2HB       GLU  57  -0.183   2.801  13.661
  444   1HG   GLU  57          1HG       GLU  57   1.424   1.389  12.358
  445   2HG   GLU  57          2HG       GLU  57   0.358   1.459  10.969
  446    H    GLU  58           H        GLU  58  -1.725   2.166  15.407
  447    HA   GLU  58           HA       GLU  58  -4.446   1.267  15.423
  448   1HB   GLU  58          1HB       GLU  58  -2.546   1.975  17.387
  449   2HB   GLU  58          2HB       GLU  58  -3.753   3.243  17.473
  450   1HG   GLU  58          1HG       GLU  58  -5.035   1.819  18.688
  451   2HG   GLU  58          2HG       GLU  58  -5.286   0.898  17.218
  452    H    GLY  59           H        GLY  59  -3.348   3.216  13.332
  453   1HA   GLY  59          1HA       GLY  59  -5.607   4.895  13.171
  454   2HA   GLY  59          2HA       GLY  59  -4.257   5.814  13.806
  455    H    ASP  60           H        ASP  60  -4.611   3.191  11.302
  456    HA   ASP  60           HA       ASP  60  -3.152   4.978   9.517
  457   1HB   ASP  60          1HB       ASP  60  -2.379   2.455  10.390
  458   2HB   ASP  60          2HB       ASP  60  -3.180   2.072   8.879
  459    H    HIS  61           H        HIS  61  -3.982   5.116   7.327
  460    HA   HIS  61           HA       HIS  61  -6.732   4.656   7.069
  461   1HB   HIS  61          1HB       HIS  61  -4.555   5.456   5.137
  462   2HB   HIS  61          2HB       HIS  61  -6.213   5.239   4.615
  463    HD1  HIS  61           1HD      HIS  61  -7.907   6.629   6.621
  464    HD2  HIS  61           2HD      HIS  61  -4.144   8.117   5.515
  465    HE1  HIS  61           1HE      HIS  61  -7.925   9.116   7.192
  466    H    VAL  62           H        VAL  62  -7.224   2.457   7.436
  467    HA   VAL  62           HA       VAL  62  -5.849   0.422   5.982
  468    HB   VAL  62           HB       VAL  62  -7.248   0.524   8.294
  469   1HG1  VAL  62          1HG1      VAL  62  -9.410   0.752   7.141
  470   2HG1  VAL  62          2HG1      VAL  62  -9.115  -0.779   6.283
  471   3HG1  VAL  62          3HG1      VAL  62  -9.313  -0.774   8.052
  472   1HG2  VAL  62          1HG2      VAL  62  -6.573  -1.629   8.531
  473   2HG2  VAL  62          2HG2      VAL  62  -7.282  -2.139   6.980
  474   3HG2  VAL  62          3HG2      VAL  62  -5.714  -1.298   7.007
  475    H    PHE  63           H        PHE  63  -6.093   0.157   3.825
  476    HA   PHE  63           HA       PHE  63  -8.789   0.619   2.754
  477   1HB   PHE  63          1HB       PHE  63  -6.291   1.815   2.157
  478   2HB   PHE  63          2HB       PHE  63  -6.440   0.591   0.912
  479    HD1  PHE  63           1HD      PHE  63  -6.845   1.847  -1.014
  480    HD2  PHE  63           2HD      PHE  63  -9.154   2.603   2.465
  481    HE1  PHE  63           1HE      PHE  63  -8.336   3.374  -2.335
  482    HE2  PHE  63           2HE      PHE  63 -10.646   4.129   1.144
  483    HZ   PHE  63           HZ       PHE  63 -10.219   4.497  -1.241
  484    H    GLU  64           H        GLU  64  -9.766  -1.053   1.668
  485    HA   GLU  64           HA       GLU  64  -8.369  -3.542   1.693
  486   1HB   GLU  64          1HB       GLU  64 -11.177  -2.820   0.744
  487   2HB   GLU  64          2HB       GLU  64 -10.560  -4.455   0.878
  488   1HG   GLU  64          1HG       GLU  64 -10.270  -4.225   3.297
  489   2HG   GLU  64          2HG       GLU  64 -10.635  -2.512   3.230
  490    H    TYR  65           H        TYR  65  -7.367  -4.534  -0.029
  491    HA   TYR  65           HA       TYR  65  -7.831  -3.331  -2.674
  492   1HB   TYR  65          1HB       TYR  65  -5.425  -3.908  -0.977
  493   2HB   TYR  65          2HB       TYR  65  -5.265  -4.509  -2.615
  494    HD1  TYR  65           1HD      TYR  65  -5.198  -1.588  -0.484
  495    HD2  TYR  65           2HD      TYR  65  -5.475  -2.886  -4.552
  496    HE1  TYR  65           1HE      TYR  65  -4.532   0.733  -1.279
  497    HE2  TYR  65           2HE      TYR  65  -4.808  -0.561  -5.332
  498    HH   TYR  65           HH       TYR  65  -4.750   1.628  -4.616
  499    H    ASP  66           H        ASP  66  -6.228  -5.148  -4.138
  500    HA   ASP  66           HA       ASP  66  -8.048  -7.224  -4.428
  501   1HB   ASP  66          1HB       ASP  66  -6.211  -6.174  -6.046
  502   2HB   ASP  66          2HB       ASP  66  -5.179  -7.424  -5.380
  503    H    GLY  67           H        GLY  67  -7.978  -7.926  -2.027
  504   1HA   GLY  67          1HA       GLY  67  -7.471  -9.524  -0.525
  505   2HA   GLY  67          2HA       GLY  67  -6.477 -10.307  -1.737
  506    H    VAL  68           H        VAL  68  -6.131  -6.943  -0.465
  507    HA   VAL  68           HA       VAL  68  -3.845  -7.740   1.116
  508    HB   VAL  68           HB       VAL  68  -3.600  -5.864  -1.245
  509   1HG1  VAL  68          1HG1      VAL  68  -1.819  -6.442   1.101
  510   2HG1  VAL  68          2HG1      VAL  68  -1.085  -6.094  -0.483
  511   3HG1  VAL  68          3HG1      VAL  68  -2.162  -4.900   0.281
  512   1HG2  VAL  68          1HG2      VAL  68  -2.392  -8.602  -0.729
  513   2HG2  VAL  68          2HG2      VAL  68  -3.601  -8.182  -1.966
  514   3HG2  VAL  68          3HG2      VAL  68  -1.951  -7.525  -2.076
  515    H    LYS  69           H        LYS  69  -3.069  -5.907   2.483
  516    HA   LYS  69           HA       LYS  69  -5.229  -3.945   2.835
  517   1HB   LYS  69          1HB       LYS  69  -4.473  -5.912   4.613
  518   2HB   LYS  69          2HB       LYS  69  -3.552  -4.534   5.180
  519   1HG   LYS  69          1HG       LYS  69  -5.799  -3.197   4.939
  520   2HG   LYS  69          2HG       LYS  69  -6.565  -4.771   4.858
  521   1HD   LYS  69          1HD       LYS  69  -4.889  -5.088   7.047
  522   2HD   LYS  69          2HD       LYS  69  -5.315  -3.393   7.179
  523   1HE   LYS  69          1HE       LYS  69  -7.407  -3.904   7.905
  524   2HE   LYS  69          2HE       LYS  69  -7.696  -4.934   6.517
  525   1HZ   LYS  69          1HZ       LYS  69  -7.784  -6.315   8.359
  526   2HZ   LYS  69          2HZ       LYS  69  -6.304  -6.613   7.737
  527   3HZ   LYS  69          3HZ       LYS  69  -6.459  -5.673   9.063
  528    H    VAL  70           H        VAL  70  -4.580  -2.013   2.051
  529    HA   VAL  70           HA       VAL  70  -1.737  -1.360   2.307
  530    HB   VAL  70           HB       VAL  70  -3.912  -0.162   0.579
  531   1HG1  VAL  70          1HG1      VAL  70  -0.956   0.423   0.848
  532   2HG1  VAL  70          2HG1      VAL  70  -1.874   0.828  -0.622
  533   3HG1  VAL  70          3HG1      VAL  70  -2.329   1.552   0.939
  534   1HG2  VAL  70          1HG2      VAL  70  -3.364  -2.455  -0.090
  535   2HG2  VAL  70          2HG2      VAL  70  -2.770  -1.283  -1.290
  536   3HG2  VAL  70          3HG2      VAL  70  -1.635  -2.038  -0.146
  537    H    VAL  71           H        VAL  71  -1.081   0.660   3.220
  538    HA   VAL  71           HA       VAL  71  -3.166   2.236   4.490
  539    HB   VAL  71           HB       VAL  71  -2.094   2.129   6.663
  540   1HG1  VAL  71          1HG1      VAL  71  -2.636  -0.252   7.237
  541   2HG1  VAL  71          2HG1      VAL  71  -3.904   0.584   6.309
  542   3HG1  VAL  71          3HG1      VAL  71  -2.825  -0.575   5.497
  543   1HG2  VAL  71          1HG2      VAL  71  -0.129   0.350   5.230
  544   2HG2  VAL  71          2HG2      VAL  71   0.174   1.725   6.320
  545   3HG2  VAL  71          3HG2      VAL  71  -0.401   0.176   6.981
  546    H    ILE  72           H        ILE  72  -2.307   4.350   5.268
  547    HA   ILE  72           HA       ILE  72   0.328   5.017   4.252
  548    HB   ILE  72           HB       ILE  72  -2.168   6.433   3.312
  549   1HG1  ILE  72          1HG1      ILE  72  -0.323   4.460   1.970
  550   2HG1  ILE  72          2HG1      ILE  72  -2.070   4.413   2.101
  551   1HG2  ILE  72          1HG2      ILE  72   0.255   7.106   1.900
  552   2HG2  ILE  72          2HG2      ILE  72  -0.900   8.163   2.746
  553   3HG2  ILE  72          3HG2      ILE  72   0.444   7.417   3.642
  554   1HD1  ILE  72          1HD1      ILE  72  -0.386   5.781   0.116
  555   2HD1  ILE  72          2HD1      ILE  72  -2.113   5.360   0.036
  556   3HD1  ILE  72          3HD1      ILE  72  -1.601   6.867   0.832
  557    H    ASP  73           H        ASP  73   1.304   6.691   5.408
  558    HA   ASP  73           HA       ASP  73   0.355   7.105   7.954
  559   1HB   ASP  73          1HB       ASP  73   2.638   7.821   6.383
  560   2HB   ASP  73          2HB       ASP  73   2.040   9.315   7.076
  561    HA   PRO  74           HA       PRO  74  -2.302  10.550   7.405
  562   1HB   PRO  74          1HB       PRO  74  -2.122  11.829   9.813
  563   2HB   PRO  74          2HB       PRO  74  -3.104  10.400   9.559
  564   1HG   PRO  74          1HG       PRO  74  -0.504  10.640  10.946
  565   2HG   PRO  74          2HG       PRO  74  -1.686   9.349  11.043
  566   1HD   PRO  74          1HD       PRO  74   0.783   9.308   9.584
  567   2HD   PRO  74          2HD       PRO  74  -0.452   8.065   9.589
  568    H    PHE  75           H        PHE  75   1.000  11.066   8.046
  569    HA   PHE  75           HA       PHE  75   0.787  13.896   7.509
  570   1HB   PHE  75          1HB       PHE  75   3.133  11.934   7.867
  571   2HB   PHE  75          2HB       PHE  75   3.317  13.675   7.800
  572    HD1  PHE  75           1HD      PHE  75   2.820  10.884   9.919
  573    HD2  PHE  75           2HD      PHE  75   2.032  15.041   9.598
  574    HE1  PHE  75           1HE      PHE  75   2.493  11.014  12.404
  575    HE2  PHE  75           2HE      PHE  75   1.705  15.171  12.083
  576    HZ   PHE  75           HZ       PHE  75   1.939  13.156  13.457
  577    H    SER  76           H        SER  76   1.530  10.860   5.829
