*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   08-MAY-08   2K3I              
*TITLE     SOLUTION NMR STRUCTURE OF PROTEIN YIIS FROM SHIGELLA                  
*TITLE    2 FLEXNERI. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET            
*TITLE    3 SFR90                                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN YIIS;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SHIGELLA FLEXNERI 2A;                           
*SOURCE   3 STRAIN: SEROTYPE 2A;                                                 
*SOURCE   4 GENE: YIIS, S3747, SF4000;                                           
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21                                     
*KEYWDS    GFT NMR, PROTEIN STRUCTURE, PSI, NESG, STRUCTURAL GENOMICS,           
*KEYWDS   2 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS          
*KEYWDS   3 CONSORTIUM, UNKNOWN FUNCTION                                         
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.L.MILLS, K.K.SINGARAPU, A.ELETSKI, D.K.SUKUMARAN, D.WANG,           
*AUTHOR   2 M.JIANG, C.CICCOSANTI, R.XIAO, J.LIU, M.C.BARAN,                     
*AUTHOR   3 G.V.T.SWAPNA, T.B.ACTON, B.ROST, G.T.MONTELIONE,                     
*AUTHOR   4 T.SZYPERSKI, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)         
*REVDAT   1   08-JUL-08 2K3I    0                                                


  1 MET  HB3     2 ALA  H       5.19            #peak     5
  6 VAL  HB      7 VAL  H       4.20            #peak    33
  8 ASP  HA      9 LYS  H       3.17            #peak    42
  8 ASP  HB2     9 LYS  H       5.10            #peak    43
  8 ASP  HB3     9 LYS  H       5.10            #peak    44
  9 LYS  HB2    10 CYS  H       5.13            #peak    47
  9 LYS  HB3    10 CYS  H       5.13            #peak    48
 11 SER  H      12 THR  H       5.04            #peak    59
 11 SER  HB2    12 THR  H       5.50            #peak    61
 11 SER  HB3    12 THR  H       5.50            #peak    62
 12 THR  HB     13 LYS  H       5.31            #peak    65
 13 LYS  HB2    14 GLY  H       5.50            #peak    69
 13 LYS  HB3    14 GLY  H       5.50            #peak    70
 14 GLY  H      15 CYS  H       5.50            #peak    77
 17 ILE  HA     18 ASP  H       3.11            #peak    88
 17 ILE  HB     18 ASP  H       4.17            #peak    89
 18 ASP  H      19 ILE  H       4.35            #peak    94
 18 ASP  HB2    19 ILE  H       4.79            #peak    96
 18 ASP  HB3    19 ILE  H       4.79            #peak    97
 19 ILE  H      20 GLY  H       3.92            #peak    98
 19 ILE  HB     20 GLY  H       4.51            #peak   100
 20 GLY  H      21 THR  H       4.01            #peak   105
 21 THR  H      22 VAL  H       5.00            #peak   108
 21 THR  HA     22 VAL  H       3.14            #peak   109
 21 THR  HB     22 VAL  H       4.20            #peak   110
 22 VAL  HA     23 ILE  H       2.96            #peak   113
 22 VAL  HB     23 ILE  H       4.54            #peak   114
 23 ILE  HA     24 ASP  H       3.52            #peak   118
 23 ILE  HB     24 ASP  H       5.50            #peak   119
 24 ASP  HB2    25 ASN  H       5.50            #peak   126
 24 ASP  HB3    25 ASN  H       5.50            #peak   127
 25 ASN  HB2    26 ASP  H       4.54            #peak   130
 26 ASP  H      27 ASN  H       4.11            #peak   134
 26 ASP  HB3    27 ASN  H       4.97            #peak   137
 27 ASN  HA     28 CYS  H       3.45            #peak   139
 27 ASN  HB3    28 CYS  H       4.88            #peak   141
 28 CYS  HA     29 THR  H       3.52            #peak   145
 28 CYS  HB2    29 THR  H       5.13            #peak   146
 28 CYS  HB3    29 THR  H       5.13            #peak   147
 29 THR  HA     30 SER  H       3.21            #peak   149
 30 SER  H      31 LYS  H       5.10            #peak   152
 30 SER  HA     31 LYS  H       3.52            #peak   153
 30 SER  HB2    31 LYS  H       4.85            #peak   154
 30 SER  HB3    31 LYS  H       4.85            #peak   155