  578    HA   SER  76           HA       SER  76   2.660  12.302   3.611
  579   1HB   SER  76          1HB       SER  76   3.010  10.043   2.638
  580   2HB   SER  76          2HB       SER  76   3.682  10.165   4.252
  581    HG   SER  76           HG       SER  76   2.548   8.229   4.211
  582    H    MET  77           H        MET  77  -0.415  11.185   4.764
  583    HA   MET  77           HA       MET  77  -1.679  10.469   2.445
  584   1HB   MET  77          1HB       MET  77  -2.357  10.832   5.116
  585   2HB   MET  77          2HB       MET  77  -3.240  12.152   4.375
  586   1HG   MET  77          1HG       MET  77  -3.407   9.325   3.254
  587   2HG   MET  77          2HG       MET  77  -4.439   9.838   4.574
  588   1HE   MET  77          1HE       MET  77  -5.456   9.331   0.920
  589   2HE   MET  77          2HE       MET  77  -4.517  10.679   0.233
  590   3HE   MET  77          3HE       MET  77  -3.709   9.453   1.239
  591    HA   PRO  78           HA       PRO  78  -2.626  15.087   1.852
  592   1HB   PRO  78          1HB       PRO  78  -1.214  16.945   3.274
  593   2HB   PRO  78          2HB       PRO  78  -2.801  16.376   3.752
  594   1HG   PRO  78          1HG       PRO  78  -0.165  15.702   4.908
  595   2HG   PRO  78          2HG       PRO  78  -1.757  15.497   5.611
  596   1HD   PRO  78          1HD       PRO  78  -0.112  13.448   4.460
  597   2HD   PRO  78          2HD       PRO  78  -1.749  13.265   5.057
  598    H    TYR  79           H        TYR  79   0.119  13.437   1.668
  599    HA   TYR  79           HA       TYR  79   1.428  15.475   0.012
  600   1HB   TYR  79          1HB       TYR  79   2.201  13.484   1.973
  601   2HB   TYR  79          2HB       TYR  79   2.824  12.918   0.436
  602    HD1  TYR  79           1HD      TYR  79   4.716  13.955  -0.596
  603    HD2  TYR  79           2HD      TYR  79   2.909  15.740   2.846
  604    HE1  TYR  79           1HE      TYR  79   6.695  15.535  -0.367
  605    HE2  TYR  79           2HE      TYR  79   4.894  17.314   3.064
  606    HH   TYR  79           HH       TYR  79   6.683  18.098   2.061
  607    H    VAL  80           H        VAL  80  -0.785  12.984  -0.284
  608    HA   VAL  80           HA       VAL  80  -0.263  12.757  -3.083
  609    HB   VAL  80           HB       VAL  80  -0.162  10.240  -2.988
  610   1HG1  VAL  80          1HG1      VAL  80   2.297  11.407  -1.700
  611   2HG1  VAL  80          2HG1      VAL  80   2.163  10.226  -3.025
  612   3HG1  VAL  80          3HG1      VAL  80   1.790  11.941  -3.321
  613   1HG2  VAL  80          1HG2      VAL  80  -0.369   9.205  -1.024
  614   2HG2  VAL  80          2HG2      VAL  80   1.170   9.933  -0.504
  615   3HG2  VAL  80          3HG2      VAL  80  -0.367  10.765  -0.166
  616    H    ASN  81           H        ASN  81  -2.343  13.887  -1.485
  617    HA   ASN  81           HA       ASN  81  -4.405  12.374  -0.778
  618   1HB   ASN  81          1HB       ASN  81  -5.882  14.270  -1.478
  619   2HB   ASN  81          2HB       ASN  81  -4.424  14.855  -0.702
  620   1HD2  ASN  81          1HD2      ASN  81  -6.422  15.082  -3.358
  621   2HD2  ASN  81          2HD2      ASN  81  -5.401  15.957  -4.451
  622    H    GLY  82           H        GLY  82  -5.371  10.646  -1.856
  623   1HA   GLY  82          1HA       GLY  82  -5.991   9.296  -3.564
  624   2HA   GLY  82          2HA       GLY  82  -6.841  10.729  -4.109
  625    H    ALA  83           H        ALA  83  -3.289  10.696  -3.896
  626    HA   ALA  83           HA       ALA  83  -3.108  11.306  -6.681
  627   1HB   ALA  83          1HB       ALA  83  -0.967  11.970  -6.161
  628   2HB   ALA  83          2HB       ALA  83  -1.674  12.028  -4.529
  629   3HB   ALA  83          3HB       ALA  83  -0.705  10.622  -5.030
  630    H    GLU  84           H        GLU  84  -1.269  10.071  -7.971
  631    HA   GLU  84           HA       GLU  84  -2.001   7.268  -7.753
  632   1HB   GLU  84          1HB       GLU  84  -2.366   8.641  -9.911
  633   2HB   GLU  84          2HB       GLU  84  -0.625   8.618 -10.108
  634   1HG   GLU  84          1HG       GLU  84  -0.591   6.175 -10.195
  635   2HG   GLU  84          2HG       GLU  84  -2.281   6.081  -9.741
  636    H    LEU  85           H        LEU  85  -0.490   5.706  -7.248
  637    HA   LEU  85           HA       LEU  85   2.294   6.633  -7.088
  638   1HB   LEU  85          1HB       LEU  85   1.904   6.331  -4.898
  639   2HB   LEU  85          2HB       LEU  85   0.551   5.250  -5.162
  640    HG   LEU  85           HG       LEU  85   2.112   3.398  -5.637
  641   1HD1  LEU  85          1HD1      LEU  85   4.546   4.377  -4.587
  642   2HD1  LEU  85          2HD1      LEU  85   4.206   3.806  -6.238
  643   3HD1  LEU  85          3HD1      LEU  85   4.024   5.531  -5.837
  644   1HD2  LEU  85          1HD2      LEU  85   3.284   3.867  -3.132
  645   2HD2  LEU  85          2HD2      LEU  85   1.727   4.728  -3.101
  646   3HD2  LEU  85          3HD2      LEU  85   1.775   2.990  -3.482
  647    H    ASP  86           H        ASP  86   3.309   5.853  -8.872
  648    HA   ASP  86           HA       ASP  86   2.540   3.204  -9.752
  649   1HB   ASP  86          1HB       ASP  86   3.048   5.526 -11.152
  650   2HB   ASP  86          2HB       ASP  86   4.616   4.749 -11.244
  651    H    TYR  87           H        TYR  87   3.715   1.759  -8.399
  652    HA   TYR  87           HA       TYR  87   6.476   2.340  -7.773
  653   1HB   TYR  87          1HB       TYR  87   4.604   1.271  -6.286
  654   2HB   TYR  87          2HB       TYR  87   4.719  -0.146  -7.311
  655    HD1  TYR  87           1HD      TYR  87   7.022  -1.320  -7.470
  656    HD2  TYR  87           2HD      TYR  87   6.029   1.521  -4.429
  657    HE1  TYR  87           1HE      TYR  87   8.901  -2.216  -6.010
  658    HE2  TYR  87           2HE      TYR  87   7.911   0.616  -2.979
  659    HH   TYR  87           HH       TYR  87   9.659  -0.684  -2.908
  660    H    VAL  88           H        VAL  88   7.939   2.024  -9.400
  661    HA   VAL  88           HA       VAL  88   7.514   0.130 -11.453
  662    HB   VAL  88           HB       VAL  88   9.953   1.678 -10.559
  663   1HG1  VAL  88          1HG1      VAL  88  10.774  -0.177 -11.809
  664   2HG1  VAL  88          2HG1      VAL  88   9.480  -0.023 -13.022
  665   3HG1  VAL  88          3HG1      VAL  88  10.755   1.215 -12.919
  666   1HG2  VAL  88          1HG2      VAL  88   8.387   2.283 -13.041
  667   2HG2  VAL  88          2HG2      VAL  88   7.729   2.793 -11.468
  668   3HG2  VAL  88          3HG2      VAL  88   9.331   3.367 -11.992
  669    H    VAL  89           H        VAL  89   8.646  -1.859 -11.863
  670    HA   VAL  89           HA       VAL  89   9.906  -2.997  -9.468
  671    HB   VAL  89           HB       VAL  89   8.067  -4.490 -11.339
  672   1HG1  VAL  89          1HG1      VAL  89   8.116  -6.236  -9.708
  673   2HG1  VAL  89          2HG1      VAL  89   9.803  -5.754 -10.007
  674   3HG1  VAL  89          3HG1      VAL  89   8.969  -5.205  -8.534
  675   1HG2  VAL  89          1HG2      VAL  89   6.458  -3.178 -10.399
  676   2HG2  VAL  89          2HG2      VAL  89   6.613  -4.366  -9.083
  677   3HG2  VAL  89          3HG2      VAL  89   7.444  -2.796  -8.968
  678    H    ASP  90           H        ASP  90  11.970  -3.573  -9.886
  679    HA   ASP  90           HA       ASP  90  12.577  -4.958 -12.269
  680   1HB   ASP  90          1HB       ASP  90  13.730  -2.160 -11.850
  681   2HB   ASP  90          2HB       ASP  90  14.358  -3.309 -13.014
  682    H    PHE  91           H        PHE  91  15.353  -4.809 -12.291
  683    HA   PHE  91           HA       PHE  91  16.995  -5.879 -11.198
  684   1HB   PHE  91          1HB       PHE  91  16.871  -3.205 -10.738
  685   2HB   PHE  91          2HB       PHE  91  16.610  -3.720  -9.083
  686    HD1  PHE  91           1HD      PHE  91  18.882  -4.910 -11.806
  687    HD2  PHE  91           2HD      PHE  91  18.524  -3.441  -7.841
  688    HE1  PHE  91           1HE      PHE  91  21.361  -5.153 -11.492
  689    HE2  PHE  91           2HE      PHE  91  21.002  -3.685  -7.527
  690    HZ   PHE  91           HZ       PHE  91  22.391  -4.538  -9.356
  691    H    MET  92           H        MET  92  17.374  -5.237  -8.147
  692    HA   MET  92           HA       MET  92  15.903  -7.582  -7.325
  693   1HB   MET  92          1HB       MET  92  18.446  -6.282  -6.668
  694   2HB   MET  92          2HB       MET  92  17.522  -6.524  -5.198
  695   1HG   MET  92          1HG       MET  92  17.425  -8.893  -5.498
  696   2HG   MET  92          2HG       MET  92  17.815  -8.789  -7.203
  697   1HE   MET  92          1HE       MET  92  21.061 -10.130  -7.036
  698   2HE   MET  92          2HE       MET  92  20.039 -10.898  -5.797
  699   3HE   MET  92          3HE       MET  92  19.317 -10.341  -7.326
  700    H    GLY  93           H        GLY  93  14.588  -4.894  -7.764
  701   1HA   GLY  93          1HA       GLY  93  12.999  -4.881  -5.395
  702   2HA   GLY  93          2HA       GLY  93  14.069  -3.494  -5.451
  703    H    GLY  94           H        GLY  94  13.586  -1.750  -6.782
  704   1HA   GLY  94          1HA       GLY  94  12.214  -1.786  -9.168
  705   2HA   GLY  94          2HA       GLY  94  10.977  -1.657  -7.933
  706    H    GLY  95           H        GLY  95  10.613   0.510  -9.021
  707   1HA   GLY  95          1HA       GLY  95  12.410   2.524  -7.815
  708   2HA   GLY  95          2HA       GLY  95  11.850   2.653  -9.470
  709    H    PHE  96           H        PHE  96  11.324   3.923  -6.505
  710    HA   PHE  96           HA       PHE  96   8.462   3.770  -6.418
  711   1HB   PHE  96          1HB       PHE  96  10.195   5.835  -5.003
  712   2HB   PHE  96          2HB       PHE  96   8.801   4.981  -4.371
  713    HD1  PHE  96           1HD      PHE  96   9.030   2.662  -3.559
  714    HD2  PHE  96           2HD      PHE  96  12.400   4.895  -4.850
  715    HE1  PHE  96           1HE      PHE  96  10.552   1.030  -2.410
  716    HE2  PHE  96           2HE      PHE  96  13.922   3.263  -3.700
  717    HZ   PHE  96           HZ       PHE  96  12.979   1.350  -2.494
  718    H    THR  97           H        THR  97   7.129   4.964  -7.686
  719    HA   THR  97           HA       THR  97   7.974   7.699  -8.328
  720    HB   THR  97           HB       THR  97   7.085   5.490 -10.243
  721    HG1  THR  97           1HG      THR  97   9.291   5.642 -10.408
  722   1HG2  THR  97          1HG2      THR  97   7.729   8.093 -11.441
  723   2HG2  THR  97          2HG2      THR  97   6.327   7.040 -11.747
  724   3HG2  THR  97          3HG2      THR  97   6.286   8.208 -10.405
  725    H    ILE  98           H        ILE  98   6.494   9.147  -7.737
  726    HA   ILE  98           HA       ILE  98   3.717   8.197  -7.614
  727    HB   ILE  98           HB       ILE  98   5.110   8.604  -5.415
  728   1HG1  ILE  98          1HG1      ILE  98   2.694   7.965  -5.668
  729   2HG1  ILE  98          2HG1      ILE  98   3.070   8.915  -4.245
  730   1HG2  ILE  98          1HG2      ILE  98   3.986  11.374  -5.751
  731   2HG2  ILE  98          2HG2      ILE  98   5.174  10.767  -4.573
  732   3HG2  ILE  98          3HG2      ILE  98   5.642  10.985  -6.276
  733   1HD1  ILE  98          1HD1      ILE  98   1.047   9.511  -6.006
  734   2HD1  ILE  98          2HD1      ILE  98   1.832  10.709  -4.949
  735   3HD1  ILE  98          3HD1      ILE  98   2.360  10.533  -6.640
  736    H    ARG  99           H        ARG  99   2.337   9.318  -8.885
  737    HA   ARG  99           HA       ARG  99   3.306  11.911  -9.788
  738   1HB   ARG  99          1HB       ARG  99   2.059   9.611 -11.197
  739   2HB   ARG  99          2HB       ARG  99   1.321  11.148 -11.603
  740   1HG   ARG  99          1HG       ARG  99   4.306  11.170 -11.537
  741   2HG   ARG  99          2HG       ARG  99   3.606  10.161 -12.787
  742   1HD   ARG  99          1HD       ARG  99   2.176  12.133 -13.507
  743   2HD   ARG  99          2HD       ARG  99   3.012  13.125 -12.329
  744    HE   ARG  99           HE       ARG  99   4.066  12.210 -14.895
  745   1HH1  ARG  99          2HH2      ARG  99   4.953  13.259 -11.655
  746   2HH1  ARG  99          1HH2      ARG  99   6.538  13.780 -12.119
  747   1HH2  ARG  99          2HH1      ARG  99   6.157  12.897 -15.508
  748   2HH2  ARG  99          1HH1      ARG  99   7.228  13.573 -14.325
  749    H    ASN 100           H        ASN 100   2.212  13.518  -8.691
  750    HA   ASN 100           HA       ASN 100  -0.588  12.987  -8.094
  751   1HB   ASN 100          1HB       ASN 100  -0.310  14.833  -6.375
  752   2HB   ASN 100          2HB       ASN 100   0.721  13.448  -6.075
  753   1HD2  ASN 100          1HD2      ASN 100   0.567  16.761  -6.427
  754   2HD2  ASN 100          2HD2      ASN 100   2.248  17.139  -6.610
  755    HA   PRO 101           HA       PRO 101  -1.381  16.251 -10.938
  756   1HB   PRO 101          1HB       PRO 101  -4.056  16.585 -10.496
  757   2HB   PRO 101          2HB       PRO 101  -3.406  15.338 -11.541
  758   1HG   PRO 101          1HG       PRO 101  -4.527  15.075  -8.818
  759   2HG   PRO 101          2HG       PRO 101  -4.273  13.831 -10.026
  760   1HD   PRO 101          1HD       PRO 101  -2.662  14.324  -7.705
  761   2HD   PRO 101          2HD       PRO 101  -2.344  13.157  -8.972
  Start of MODEL   20
    1    H    MET   1           H        MET   1 -16.071  -1.717  14.486
    2    HA   MET   1           HA       MET   1 -18.457  -1.011  15.708
    3   1HB   MET   1          1HB       MET   1 -17.220  -3.663  16.483
    4   2HB   MET   1          2HB       MET   1 -17.856  -2.673  17.781
    5   1HG   MET   1          1HG       MET   1 -20.053  -2.961  17.117
    6   2HG   MET   1          2HG       MET   1 -19.655  -2.937  15.410
    7   1HE   MET   1          1HE       MET   1 -21.491  -6.140  15.784
    8   2HE   MET   1          2HE       MET   1 -21.431  -4.432  15.286
    9   3HE   MET   1          3HE       MET   1 -20.575  -5.667  14.333
   10    H    GLN   2           H        GLN   2 -17.526   0.967  16.205
   11    HA   GLN   2           HA       GLN   2 -16.341   2.430  17.285
   12   1HB   GLN   2          1HB       GLN   2 -16.256   0.103  19.073
   13   2HB   GLN   2          2HB       GLN   2 -14.835   1.109  19.264
   14   1HG   GLN   2          1HG       GLN   2 -17.631   2.312  19.210
   15   2HG   GLN   2          2HG       GLN   2 -16.935   1.691  20.693
   16   1HE2  GLN   2          1HE2      GLN   2 -16.753   3.595  21.744
   17   2HE2  GLN   2          2HE2      GLN   2 -15.677   4.876  21.297
   18    H    GLU   3           H        GLU   3 -15.153   2.380  15.123
   19    HA   GLU   3           HA       GLU   3 -12.357   2.032  15.711
   20   1HB   GLU   3          1HB       GLU   3 -11.902   0.756  13.654
   21   2HB   GLU   3          2HB       GLU   3 -12.996  -0.132  14.696
   22   1HG   GLU   3          1HG       GLU   3 -14.895   0.353  13.331
   23   2HG   GLU   3          2HG       GLU   3 -14.095   1.691  12.530
   24    H    GLN   4           H        GLN   4 -10.959   3.249  14.189
   25    HA   GLN   4           HA       GLN   4 -12.204   5.654  13.454
   26   1HB   GLN   4          1HB       GLN   4  -9.639   4.898  14.075
   27   2HB   GLN   4          2HB       GLN   4  -9.507   5.050  12.334
   28   1HG   GLN   4          1HG       GLN   4 -10.973   7.327  13.044
   29   2HG   GLN   4          2HG       GLN   4  -9.854   7.156  14.382
   30   1HE2  GLN   4          1HE2      GLN   4 -10.307   8.179  11.205
   31   2HE2  GLN   4          2HE2      GLN   4  -8.668   8.524  10.762
   32    H    ALA   5           H        ALA   5 -13.887   4.867  11.959
   33    HA   ALA   5           HA       ALA   5 -13.088   3.598   9.531
   34   1HB   ALA   5          1HB       ALA   5 -15.272   3.152  10.472
   35   2HB   ALA   5          2HB       ALA   5 -15.673   4.886  10.489
   36   3HB   ALA   5          3HB       ALA   5 -15.502   4.027   8.940
   37    H    GLN   6           H        GLN   6 -12.152   4.578   7.814
   38    HA   GLN   6           HA       GLN   6 -13.119   6.995   6.826
   39   1HB   GLN   6          1HB       GLN   6 -11.934   8.050   8.677
   40   2HB   GLN   6          2HB       GLN   6 -10.476   7.139   8.336
   41   1HG   GLN   6          1HG       GLN   6  -9.893   8.466   6.527
   42   2HG   GLN   6          2HG       GLN   6 -11.557   8.743   6.051
   43   1HE2  GLN   6          1HE2      GLN   6  -9.249   9.443   8.661
   44   2HE2  GLN   6          2HE2      GLN   6  -9.779  11.056   9.002
   45    H    GLN   7           H        GLN   7 -12.732   6.930   4.643
   46    HA   GLN   7           HA       GLN   7 -10.431   5.333   3.820
   47   1HB   GLN   7          1HB       GLN   7 -12.354   4.031   3.259
   48   2HB   GLN   7          2HB       GLN   7 -13.251   5.429   2.702
   49   1HG   GLN   7          1HG       GLN   7 -11.605   5.704   0.814
   50   2HG   GLN   7          2HG       GLN   7 -10.769   4.262   1.356
   51   1HE2  GLN   7          1HE2      GLN   7 -13.465   5.569  -0.312
   52   2HE2  GLN   7          2HE2      GLN   7 -14.206   4.095  -0.839
   53    H    PHE   8           H        PHE   8  -8.922   6.859   3.224
   54    HA   PHE   8           HA       PHE   8  -9.710   9.345   2.096
   55   1HB   PHE   8          1HB       PHE   8  -7.063   7.800   2.360
   56   2HB   PHE   8          2HB       PHE   8  -7.138   9.459   1.801
   57    HD1  PHE   8           1HD      PHE   8  -7.315  11.256   3.332
   58    HD2  PHE   8           2HD      PHE   8  -7.786   7.270   4.708
   59    HE1  PHE   8           1HE      PHE   8  -7.201  12.062   5.707
   60    HE2  PHE   8           2HE      PHE   8  -7.671   8.076   7.083
   61    HZ   PHE   8           HZ       PHE   8  -7.379  10.462   7.554
   62    H    ILE   9           H        ILE   9  -8.855  10.160  -0.037
   63    HA   ILE   9           HA       ILE   9  -9.488   8.218  -2.063
   64    HB   ILE   9           HB       ILE   9  -8.644  11.089  -2.418
   65   1HG1  ILE   9          1HG1      ILE   9 -10.509  10.831  -0.743
   66   2HG1  ILE   9          2HG1      ILE   9 -10.882  11.806  -2.151
   67   1HG2  ILE   9          1HG2      ILE   9 -10.513  10.521  -4.324
   68   2HG2  ILE   9          2HG2      ILE   9  -8.751  10.429  -4.558
   69   3HG2  ILE   9          3HG2      ILE   9  -9.675   8.958  -4.168
   70   1HD1  ILE   9          1HD1      ILE   9 -11.507   9.049  -2.766
   71   2HD1  ILE   9          2HD1      ILE   9 -12.262   9.483  -1.214
   72   3HD1  ILE   9          3HD1      ILE   9 -12.609  10.443  -2.673
   73    H    PHE  10           H        PHE  10  -7.981   6.787  -2.728
   74    HA   PHE  10           HA       PHE  10  -5.456   7.793  -3.623
   75   1HB   PHE  10          1HB       PHE  10  -5.389   7.292  -1.026
   76   2HB   PHE  10          2HB       PHE  10  -5.555   5.606  -1.474
   77    HD1  PHE  10           1HD      PHE  10  -3.586   4.433  -1.403
   78    HD2  PHE  10           2HD      PHE  10  -3.473   8.491  -2.637
   79    HE1  PHE  10           1HE      PHE  10  -1.100   4.270  -1.712
   80    HE2  PHE  10           2HE      PHE  10  -0.987   8.329  -2.945
   81    HZ   PHE  10           HZ       PHE  10   0.170   6.220  -2.479
   82    H    LYS  11           H        LYS  11  -4.678   6.539  -5.301
   83    HA   LYS  11           HA       LYS  11  -5.741   3.830  -5.535
   84   1HB   LYS  11          1HB       LYS  11  -5.870   5.899  -7.750
   85   2HB   LYS  11          2HB       LYS  11  -6.280   4.203  -7.909
   86   1HG   LYS  11          1HG       LYS  11  -7.627   5.940  -5.807