 31 LYS  HA     32 PHE  H       3.30            #peak   157
 32 PHE  H      33 SER  H       5.25            #peak   166
 32 PHE  HA     33 SER  H       3.11            #peak   167
 32 PHE  HB3    33 SER  H       4.76            #peak   169
 33 SER  HA     34 ARG  H       3.11            #peak   176
 33 SER  HB2    34 ARG  H       4.63            #peak   177
 33 SER  HB3    34 ARG  H       4.63            #peak   178
 34 ARG  HA     35 PHE  H       3.11            #peak   180
 34 ARG  HB2    35 PHE  H       4.14            #peak   181
 34 ARG  HB3    35 PHE  H       4.14            #peak   182
 35 PHE  HA     36 PHE  H       2.96            #peak   188
 35 PHE  HB2    36 PHE  H       4.07            #peak   189
 35 PHE  HB3    36 PHE  H       4.07            #peak   190
 36 PHE  HA     37 ALA  H       2.99            #peak   197
 36 PHE  HB2    37 ALA  H       4.11            #peak   198
 36 PHE  HB3    37 ALA  H       4.11            #peak   199
 38 THR  H      39 ARG  H       5.31            #peak   208
 38 THR  HA     39 ARG  H       3.02            #peak   209
 38 THR  HB     39 ARG  H       3.36            #peak   210
 39 ARG  H      40 GLU  H       3.48            #peak   212
 40 GLU  H      41 GLU  H       3.61            #peak   220
 40 GLU  HB3    41 GLU  H       3.83            #peak   223
 43 GLU  H      44 SER  H       3.48            #peak   235
 43 GLU  HB3    44 SER  H       4.11            #peak   238
 44 SER  H      45 PHE  H       3.36            #peak   241
 44 SER  HB2    45 PHE  H       4.35            #peak   243
 44 SER  HB3    45 PHE  H       4.35            #peak   244
 45 PHE  HB2    46 MET  H       4.20            #peak   247
 45 PHE  HB3    46 MET  H       4.20            #peak   248
 46 MET  H      47 THR  H       3.83            #peak   254
 46 MET  HB3    47 THR  H       5.10            #peak   257
 47 THR  HB     48 LYS  H       3.58            #peak   262
 49 LEU  H      50 LYS  H       3.64            #peak   274
 49 LEU  HB2    50 LYS  H       4.82            #peak   276
 49 LEU  HB3    50 LYS  H       4.82            #peak   277
 50 LYS  HB2    51 GLU  H       4.42            #peak   283
 50 LYS  HB3    51 GLU  H       4.42            #peak   284
 51 GLU  HB2    52 LEU  H       3.86            #peak   293
 52 LEU  HB2    53 ALA  H       3.79            #peak   299
 52 LEU  HB3    53 ALA  H       3.79            #peak   300
 53 ALA  H      54 ALA  H       3.58            #peak   304
 54 ALA  HA     55 ALA  H       3.52            #peak   308
 55 ALA  H      56 ALA  H       3.27            #peak   310
 57 SER  HA     58 SER  H       3.36            #peak   317
 57 SER  HB2    58 SER  H       4.72            #peak   318
 57 SER  HB3    58 SER  H       4.72            #peak   319
 58 SER  H      59 ALA  H       3.52            #peak   320
 58 SER  HB2    59 ALA  H       4.35            #peak   322
 58 SER  HB3    59 ALA  H       4.35            #peak   323
 59 ALA  HA     60 ASP  H       3.55            #peak   325
 61 GLU  H      62 GLY  H       3.79            #peak   331
 61 GLU  HA     62 GLY  H       3.52            #peak   332
 61 GLU  HB2    62 GLY  H       4.82            #peak   333
 61 GLU  HB3    62 GLY  H       4.82            #peak   334
 63 ALA  HA     64 SER  H       3.21            #peak   341
 64 SER  HA     65 VAL  H       2.83            #peak   344
 65 VAL  H      66 ALA  H       4.26            #peak   347
 65 VAL  HA     66 ALA  H       2.90            #peak   348
 65 VAL  HB     66 ALA  H       5.25            #peak   349
 66 ALA  HA     67 TYR  H       2.99            #peak   353
 67 TYR  HA     68 LYS  H       3.11            #peak   356
 67 TYR  HB2    68 LYS  H       5.22            #peak   357
 67 TYR  HB3    68 LYS  H       5.22            #peak   358
 68 LYS  H      69 ILE  H       5.47            #peak   363
 68 LYS  HA     69 ILE  H       2.80            #peak   364
 69 ILE  HA     70 LYS  H       2.93            #peak   374
 69 ILE  HB     70 LYS  H       4.60            #peak   375
 70 LYS  H      71 ASP  H       5.25            #peak   380