   87   2HG   LYS  11          2HG       LYS  11  -8.210   5.916  -7.459
   88   1HD   LYS  11          1HD       LYS  11  -8.902   3.674  -7.338
   89   2HD   LYS  11          2HD       LYS  11  -7.738   3.267  -6.093
   90   1HE   LYS  11          1HE       LYS  11  -9.060   4.734  -4.477
   91   2HE   LYS  11          2HE       LYS  11 -10.272   4.933  -5.727
   92   1HZ   LYS  11          1HZ       LYS  11  -9.499   2.219  -5.193
   93   2HZ   LYS  11          2HZ       LYS  11 -10.289   2.966  -3.974
   94   3HZ   LYS  11          3HZ       LYS  11 -10.984   2.850  -5.448
   95    H    VAL  12           H        VAL  12  -4.014   2.508  -5.617
   96    HA   VAL  12           HA       VAL  12  -1.551   3.609  -6.758
   97    HB   VAL  12           HB       VAL  12  -1.738   2.699  -4.364
   98   1HG1  VAL  12          1HG1      VAL  12  -2.681   0.425  -5.754
   99   2HG1  VAL  12          2HG1      VAL  12  -1.075  -0.005  -5.118
  100   3HG1  VAL  12          3HG1      VAL  12  -2.342   0.581  -4.014
  101   1HG2  VAL  12          1HG2      VAL  12   0.378   1.784  -6.331
  102   2HG2  VAL  12          2HG2      VAL  12   0.405   3.212  -5.268
  103   3HG2  VAL  12          3HG2      VAL  12   0.530   1.579  -4.569
  104    H    THR  13           H        THR  13  -0.369   2.415  -8.344
  105    HA   THR  13           HA       THR  13  -1.956   1.161 -10.269
  106    HB   THR  13           HB       THR  13   0.301   0.659 -11.285
  107    HG1  THR  13           1HG      THR  13   1.965   0.578  -9.821
  108   1HG2  THR  13          1HG2      THR  13   0.481   3.370  -9.903
  109   2HG2  THR  13          2HG2      THR  13   1.055   2.920 -11.527
  110   3HG2  THR  13          3HG2      THR  13  -0.689   3.088 -11.215
  111    H    ASP  14           H        ASP  14  -1.944  -1.034 -11.069
  112    HA   ASP  14           HA       ASP  14  -2.408  -2.831  -9.012
  113   1HB   ASP  14          1HB       ASP  14  -2.278  -2.883 -11.992
  114   2HB   ASP  14          2HB       ASP  14  -1.995  -4.434 -11.227
  115    H    LYS  15           H        LYS  15   0.463  -1.875 -10.830
  116    HA   LYS  15           HA       LYS  15   1.965  -4.231 -10.510
  117   1HB   LYS  15          1HB       LYS  15   2.242  -1.829 -11.857
  118   2HB   LYS  15          2HB       LYS  15   3.485  -1.723 -10.627
  119   1HG   LYS  15          1HG       LYS  15   4.429  -2.814 -12.601
  120   2HG   LYS  15          2HG       LYS  15   4.332  -3.988 -11.304
  121   1HD   LYS  15          1HD       LYS  15   2.480  -5.113 -12.276
  122   2HD   LYS  15          2HD       LYS  15   2.028  -3.733 -13.257
  123   1HE   LYS  15          1HE       LYS  15   4.459  -4.124 -14.333
  124   2HE   LYS  15          2HE       LYS  15   4.230  -5.748 -13.716
  125   1HZ   LYS  15          1HZ       LYS  15   2.096  -4.481 -15.243
  126   2HZ   LYS  15          2HZ       LYS  15   3.363  -5.149 -16.027
  127   3HZ   LYS  15          3HZ       LYS  15   2.424  -6.071 -15.060
  128    H    ALA  16           H        ALA  16   1.560  -1.243  -8.534
  129    HA   ALA  16           HA       ALA  16   3.538  -1.806  -6.666
  130   1HB   ALA  16          1HB       ALA  16   2.302  -0.206  -5.256
  131   2HB   ALA  16          2HB       ALA  16   2.393   0.370  -6.938
  132   3HB   ALA  16          3HB       ALA  16   0.885  -0.350  -6.324
  133    H    VAL  17           H        VAL  17  -0.046  -2.411  -6.447
  134    HA   VAL  17           HA       VAL  17   0.069  -3.848  -4.085
  135    HB   VAL  17           HB       VAL  17  -1.823  -3.527  -6.353
  136   1HG1  VAL  17          1HG1      VAL  17  -1.869  -5.852  -4.441
  137   2HG1  VAL  17          2HG1      VAL  17  -3.390  -5.145  -5.036
  138   3HG1  VAL  17          3HG1      VAL  17  -2.210  -5.814  -6.188
  139   1HG2  VAL  17          1HG2      VAL  17  -2.109  -3.279  -3.339
  140   2HG2  VAL  17          2HG2      VAL  17  -1.792  -1.946  -4.476
  141   3HG2  VAL  17          3HG2      VAL  17  -3.335  -2.829  -4.548
  142    H    GLU  18           H        GLU  18   0.440  -4.888  -7.514
  143    HA   GLU  18           HA       GLU  18   0.443  -7.604  -6.978
  144   1HB   GLU  18          1HB       GLU  18   1.385  -5.843  -9.222
  145   2HB   GLU  18          2HB       GLU  18   1.967  -7.496  -9.207
  146   1HG   GLU  18          1HG       GLU  18  -0.988  -6.954  -8.804
  147   2HG   GLU  18          2HG       GLU  18  -0.316  -6.905 -10.421
  148    H    GLU  19           H        GLU  19   3.000  -5.106  -6.832
  149    HA   GLU  19           HA       GLU  19   5.167  -6.811  -6.740
  150   1HB   GLU  19          1HB       GLU  19   5.496  -4.447  -7.092
  151   2HB   GLU  19          2HB       GLU  19   4.696  -4.035  -5.589
  152   1HG   GLU  19          1HG       GLU  19   7.031  -3.839  -5.117
  153   2HG   GLU  19          2HG       GLU  19   6.547  -5.351  -4.375
  154    H    ILE  20           H        ILE  20   3.311  -5.270  -4.015
  155    HA   ILE  20           HA       ILE  20   4.718  -6.608  -2.000
  156    HB   ILE  20           HB       ILE  20   1.986  -5.332  -2.072
  157   1HG1  ILE  20          1HG1      ILE  20   3.429  -3.665  -0.598
  158   2HG1  ILE  20          2HG1      ILE  20   4.763  -4.371  -1.489
  159   1HG2  ILE  20          1HG2      ILE  20   3.427  -6.750   0.119
  160   2HG2  ILE  20          2HG2      ILE  20   2.561  -5.247   0.521
  161   3HG2  ILE  20          3HG2      ILE  20   1.684  -6.611  -0.213
  162   1HD1  ILE  20          1HD1      ILE  20   4.036  -3.531  -3.540
  163   2HD1  ILE  20          2HD1      ILE  20   2.326  -3.514  -3.045
  164   3HD1  ILE  20          3HD1      ILE  20   3.439  -2.260  -2.446
  165    H    LYS  21           H        LYS  21   2.015  -7.533  -4.107
  166    HA   LYS  21           HA       LYS  21   1.049  -9.654  -2.571
  167   1HB   LYS  21          1HB       LYS  21   0.765  -8.633  -5.310
  168   2HB   LYS  21          2HB       LYS  21   0.601 -10.374  -5.202
  169   1HG   LYS  21          1HG       LYS  21  -0.999  -9.941  -3.201
  170   2HG   LYS  21          2HG       LYS  21  -0.999  -8.262  -3.700
  171   1HD   LYS  21          1HD       LYS  21  -2.110  -8.712  -5.727
  172   2HD   LYS  21          2HD       LYS  21  -1.553 -10.372  -5.789
  173   1HE   LYS  21          1HE       LYS  21  -3.430  -9.467  -3.577
  174   2HE   LYS  21          2HE       LYS  21  -4.062  -9.893  -5.154
  175   1HZ   LYS  21          1HZ       LYS  21  -3.305 -12.049  -4.931
  176   2HZ   LYS  21          2HZ       LYS  21  -2.248 -11.695  -3.737
  177   3HZ   LYS  21          3HZ       LYS  21  -3.852 -11.706  -3.431
  178    H    LYS  22           H        LYS  22   3.568  -9.521  -5.172
  179    HA   LYS  22           HA       LYS  22   4.162 -12.296  -4.857
  180   1HB   LYS  22          1HB       LYS  22   5.221 -10.018  -6.495
  181   2HB   LYS  22          2HB       LYS  22   6.209 -11.453  -6.310
  182   1HG   LYS  22          1HG       LYS  22   3.960 -12.738  -6.922
  183   2HG   LYS  22          2HG       LYS  22   3.474 -11.190  -7.584
  184   1HD   LYS  22          1HD       LYS  22   4.599 -11.775  -9.471
  185   2HD   LYS  22          2HD       LYS  22   6.076 -11.488  -8.572
  186   1HE   LYS  22          1HE       LYS  22   5.238 -14.078  -7.772
  187   2HE   LYS  22          2HE       LYS  22   4.939 -14.027  -9.498
  188   1HZ   LYS  22          1HZ       LYS  22   7.346 -12.878  -9.282
  189   2HZ   LYS  22          2HZ       LYS  22   7.420 -14.005  -8.103
  190   3HZ   LYS  22          3HZ       LYS  22   7.096 -14.452  -9.640
  191    H    VAL  23           H        VAL  23   5.645  -9.165  -3.836
  192    HA   VAL  23           HA       VAL  23   7.944 -10.185  -2.715
  193    HB   VAL  23           HB       VAL  23   6.238  -7.773  -2.327
  194   1HG1  VAL  23          1HG1      VAL  23   8.038  -6.963  -0.660
  195   2HG1  VAL  23          2HG1      VAL  23   6.760  -8.045  -0.057
  196   3HG1  VAL  23          3HG1      VAL  23   8.381  -8.691  -0.407
  197   1HG2  VAL  23          1HG2      VAL  23   8.116  -6.608  -3.179
  198   2HG2  VAL  23          2HG2      VAL  23   9.213  -7.972  -2.852
  199   3HG2  VAL  23          3HG2      VAL  23   7.998  -8.098  -4.147
  200    H    ALA  24           H        ALA  24   4.739  -9.557  -1.120
  201    HA   ALA  24           HA       ALA  24   5.510 -10.650   1.342
  202   1HB   ALA  24          1HB       ALA  24   3.269 -10.313   1.942
  203   2HB   ALA  24          2HB       ALA  24   3.507  -9.118   0.645
  204   3HB   ALA  24          3HB       ALA  24   2.674 -10.652   0.299
  205    H    GLN  25           H        GLN  25   3.885 -12.036  -1.573
  206    HA   GLN  25           HA       GLN  25   3.307 -14.487  -0.485
  207   1HB   GLN  25          1HB       GLN  25   3.755 -13.435  -3.266
  208   2HB   GLN  25          2HB       GLN  25   3.691 -15.174  -3.062
  209   1HG   GLN  25          1HG       GLN  25   1.466 -15.102  -2.154
  210   2HG   GLN  25          2HG       GLN  25   1.551 -13.376  -1.861
  211   1HE2  GLN  25          1HE2      GLN  25  -0.551 -14.447  -3.202
  212   2HE2  GLN  25          2HE2      GLN  25  -0.536 -13.986  -4.871
  213    H    GLU  26           H        GLU  26   6.343 -13.187  -1.869
  214    HA   GLU  26           HA       GLU  26   7.602 -15.730  -1.861
  215   1HB   GLU  26          1HB       GLU  26   8.203 -13.018  -2.763
  216   2HB   GLU  26          2HB       GLU  26   9.586 -13.704  -1.933
  217   1HG   GLU  26          1HG       GLU  26   8.701 -15.839  -3.509
  218   2HG   GLU  26          2HG       GLU  26   8.395 -14.453  -4.538
  219    H    ASN  27           H        ASN  27   6.577 -13.774   0.621
  220    HA   ASN  27           HA       ASN  27   8.914 -14.396   2.242
  221   1HB   ASN  27          1HB       ASN  27   6.923 -12.158   2.215
  222   2HB   ASN  27          2HB       ASN  27   7.360 -12.730   3.813
  223   1HD2  ASN  27          1HD2      ASN  27   8.153 -10.692   1.319
  224   2HD2  ASN  27          2HD2      ASN  27   9.796 -10.314   1.718
  225    H    ASN  28           H        ASN  28   6.053 -15.724   1.338
  226    HA   ASN  28           HA       ASN  28   4.841 -17.330   2.178
  227   1HB   ASN  28          1HB       ASN  28   6.988 -17.683   3.728
  228   2HB   ASN  28          2HB       ASN  28   5.969 -17.002   4.981
  229   1HD2  ASN  28          1HD2      ASN  28   6.291 -19.572   2.604
  230   2HD2  ASN  28          2HD2      ASN  28   5.241 -20.727   3.356
  231    H    ILE  29           H        ILE  29   4.244 -14.393   2.311
  232    HA   ILE  29           HA       ILE  29   2.597 -14.236   4.721
  233    HB   ILE  29           HB       ILE  29   3.472 -12.130   2.742
  234   1HG1  ILE  29          1HG1      ILE  29   4.294 -12.512   5.634
  235   2HG1  ILE  29          2HG1      ILE  29   5.232 -13.086   4.270
  236   1HG2  ILE  29          1HG2      ILE  29   2.566 -10.656   4.734
  237   2HG2  ILE  29          2HG2      ILE  29   1.486 -11.236   3.444
  238   3HG2  ILE  29          3HG2      ILE  29   1.528 -12.075   5.013
  239   1HD1  ILE  29          1HD1      ILE  29   4.405 -10.263   3.975
  240   2HD1  ILE  29          2HD1      ILE  29   5.429 -10.556   5.401
  241   3HD1  ILE  29          3HD1      ILE  29   6.013 -11.002   3.780
  242    H    GLU  30           H        GLU  30   0.339 -13.825   4.605
  243    HA   GLU  30           HA       GLU  30  -0.763 -14.167   1.931
  244   1HB   GLU  30          1HB       GLU  30  -0.920 -16.036   4.089
  245   2HB   GLU  30          2HB       GLU  30  -2.516 -15.331   3.927
  246   1HG   GLU  30          1HG       GLU  30  -2.694 -15.987   1.616
  247   2HG   GLU  30          2HG       GLU  30  -0.980 -16.330   1.497
  248    H    ASN  31           H        ASN  31  -0.316 -12.044   4.343
  249    HA   ASN  31           HA       ASN  31  -2.784 -10.714   3.727
  250   1HB   ASN  31          1HB       ASN  31  -2.799 -10.134   6.372
  251   2HB   ASN  31          2HB       ASN  31  -3.673 -11.510   5.728
  252   1HD2  ASN  31          1HD2      ASN  31  -3.475 -12.404   7.843
  253   2HD2  ASN  31          2HD2      ASN  31  -2.038 -13.236   8.336
  254    HA   PRO  32           HA       PRO  32   1.037  -8.183   4.170
  255   1HB   PRO  32          1HB       PRO  32   1.214  -7.255   1.606
  256   2HB   PRO  32          2HB       PRO  32   2.091  -8.660   2.179
  257   1HG   PRO  32          1HG       PRO  32  -0.304  -8.548   0.449
  258   2HG   PRO  32          2HG       PRO  32   0.821  -9.871   0.683
  259   1HD   PRO  32          1HD       PRO  32  -1.809  -9.635   1.803
  260   2HD   PRO  32          2HD       PRO  32  -0.641 -10.900   2.128
  261    H    ILE  33           H        ILE  33   1.406  -5.827   4.042
  262    HA   ILE  33           HA       ILE  33  -1.117  -4.425   3.611
  263    HB   ILE  33           HB       ILE  33   0.448  -4.543   6.169
  264   1HG1  ILE  33          1HG1      ILE  33  -2.544  -4.559   5.732
  265   2HG1  ILE  33          2HG1      ILE  33  -1.579  -6.021   5.664
  266   1HG2  ILE  33          1HG2      ILE  33  -1.387  -2.566   6.620
  267   2HG2  ILE  33          2HG2      ILE  33   0.343  -2.309   6.294
  268   3HG2  ILE  33          3HG2      ILE  33  -0.840  -2.187   4.970
  269   1HD1  ILE  33          1HD1      ILE  33  -0.629  -5.033   8.001
  270   2HD1  ILE  33          2HD1      ILE  33  -2.245  -4.286   8.017
  271   3HD1  ILE  33          3HD1      ILE  33  -2.083  -6.056   7.919
  272    H    LEU  34           H        LEU  34  -0.854  -2.469   2.600
  273    HA   LEU  34           HA       LEU  34   1.883  -1.809   1.887
  274   1HB   LEU  34          1HB       LEU  34  -0.832  -1.193   0.804
  275   2HB   LEU  34          2HB       LEU  34   0.486  -0.092   0.452
  276    HG   LEU  34           HG       LEU  34   1.609  -1.611  -0.872
  277   1HD1  LEU  34          1HD1      LEU  34   1.166  -4.092  -0.815
  278   2HD1  LEU  34          2HD1      LEU  34   1.919  -3.411   0.648
  279   3HD1  LEU  34          3HD1      LEU  34   0.184  -3.809   0.642
  280   1HD2  LEU  34          1HD2      LEU  34  -1.272  -2.493  -1.202
  281   2HD2  LEU  34          2HD2      LEU  34  -0.565  -1.004  -1.873
  282   3HD2  LEU  34          3HD2      LEU  34   0.024  -2.593  -2.417
  283    H    ARG  35           H        ARG  35   3.026  -0.346   3.023
  284    HA   ARG  35           HA       ARG  35   1.453   1.591   4.522
  285   1HB   ARG  35          1HB       ARG  35   2.733   0.131   6.018
  286   2HB   ARG  35          2HB       ARG  35   4.199   0.374   5.089
  287   1HG   ARG  35          1HG       ARG  35   3.155   2.967   5.865
  288   2HG   ARG  35          2HG       ARG  35   3.220   1.943   7.286
  289   1HD   ARG  35          1HD       ARG  35   5.599   2.035   5.404
  290   2HD   ARG  35          2HD       ARG  35   5.363   3.331   6.560
  291    HE   ARG  35           HE       ARG  35   5.079   1.007   8.078
  292   1HH1  ARG  35          2HH2      ARG  35   7.585   2.336   5.995
  293   2HH1  ARG  35          1HH2      ARG  35   8.882   1.577   6.856
  294   1HH2  ARG  35          2HH1      ARG  35   6.790   0.006   9.214
  295   2HH2  ARG  35          1HH1      ARG  35   8.427   0.243   8.699
  296    H    ILE  36           H        ILE  36   1.543   3.624   3.620
  297    HA   ILE  36           HA       ILE  36   3.743   4.242   1.840
  298    HB   ILE  36           HB       ILE  36   1.026   5.330   2.386
  299   1HG1  ILE  36          1HG1      ILE  36   1.139   5.401  -0.194
  300   2HG1  ILE  36          2HG1      ILE  36   2.610   4.463  -0.032
  301   1HG2  ILE  36          1HG2      ILE  36   1.803   7.259   0.766
  302   2HG2  ILE  36          2HG2      ILE  36   1.980   7.406   2.531
  303   3HG2  ILE  36          3HG2      ILE  36   3.383   6.960   1.530
  304   1HD1  ILE  36          1HD1      ILE  36   0.591   3.311   1.696
  305   2HD1  ILE  36          2HD1      ILE  36  -0.080   3.514   0.060
  306   3HD1  ILE  36          3HD1      ILE  36   1.412   2.574   0.299
  307    H    ARG  37           H        ARG  37   5.579   5.142   2.588
  308    HA   ARG  37           HA       ARG  37   5.273   6.933   4.860
  309   1HB   ARG  37          1HB       ARG  37   7.390   6.115   5.791
  310   2HB   ARG  37          2HB       ARG  37   6.331   4.744   5.529
  311   1HG   ARG  37          1HG       ARG  37   7.969   3.794   4.282
  312   2HG   ARG  37          2HG       ARG  37   7.711   5.039   3.077
  313   1HD   ARG  37          1HD       ARG  37  10.059   5.109   3.660
  314   2HD   ARG  37          2HD       ARG  37   9.324   6.532   4.370
  315    HE   ARG  37           HE       ARG  37   9.637   5.621   6.531
  316   1HH1  ARG  37          2HH2      ARG  37  10.392   3.228   4.064
  317   2HH1  ARG  37          1HH2      ARG  37  11.136   2.129   5.177
  318   1HH2  ARG  37          2HH1      ARG  37  10.618   4.171   7.999
  319   2HH2  ARG  37          1HH1      ARG  37  11.265   2.669   7.430
  320    H    VAL  38           H        VAL  38   6.822   8.742   4.910
  321    HA   VAL  38           HA       VAL  38   7.856   9.321   2.235
  322    HB   VAL  38           HB       VAL  38   7.458  11.230   4.536
  323   1HG1  VAL  38          1HG1      VAL  38   8.889  12.093   2.793
  324   2HG1  VAL  38          2HG1      VAL  38   7.730  11.601   1.535
  325   3HG1  VAL  38          3HG1      VAL  38   7.305  12.897   2.679
  326   1HG2  VAL  38          1HG2      VAL  38   5.444   9.894   2.897
  327   2HG2  VAL  38          2HG2      VAL  38   5.251  10.905   4.349
  328   3HG2  VAL  38          3HG2      VAL  38   5.372  11.666   2.745
  329    H    VAL  39           H        VAL  39   9.959   8.785   1.956
  330    HA   VAL  39           HA       VAL  39  11.732   9.207   4.264
  331    HB   VAL  39           HB       VAL  39  11.355   6.844   3.558
  332   1HG1  VAL  39          1HG1      VAL  39  13.123   6.949   1.244
  333   2HG1  VAL  39          2HG1      VAL  39  11.544   6.151   1.440
  334   3HG1  VAL  39          3HG1      VAL  39  11.622   7.867   0.975
  335   1HG2  VAL  39          1HG2      VAL  39  13.723   6.216   3.602
  336   2HG2  VAL  39          2HG2      VAL  39  14.185   7.885   3.188
  337   3HG2  VAL  39          3HG2      VAL  39  13.396   7.541   4.746
  338    HA   PRO  40           HA       PRO  40  13.666  12.125   1.707
  339   1HB   PRO  40          1HB       PRO  40  15.888  12.620   3.219
  340   2HB   PRO  40          2HB       PRO  40  14.334  13.369   3.526
  341   1HG   PRO  40          1HG       PRO  40  15.665  11.185   5.009
  342   2HG   PRO  40          2HG       PRO  40  14.349  12.220   5.526
  343   1HD   PRO  40          1HD       PRO  40  14.148   9.495   4.651
  344   2HD   PRO  40          2HD       PRO  40  12.822  10.566   5.058
  345    H    GLY  41           H        GLY  41  13.780   9.968   0.339
  346   1HA   GLY  41          1HA       GLY  41  16.614   9.255   0.039
  347   2HA   GLY  41          2HA       GLY  41  15.233   8.372  -0.579
  348    H    GLY  42           H        GLY  42  16.783  11.651  -0.855
  349   1HA   GLY  42          1HA       GLY  42  17.637  12.398  -2.940
  350   2HA   GLY  42          2HA       GLY  42  16.414  11.460  -3.774
  351    H    CYS  43           H        CYS  43  17.274  14.567  -2.986
  352    HA   CYS  43           HA       CYS  43  14.836  15.649  -2.113
  353   1HB   CYS  43          1HB       CYS  43  15.820  17.813  -2.657
  354   2HB   CYS  43          2HB       CYS  43  16.980  16.806  -1.814
  355    HG   CYS  43           HG       CYS  43  18.556  16.336  -3.617
  356    H    SER  44           H        SER  44  15.991  14.373  -5.138
  357    HA   SER  44           HA       SER  44  14.075  15.924  -6.646
  358   1HB   SER  44          1HB       SER  44  16.320  15.640  -7.612
  359   2HB   SER  44          2HB       SER  44  16.186  13.896  -7.501
  360    HG   SER  44           HG       SER  44  14.188  15.339  -8.961
  361    H    GLY  45           H        GLY  45  14.543  12.794  -5.125
  362   1HA   GLY  45          1HA       GLY  45  12.376  11.567  -6.675
  363   2HA   GLY  45          2HA       GLY  45  13.478  10.764  -5.575
  364    H    PHE  46           H        PHE  46  13.355  11.709  -3.172
  365    HA   PHE  46           HA       PHE  46  12.086  11.549  -1.348
  366   1HB   PHE  46          1HB       PHE  46  10.581  13.550  -1.159
  367   2HB   PHE  46          2HB       PHE  46  12.071  13.990  -1.970
  368    HD1  PHE  46           1HD      PHE  46  12.085  14.394  -4.406
  369    HD2  PHE  46           2HD      PHE  46   8.477  13.607  -2.314
  370    HE1  PHE  46           1HE      PHE  46  10.765  15.290  -6.344
  371    HE2  PHE  46           2HE      PHE  46   7.158  14.503  -4.252
  372    HZ   PHE  46           HZ       PHE  46   8.318  15.333  -6.244
  373    H    GLN  47           H        GLN  47  11.204   9.773  -3.606
  374    HA   GLN  47           HA       GLN  47   8.393   9.839  -3.642
  375   1HB   GLN  47          1HB       GLN  47  10.275   7.541  -4.336
  376   2HB   GLN  47          2HB       GLN  47   8.593   7.668  -4.811
  377   1HG   GLN  47          1HG       GLN  47   9.339   8.703  -6.694
  378   2HG   GLN  47          2HG       GLN  47   9.638  10.104  -5.683
  379   1HE2  GLN  47          1HE2      GLN  47  11.065   9.528  -7.995
  380   2HE2  GLN  47          2HE2      GLN  47  12.717   9.186  -7.604
  381    H    TYR  48           H        TYR  48   7.273   7.493  -3.080
  382    HA   TYR  48           HA       TYR  48   7.915   7.088  -0.244
  383   1HB   TYR  48          1HB       TYR  48   5.428   6.472  -1.959
  384   2HB   TYR  48          2HB       TYR  48   5.500   6.336  -0.213
  385    HD1  TYR  48           1HD      TYR  48   5.093   8.217   1.185
  386    HD2  TYR  48           2HD      TYR  48   5.629   8.773  -3.023
  387    HE1  TYR  48           1HE      TYR  48   4.315  10.628   1.397
  388    HE2  TYR  48           2HE      TYR  48   4.849  11.182  -2.797
  389    HH   TYR  48           HH       TYR  48   3.778  12.605  -1.450
  390    H    ALA  49           H        ALA  49   9.039   5.263   0.203
  391    HA   ALA  49           HA       ALA  49   9.090   3.126  -1.719
  392   1HB   ALA  49          1HB       ALA  49  10.402   2.307   0.613
  393   2HB   ALA  49          2HB       ALA  49  11.152   3.070  -0.809
  394   3HB   ALA  49          3HB       ALA  49  10.645   4.069   0.573
  395    H    MET  50           H        MET  50   8.630   0.839  -1.078
  396    HA   MET  50           HA       MET  50   6.177   0.823   0.451
  397   1HB   MET  50          1HB       MET  50   7.315  -0.631  -1.828
  398   2HB   MET  50          2HB       MET  50   6.792  -1.774  -0.607
  399   1HG   MET  50          1HG       MET  50   5.000   0.503  -1.559
  400   2HG   MET  50          2HG       MET  50   5.028  -1.054  -2.363
  401   1HE   MET  50          1HE       MET  50   2.405   0.014   0.970
  402   2HE   MET  50          2HE       MET  50   3.856   1.000   0.669
  403   3HE   MET  50          3HE       MET  50   2.718   0.664  -0.657
  404    H    GLY  51           H        GLY  51   5.822  -1.403   1.718
  405   1HA   GLY  51          1HA       GLY  51   8.004  -2.764   2.819
  406   2HA   GLY  51          2HA       GLY  51   7.636  -1.410   3.870
  407    H    PHE  52           H        PHE  52   6.566  -4.540   2.651
  408    HA   PHE  52           HA       PHE  52   3.937  -4.438   3.651
  409   1HB   PHE  52          1HB       PHE  52   4.250  -6.992   3.410
  410   2HB   PHE  52          2HB       PHE  52   4.630  -6.078   1.964
  411    HD1  PHE  52           1HD      PHE  52   6.027  -8.031   4.729
  412    HD2  PHE  52           2HD      PHE  52   6.912  -5.889   1.174
  413    HE1  PHE  52           1HE      PHE  52   8.314  -9.065   4.675
  414    HE2  PHE  52           2HE      PHE  52   9.198  -6.923   1.120
  415    HZ   PHE  52           HZ       PHE  52   9.872  -8.498   2.871
  416    H    ASP  53           H        ASP  53   3.469  -4.094   5.779
  417    HA   ASP  53           HA       ASP  53   5.198  -5.442   7.696
  418   1HB   ASP  53          1HB       ASP  53   3.508  -2.928   7.801
  419   2HB   ASP  53          2HB       ASP  53   3.881  -3.767   9.293
  420    H    ASP  54           H        ASP  54   3.771  -5.866   9.885
  421    HA   ASP  54           HA       ASP  54   1.212  -6.945   8.997
  422   1HB   ASP  54          1HB       ASP  54   3.150  -8.623   9.490
  423   2HB   ASP  54          2HB       ASP  54   2.949  -8.178  11.173
  424    H    THR  55           H        THR  55   0.999  -4.467   9.939
  425    HA   THR  55           HA       THR  55  -0.307  -4.731  12.444
  426    HB   THR  55           HB       THR  55   2.079  -4.676  13.220
  427    HG1  THR  55           1HG      THR  55   0.295  -3.582  14.388
  428   1HG2  THR  55          1HG2      THR  55   2.132  -2.338  11.359
  429   2HG2  THR  55          2HG2      THR  55   2.843  -2.035  12.963
  430   3HG2  THR  55          3HG2      THR  55   3.477  -3.348  11.942
  431    H    VAL  56           H        VAL  56  -0.809  -2.297  13.264
  432    HA   VAL  56           HA       VAL  56  -1.242  -0.634  10.905
  433    HB   VAL  56           HB       VAL  56  -3.283  -2.069  12.478
  434   1HG1  VAL  56          1HG1      VAL  56  -3.567   0.879  11.832
  435   2HG1  VAL  56          2HG1      VAL  56  -4.953  -0.200  12.120
  436   3HG1  VAL  56          3HG1      VAL  56  -3.758   0.076  13.409
  437   1HG2  VAL  56          1HG2      VAL  56  -3.341  -2.675  10.262
  438   2HG2  VAL  56          2HG2      VAL  56  -4.543  -1.362  10.255
  439   3HG2  VAL  56          3HG2      VAL  56  -2.884  -1.053   9.688
  440    H    GLU  57           H        GLU  57  -1.646   1.629  11.450
  441    HA   GLU  57           HA       GLU  57  -0.373   2.250  13.966
  442   1HB   GLU  57          1HB       GLU  57  -1.152   4.212  11.777
  443   2HB   GLU  57          2HB       GLU  57   0.047   4.433  13.036
  444   1HG   GLU  57          1HG       GLU  57   0.652   2.020  11.512
  445   2HG   GLU  57          2HG       GLU  57   0.456   3.376  10.419
  446    H    GLU  58           H        GLU  58  -1.273   4.421  15.032
  447    HA   GLU  58           HA       GLU  58  -3.996   3.817  15.638
  448   1HB   GLU  58          1HB       GLU  58  -1.956   4.678  17.176
  449   2HB   GLU  58          2HB       GLU  58  -2.616   6.246  16.752
  450   1HG   GLU  58          1HG       GLU  58  -4.810   5.651  17.647
  451   2HG   GLU  58          2HG       GLU  58  -4.332   3.978  17.858
  452    H    GLY  59           H        GLY  59  -3.054   5.002  12.930
  453   1HA   GLY  59          1HA       GLY  59  -5.290   6.701  12.530
  454   2HA   GLY  59          2HA       GLY  59  -3.824   7.652  12.659
  455    H    ASP  60           H        ASP  60  -4.220   4.312  11.323
  456    HA   ASP  60           HA       ASP  60  -2.959   5.283   8.913
  457   1HB   ASP  60          1HB       ASP  60  -3.068   2.761  10.394
  458   2HB   ASP  60          2HB       ASP  60  -3.488   2.492   8.714
  459    H    HIS  61           H        HIS  61  -4.009   5.103   6.836
  460    HA   HIS  61           HA       HIS  61  -6.854   5.043   6.959
  461   1HB   HIS  61          1HB       HIS  61  -6.006   6.630   5.486
  462   2HB   HIS  61          2HB       HIS  61  -4.790   5.547   4.839
  463    HD1  HIS  61           1HD      HIS  61  -8.243   4.149   5.022
  464    HD2  HIS  61           2HD      HIS  61  -5.848   6.169   2.232
  465    HE1  HIS  61           1HE      HIS  61  -9.399   3.886   2.762
  466    H    VAL  62           H        VAL  62  -7.902   3.127   7.212
  467    HA   VAL  62           HA       VAL  62  -6.728   0.699   6.263
  468    HB   VAL  62           HB       VAL  62  -8.779   1.548   8.078
  469   1HG1  VAL  62          1HG1      VAL  62 -10.309  -0.473   7.611
  470   2HG1  VAL  62          2HG1      VAL  62 -10.507   0.975   6.594
  471   3HG1  VAL  62          3HG1      VAL  62  -9.627  -0.440   5.967
  472   1HG2  VAL  62          1HG2      VAL  62  -6.706  -0.124   8.185
  473   2HG2  VAL  62          2HG2      VAL  62  -8.113  -0.297   9.262
  474   3HG2  VAL  62          3HG2      VAL  62  -7.972  -1.319   7.811
  475    H    PHE  63           H        PHE  63  -6.571   0.527   4.054
  476    HA   PHE  63           HA       PHE  63  -9.067   0.990   2.577
  477   1HB   PHE  63          1HB       PHE  63  -6.543   2.176   2.310
  478   2HB   PHE  63          2HB       PHE  63  -6.413   0.847   1.176
  479    HD1  PHE  63           1HD      PHE  63  -9.598   1.080   0.695
  480    HD2  PHE  63           2HD      PHE  63  -6.282   3.710   0.384
  481    HE1  PHE  63           1HE      PHE  63 -10.829   2.429  -1.027
  482    HE2  PHE  63           2HE      PHE  63  -7.513   5.059  -1.338
  483    HZ   PHE  63           HZ       PHE  63  -9.772   4.402  -2.023
  484    H    GLU  64           H        GLU  64 -10.029  -0.930   2.096
  485    HA   GLU  64           HA       GLU  64  -8.433  -3.287   1.984
  486   1HB   GLU  64          1HB       GLU  64 -11.407  -2.822   1.491
  487   2HB   GLU  64          2HB       GLU  64 -10.652  -4.403   1.533
  488   1HG   GLU  64          1HG       GLU  64  -9.833  -3.895   3.879
  489   2HG   GLU  64          2HG       GLU  64 -10.720  -2.385   3.826
  490    H    TYR  65           H        TYR  65  -7.545  -4.207   0.175
  491    HA   TYR  65           HA       TYR  65  -8.428  -3.111  -2.407
  492   1HB   TYR  65          1HB       TYR  65  -5.891  -3.496  -1.030
  493   2HB   TYR  65          2HB       TYR  65  -5.906  -4.604  -2.388
  494    HD1  TYR  65           1HD      TYR  65  -5.770  -3.802  -4.667
  495    HD2  TYR  65           2HD      TYR  65  -6.009  -1.044  -1.405
  496    HE1  TYR  65           1HE      TYR  65  -5.102  -1.901  -6.216
  497    HE2  TYR  65           2HE      TYR  65  -5.340   0.848  -2.966
  498    HH   TYR  65           HH       TYR  65  -5.581   1.224  -5.544
  499    H    ASP  66           H        ASP  66  -6.930  -5.138  -3.907
  500    HA   ASP  66           HA       ASP  66  -8.963  -7.017  -4.114
  501   1HB   ASP  66          1HB       ASP  66  -7.399  -6.370  -5.957
  502   2HB   ASP  66          2HB       ASP  66  -6.073  -7.132  -5.101
  503    H    GLY  67           H        GLY  67  -8.898  -7.582  -1.653
  504   1HA   GLY  67          1HA       GLY  67  -8.658  -9.412  -0.289
  505   2HA   GLY  67          2HA       GLY  67  -7.383 -10.037  -1.316
  506    H    VAL  68           H        VAL  68  -5.936  -7.367  -1.359
  507    HA   VAL  68           HA       VAL  68  -4.633  -7.724   1.223
  508    HB   VAL  68           HB       VAL  68  -3.731  -6.105  -1.159
  509   1HG1  VAL  68          1HG1      VAL  68  -1.500  -6.387  -0.181
  510   2HG1  VAL  68          2HG1      VAL  68  -2.607  -5.598   0.968
  511   3HG1  VAL  68          3HG1      VAL  68  -2.198  -7.319   1.165
  512   1HG2  VAL  68          1HG2      VAL  68  -4.129  -8.419  -1.874
  513   2HG2  VAL  68          2HG2      VAL  68  -2.389  -8.046  -1.837
  514   3HG2  VAL  68          3HG2      VAL  68  -3.120  -9.014  -0.534
  515    H    LYS  69           H        LYS  69  -4.003  -5.803   2.495
  516    HA   LYS  69           HA       LYS  69  -5.983  -3.661   2.142
  517   1HB   LYS  69          1HB       LYS  69  -6.187  -5.199   4.168
  518   2HB   LYS  69          2HB       LYS  69  -4.695  -4.490   4.750
  519   1HG   LYS  69          1HG       LYS  69  -5.898  -2.181   4.313
  520   2HG   LYS  69          2HG       LYS  69  -7.370  -3.131   4.291
  521   1HD   LYS  69          1HD       LYS  69  -5.381  -3.391   6.577
  522   2HD   LYS  69          2HD       LYS  69  -6.580  -2.113   6.570
  523   1HE   LYS  69          1HE       LYS  69  -8.082  -3.584   7.422
  524   2HE   LYS  69          2HE       LYS  69  -8.026  -4.464   5.908
  525   1HZ   LYS  69          1HZ       LYS  69  -7.214  -6.085   7.158
  526   2HZ   LYS  69          2HZ       LYS  69  -5.796  -5.275   7.147
  527   3HZ   LYS  69          3HZ       LYS  69  -6.823  -5.108   8.406
  528    H    VAL  70           H        VAL  70  -5.281  -1.470   2.627
  529    HA   VAL  70           HA       VAL  70  -2.360  -1.185   2.482
  530    HB   VAL  70           HB       VAL  70  -4.462   0.460   1.059
  531   1HG1  VAL  70          1HG1      VAL  70  -2.392   1.396  -0.113
  532   2HG1  VAL  70          2HG1      VAL  70  -2.667   1.917   1.567
  533   3HG1  VAL  70          3HG1      VAL  70  -1.447   0.671   1.209
  534   1HG2  VAL  70          1HG2      VAL  70  -3.205  -0.501  -0.992
  535   2HG2  VAL  70          2HG2      VAL  70  -2.628  -1.751   0.136
  536   3HG2  VAL  70          3HG2      VAL  70  -4.373  -1.544  -0.146
  537    H    VAL  71           H        VAL  71  -1.530   0.833   3.443
  538    HA   VAL  71           HA       VAL  71  -3.408   2.224   5.169
  539    HB   VAL  71           HB       VAL  71  -2.413   1.692   7.167
  540   1HG1  VAL  71          1HG1      VAL  71  -3.591  -0.266   6.428
  541   2HG1  VAL  71          2HG1      VAL  71  -2.201  -0.805   5.455
  542   3HG1  VAL  71          3HG1      VAL  71  -2.096  -0.801   7.232
  543   1HG2  VAL  71          1HG2      VAL  71   0.021   0.741   5.623
  544   2HG2  VAL  71          2HG2      VAL  71  -0.117   2.207   6.622
  545   3HG2  VAL  71          3HG2      VAL  71  -0.177   0.601   7.386
  546    H    ILE  72           H        ILE  72  -2.592   4.302   5.880
  547    HA   ILE  72           HA       ILE  72  -0.056   5.091   4.675
  548    HB   ILE  72           HB       ILE  72  -2.563   6.716   4.288
  549   1HG1  ILE  72          1HG1      ILE  72  -1.415   5.354   1.933
  550   2HG1  ILE  72          2HG1      ILE  72  -2.181   4.282   3.088
  551   1HG2  ILE  72          1HG2      ILE  72  -0.954   8.248   3.921
  552   2HG2  ILE  72          2HG2      ILE  72   0.304   7.023   3.629
  553   3HG2  ILE  72          3HG2      ILE  72  -0.840   7.450   2.334
  554   1HD1  ILE  72          1HD1      ILE  72  -3.776   6.713   2.656
  555   2HD1  ILE  72          2HD1      ILE  72  -3.489   5.819   1.144
  556   3HD1  ILE  72          3HD1      ILE  72  -4.260   5.005   2.527
  557    H    ASP  73           H        ASP  73   0.652   7.286   5.538
  558    HA   ASP  73           HA       ASP  73   0.109   7.252   8.350
  559   1HB   ASP  73          1HB       ASP  73   2.106   8.587   6.520
  560   2HB   ASP  73          2HB       ASP  73   1.842   9.295   8.101
  561    HA   PRO  74           HA       PRO  74  -2.374  10.866   8.254
  562   1HB   PRO  74          1HB       PRO  74  -1.748  12.151  10.583
  563   2HB   PRO  74          2HB       PRO  74  -2.818  10.765  10.511
  564   1HG   PRO  74          1HG       PRO  74  -0.019  10.897  11.452
  565   2HG   PRO  74          2HG       PRO  74  -1.223   9.661  11.758
  566   1HD   PRO  74          1HD       PRO  74   0.970   9.502   9.916
  567   2HD   PRO  74          2HD       PRO  74  -0.299   8.315  10.139
  568    H    PHE  75           H        PHE  75   1.012  11.256   8.380
  569    HA   PHE  75           HA       PHE  75   0.762  14.073   7.709
  570   1HB   PHE  75          1HB       PHE  75   2.506  12.656   9.270
  571   2HB   PHE  75          2HB       PHE  75   3.340  12.465   7.741
  572    HD1  PHE  75           1HD      PHE  75   2.599  14.701  10.466
  573    HD2  PHE  75           2HD      PHE  75   4.115  14.509   6.508
  574    HE1  PHE  75           1HE      PHE  75   3.660  16.957  10.763
  575    HE2  PHE  75           2HE      PHE  75   5.176  16.764   6.804
  576    HZ   PHE  75           HZ       PHE  75   4.936  17.961   8.929
  577    H    SER  76           H        SER  76   0.764  11.048   6.133
  578    HA   SER  76           HA       SER  76   2.238  11.996   3.856
  579   1HB   SER  76          1HB       SER  76   2.343   9.602   4.710
  580   2HB   SER  76          2HB       SER  76   0.682   9.395   4.190
  581    HG   SER  76           HG       SER  76   2.043  10.463   2.104
  582    H    MET  77           H        MET  77  -1.015  11.947   5.089
  583    HA   MET  77           HA       MET  77  -2.478  11.692   2.785
  584   1HB   MET  77          1HB       MET  77  -2.912  12.322   5.507
  585   2HB   MET  77          2HB       MET  77  -3.494  13.748   4.670
  586   1HG   MET  77          1HG       MET  77  -5.308  12.063   4.971
  587   2HG   MET  77          2HG       MET  77  -4.999  12.373   3.274
  588   1HE   MET  77          1HE       MET  77  -5.238   9.001   2.142
  589   2HE   MET  77          2HE       MET  77  -5.640  10.734   2.084
  590   3HE   MET  77          3HE       MET  77  -4.036  10.174   1.551
  591    HA   PRO  78           HA       PRO  78  -1.977  16.382   2.252
  592   1HB   PRO  78          1HB       PRO  78  -0.134  17.736   3.748
  593   2HB   PRO  78          2HB       PRO  78  -1.832  17.645   4.172
  594   1HG   PRO  78          1HG       PRO  78   0.460  16.225   5.385
  595   2HG   PRO  78          2HG       PRO  78  -1.145  16.481   6.041
  596   1HD   PRO  78          1HD       PRO  78  -0.126  14.057   4.894
  597   2HD   PRO  78          2HD       PRO  78  -1.765  14.349   5.444
  598    H    TYR  79           H        TYR  79   0.254  14.032   2.200
  599    HA   TYR  79           HA       TYR  79   1.960  15.606   0.389
  600   1HB   TYR  79          1HB       TYR  79   2.572  14.208   2.725
  601   2HB   TYR  79          2HB       TYR  79   2.771  12.934   1.539
  602    HD1  TYR  79           1HD      TYR  79   3.714  15.018  -0.675
  603    HD2  TYR  79           2HD      TYR  79   4.941  14.141   3.329
  604    HE1  TYR  79           1HE      TYR  79   6.051  15.873  -1.195
  605    HE2  TYR  79           2HE      TYR  79   7.274  14.999   2.795
  606    HH   TYR  79           HH       TYR  79   8.512  15.228   0.003
  607    H    VAL  80           H        VAL  80  -0.413  13.134   0.641
  608    HA   VAL  80           HA       VAL  80   0.122  12.383  -2.112
  609    HB   VAL  80           HB       VAL  80   0.063  10.039  -1.695
  610   1HG1  VAL  80          1HG1      VAL  80   2.010  11.400   0.198
  611   2HG1  VAL  80          2HG1      VAL  80   2.131   9.715  -0.362
  612   3HG1  VAL  80          3HG1      VAL  80   2.267  11.052  -1.529
  613   1HG2  VAL  80          1HG2      VAL  80  -0.804   9.070   0.126
  614   2HG2  VAL  80          2HG2      VAL  80   0.242  10.011   1.215
  615   3HG2  VAL  80          3HG2      VAL  80  -1.300  10.698   0.650
  616    H    ASN  81           H        ASN  81  -1.795  14.175  -1.093
  617    HA   ASN  81           HA       ASN  81  -4.197  12.675  -0.694
  618   1HB   ASN  81          1HB       ASN  81  -4.150  14.711   0.547
  619   2HB   ASN  81          2HB       ASN  81  -3.455  15.619  -0.781
  620   1HD2  ASN  81          1HD2      ASN  81  -5.132  17.152  -0.351
  621   2HD2  ASN  81          2HD2      ASN  81  -6.721  16.945  -1.011
  622    H    GLY  82           H        GLY  82  -5.488  12.003  -2.418
  623   1HA   GLY  82          1HA       GLY  82  -6.351  11.832  -4.484
  624   2HA   GLY  82          2HA       GLY  82  -6.163  13.569  -4.619
  625    H    ALA  83           H        ALA  83  -3.948  10.677  -4.501
  626    HA   ALA  83           HA       ALA  83  -2.949  11.342  -7.118
  627   1HB   ALA  83          1HB       ALA  83  -1.408  11.861  -4.585
  628   2HB   ALA  83          2HB       ALA  83  -0.537  11.278  -6.023
  629   3HB   ALA  83          3HB       ALA  83  -1.457  12.800  -6.097
  630    H    GLU  84           H        GLU  84  -1.452   9.614  -7.912
  631    HA   GLU  84           HA       GLU  84  -2.041   7.142  -6.482
  632   1HB   GLU  84          1HB       GLU  84  -1.911   6.000  -8.659
  633   2HB   GLU  84          2HB       GLU  84  -3.093   7.293  -8.719
  634   1HG   GLU  84          1HG       GLU  84  -1.193   8.788  -9.657
  635   2HG   GLU  84          2HG       GLU  84  -0.267   7.314  -9.857
  636    H    LEU  85           H        LEU  85  -0.347   5.458  -6.470
  637    HA   LEU  85           HA       LEU  85   2.326   6.618  -6.855
  638   1HB   LEU  85          1HB       LEU  85   2.435   6.486  -4.633
  639   2HB   LEU  85          2HB       LEU  85   1.070   5.394  -4.515
  640    HG   LEU  85           HG       LEU  85   2.526   3.490  -5.089
  641   1HD1  LEU  85          1HD1      LEU  85   4.362   3.946  -6.275
  642   2HD1  LEU  85          2HD1      LEU  85   4.418   5.636  -5.719
  643   3HD1  LEU  85          3HD1      LEU  85   5.115   4.344  -4.713
  644   1HD2  LEU  85          1HD2      LEU  85   2.239   4.651  -2.691
  645   2HD2  LEU  85          2HD2      LEU  85   3.216   3.186  -2.953
  646   3HD2  LEU  85          3HD2      LEU  85   4.007   4.778  -2.858
  647    H    ASP  86           H        ASP  86   3.170   5.717  -8.660
  648    HA   ASP  86           HA       ASP  86   2.385   3.011  -9.280
  649   1HB   ASP  86          1HB       ASP  86   4.344   4.466 -11.009
  650   2HB   ASP  86          2HB       ASP  86   2.957   3.501 -11.473
  651    H    TYR  87           H        TYR  87   3.664   1.526  -8.125
  652    HA   TYR  87           HA       TYR  87   6.433   2.152  -7.584
  653   1HB   TYR  87          1HB       TYR  87   4.478   0.892  -6.203
  654   2HB   TYR  87          2HB       TYR  87   4.965  -0.496  -7.157
  655    HD1  TYR  87           1HD      TYR  87   5.972   1.840  -4.498
  656    HD2  TYR  87           2HD      TYR  87   7.120  -1.586  -6.790
  657    HE1  TYR  87           1HE      TYR  87   7.839   1.350  -2.844
  658    HE2  TYR  87           2HE      TYR  87   8.983  -2.064  -5.128
  659    HH   TYR  87           HH       TYR  87   9.665  -1.616  -3.013
  660    H    VAL  88           H        VAL  88   8.119   1.577  -8.859
  661    HA   VAL  88           HA       VAL  88   7.624   0.022 -11.198
  662    HB   VAL  88           HB       VAL  88  10.087   1.256  -9.962
  663   1HG1  VAL  88          1HG1      VAL  88  11.029  -0.505 -11.170
  664   2HG1  VAL  88          2HG1      VAL  88   9.786  -0.432 -12.443
  665   3HG1  VAL  88          3HG1      VAL  88  11.035   0.833 -12.343
  666   1HG2  VAL  88          1HG2      VAL  88   9.031   3.078 -10.798
  667   2HG2  VAL  88          2HG2      VAL  88   9.708   2.505 -12.341
  668   3HG2  VAL  88          3HG2      VAL  88   8.024   2.121 -11.910
  669    H    VAL  89           H        VAL  89   8.674  -2.007 -11.757
  670    HA   VAL  89           HA       VAL  89   9.516  -3.535  -9.396
  671    HB   VAL  89           HB       VAL  89   7.796  -4.580 -11.649
  672   1HG1  VAL  89          1HG1      VAL  89   7.520  -6.541 -10.302
  673   2HG1  VAL  89          2HG1      VAL  89   9.264  -6.196 -10.386
  674   3HG1  VAL  89          3HG1      VAL  89   8.345  -5.783  -8.919
  675   1HG2  VAL  89          1HG2      VAL  89   6.140  -3.383 -10.694
  676   2HG2  VAL  89          2HG2      VAL  89   6.191  -4.637  -9.432
  677   3HG2  VAL  89          3HG2      VAL  89   7.065  -3.103  -9.199
  678    H    ASP  90           H        ASP  90  11.555  -4.280  -9.634
  679    HA   ASP  90           HA       ASP  90  12.353  -5.411 -12.093
  680   1HB   ASP  90          1HB       ASP  90  13.680  -2.825 -11.154
  681   2HB   ASP  90          2HB       ASP  90  14.357  -3.879 -12.380
  682    H    PHE  91           H        PHE  91  15.069  -5.646 -11.780
  683    HA   PHE  91           HA       PHE  91  16.425  -7.026 -10.640
  684   1HB   PHE  91          1HB       PHE  91  16.585  -4.410  -9.924
  685   2HB   PHE  91          2HB       PHE  91  16.074  -5.029  -8.366
  686    HD1  PHE  91           1HD      PHE  91  18.440  -6.386 -10.920
  687    HD2  PHE  91           2HD      PHE  91  17.890  -5.008  -6.944
  688    HE1  PHE  91           1HE      PHE  91  20.816  -6.990 -10.382
  689    HE2  PHE  91           2HE      PHE  91  20.265  -5.613  -6.406
  690    HZ   PHE  91           HZ       PHE  91  21.700  -6.597  -8.131
  691    H    MET  92           H        MET  92  16.529  -6.714  -7.518
  692    HA   MET  92           HA       MET  92  14.760  -8.940  -7.092
  693   1HB   MET  92          1HB       MET  92  17.244  -7.866  -5.953
  694   2HB   MET  92          2HB       MET  92  16.090  -8.170  -4.669
  695   1HG   MET  92          1HG       MET  92  16.353 -10.426  -4.852
  696   2HG   MET  92          2HG       MET  92  16.080 -10.386  -6.582
  697   1HE   MET  92          1HE       MET  92  17.582 -11.309  -7.992
  698   2HE   MET  92          2HE       MET  92  19.307 -11.645  -7.708
  699   3HE   MET  92          3HE       MET  92  18.068 -12.452  -6.716
  700    H    GLY  93           H        GLY  93  14.118  -5.795  -7.277
  701   1HA   GLY  93          1HA       GLY  93  12.046  -5.925  -5.233
  702   2HA   GLY  93          2HA       GLY  93  13.228  -4.643  -5.058
  703    H    GLY  94           H        GLY  94  13.106  -2.799  -6.349
  704   1HA   GLY  94          1HA       GLY  94  12.064  -2.558  -8.872
  705   2HA   GLY  94          2HA       GLY  94  10.678  -2.405  -7.811
  706    H    GLY  95           H        GLY  95  10.442  -0.157  -8.486
  707   1HA   GLY  95          1HA       GLY  95  12.336   1.614  -7.073
  708   2HA   GLY  95          2HA       GLY  95  11.842   1.942  -8.722
  709    H    PHE  96           H        PHE  96  11.259   3.973  -7.129
  710    HA   PHE  96           HA       PHE  96   8.412   3.610  -6.509
  711   1HB   PHE  96          1HB       PHE  96  10.078   5.759  -5.195
  712   2HB   PHE  96          2HB       PHE  96   8.781   4.809  -4.499
  713    HD1  PHE  96           1HD      PHE  96  12.340   5.130  -4.904
  714    HD2  PHE  96           2HD      PHE  96   9.254   2.441  -3.784
  715    HE1  PHE  96           1HE      PHE  96  14.026   3.678  -3.741
  716    HE2  PHE  96           2HE      PHE  96  10.939   0.990  -2.622
  717    HZ   PHE  96           HZ       PHE  96  13.306   1.625  -2.614
  718    H    THR  97           H        THR  97   7.032   4.988  -7.550
  719    HA   THR  97           HA       THR  97   8.104   7.518  -8.542
  720    HB   THR  97           HB       THR  97   6.791   5.327 -10.229
  721    HG1  THR  97           1HG      THR  97   8.900   5.256 -11.032
  722   1HG2  THR  97          1HG2      THR  97   7.881   7.783 -11.515
  723   2HG2  THR  97          2HG2      THR  97   6.419   6.852 -11.919
  724   3HG2  THR  97          3HG2      THR  97   6.377   8.048 -10.601
  725    H    ILE  98           H        ILE  98   6.604   9.185  -8.688
  726    HA   ILE  98           HA       ILE  98   3.941   8.465  -7.674
  727    HB   ILE  98           HB       ILE  98   5.735  10.777  -6.966
  728   1HG1  ILE  98          1HG1      ILE  98   5.963   8.605  -5.735
  729   2HG1  ILE  98          2HG1      ILE  98   5.562   9.985  -4.732
  730   1HG2  ILE  98          1HG2      ILE  98   2.753  10.562  -6.828
  731   2HG2  ILE  98          2HG2      ILE  98   3.626  11.385  -5.512
  732   3HG2  ILE  98          3HG2      ILE  98   3.787  11.966  -7.187
  733   1HD1  ILE  98          1HD1      ILE  98   3.051   8.993  -5.520
  734   2HD1  ILE  98          2HD1      ILE  98   4.025   7.535  -5.215
  735   3HD1  ILE  98          3HD1      ILE  98   3.828   8.756  -3.936
  736    H    ARG  99           H        ARG  99   2.188   9.246  -8.798
  737    HA   ARG  99           HA       ARG  99   2.883  10.959 -11.048
  738   1HB   ARG  99          1HB       ARG  99   1.270   8.468 -10.854
  739   2HB   ARG  99          2HB       ARG  99   0.467   9.745 -11.745
  740   1HG   ARG  99          1HG       ARG  99   2.658  10.024 -13.079
  741   2HG   ARG  99          2HG       ARG  99   3.211   8.545 -12.319
  742   1HD   ARG  99          1HD       ARG  99   1.811   7.212 -13.575
  743   2HD   ARG  99          2HD       ARG  99   0.483   8.353 -13.499
  744    HE   ARG  99           HE       ARG  99   2.400   8.128 -15.634
  745   1HH1  ARG  99          2HH2      ARG  99   0.594  10.541 -13.818
  746   2HH1  ARG  99          1HH2      ARG  99   0.591  11.696 -15.109
  747   1HH2  ARG  99          2HH1      ARG  99   2.396   9.651 -17.338
  748   2HH2  ARG  99          1HH1      ARG  99   1.623  11.186 -17.124
  749    H    ASN 100           H        ASN 100   1.423  12.709 -11.543
  750    HA   ASN 100           HA       ASN 100  -0.593  13.122  -9.476
  751   1HB   ASN 100          1HB       ASN 100   1.560  14.886 -10.541
  752   2HB   ASN 100          2HB       ASN 100  -0.009  15.665 -10.479
  753   1HD2  ASN 100          1HD2      ASN 100  -0.479  16.663  -8.686
  754   2HD2  ASN 100          2HD2      ASN 100   0.111  16.311  -7.096
  755    HA   PRO 101           HA       PRO 101  -3.293  13.629 -12.897
  756   1HB   PRO 101          1HB       PRO 101  -5.339  15.053 -11.775
  757   2HB   PRO 101          2HB       PRO 101  -5.158  13.320 -11.582
  758   1HG   PRO 101          1HG       PRO 101  -4.603  15.470  -9.630
  759   2HG   PRO 101          2HG       PRO 101  -4.839  13.758  -9.340
  760   1HD   PRO 101          1HD       PRO 101  -2.341  15.168  -9.356
  761   2HD   PRO 101          2HD       PRO 101  -2.568  13.439  -9.181