 70 LYS  HA     71 ASP  H       2.86            #peak   381
 70 LYS  HB2    71 ASP  H       4.17            #peak   382
 70 LYS  HB3    71 ASP  H       4.17            #peak   383
 71 ASP  H      72 LEU  H       5.50            #peak   390
 71 ASP  HA     72 LEU  H       3.55            #peak   391
 71 ASP  HB2    72 LEU  H       4.57            #peak   392
 71 ASP  HB3    72 LEU  H       4.57            #peak   393
 72 LEU  HA     73 GLU  H       3.30            #peak   395
 73 GLU  HA     74 GLY  H       2.99            #peak   402
 73 GLU  HB3    74 GLY  H       4.85            #peak   404
 75 GLN  H      76 VAL  H       4.97            #peak   410
 75 GLN  HA     76 VAL  H       3.17            #peak   411
 76 VAL  HA     77 GLU  H       3.08            #peak   419
 76 VAL  HB     77 GLU  H       4.32            #peak   420
 77 GLU  HA     78 LEU  H       3.17            #peak   424
 77 GLU  HB2    78 LEU  H       5.13            #peak   425
 77 GLU  HB3    78 LEU  H       5.13            #peak   426
 78 LEU  H      79 ASP  H       4.85            #peak   429
 78 LEU  HA     79 ASP  H       3.24            #peak   430
 78 LEU  HB2    79 ASP  H       4.91            #peak   431
 78 LEU  HB3    79 ASP  H       4.91            #peak   432
 79 ASP  HA     80 ALA  H       3.05            #peak   437
 80 ALA  HA     81 ALA  H       3.30            #peak   441
 81 ALA  HA     82 PHE  H       3.11            #peak   444
 82 PHE  H      83 THR  H       4.91            #peak   446
 82 PHE  HA     83 THR  H       2.96            #peak   447
 82 PHE  HB3    83 THR  H       4.66            #peak   449
 83 THR  HA     84 PHE  H       3.27            #peak   456
 83 THR  HB     84 PHE  H       4.72            #peak   457
 84 PHE  HA     85 SER  H       3.17            #peak   460
 84 PHE  HB2    85 SER  H       4.82            #peak   461
 85 SER  HB2    86 CYS  H       5.13            #peak   470
 85 SER  HB3    86 CYS  H       5.13            #peak   471
 86 CYS  HA     87 GLN  H       3.39            #peak   473
 87 GLN  H      88 ALA  H       3.83            #peak   476
 87 GLN  HB2    88 ALA  H       4.63            #peak   478
 87 GLN  HB3    88 ALA  H       4.63            #peak   479
 88 ALA  H      89 GLU  H       3.73            #peak   484
 89 GLU  H      90 MET  H       3.42            #peak   487
 89 GLU  HB2    90 MET  H       5.19            #peak   489
 90 MET  HB2    91 ILE  H       4.35            #peak   495
 90 MET  HB3    91 ILE  H       4.35            #peak   496
 92 ILE  H      93 PHE  H       3.67            #peak   506
 92 ILE  HB     93 PHE  H       3.89            #peak   508
 93 PHE  H      94 GLU  H       3.83            #peak   513
 93 PHE  HB3    94 GLU  H       4.26            #peak   516
 94 GLU  HB2    95 LEU  H       5.31            #peak   524
 94 GLU  HB3    95 LEU  H       5.31            #peak   525
 95 LEU  H      96 SER  H       3.48            #peak   528
 95 LEU  HB2    96 SER  H       3.83            #peak   530
 95 LEU  HB3    96 SER  H       3.83            #peak   531
 96 SER  HB2    97 LEU  H       5.41            #peak   537
 96 SER  HB3    97 LEU  H       5.41            #peak   538
 97 LEU  HB2    98 ARG  H       4.17            #peak   541
 97 LEU  HB3    98 ARG  H       4.17            #peak   542
 98 ARG  HB3    99 SER  H       5.44            #peak   549
100 LEU  H     101 ALA  H       3.45            #peak   558
102 LEU  HB2   103 GLU  H       4.42            #peak   570
  9 LYS  H       9 LYS  HB2     4.04            #peak   656
  9 LYS  H       9 LYS  HB3     4.04            #peak   657
 15 CYS  H      15 CYS  HA      2.93            #peak   690
 18 ASP  H      18 ASP  HB2     3.58            #peak   705
 18 ASP  H      18 ASP  HB3     3.58            #peak   706
 21 THR  H      21 THR  HB      3.61            #peak   719
 22 VAL  H      22 VAL  HB      3.67            #peak   723
 23 ILE  H      23 ILE  HB      3.52            #peak   728
 26 ASP  H      26 ASP  HB3     4.07            #peak   746
 29 THR  H      29 THR  HB      3.36            #peak   759
 31 LYS  H      31 LYS  HB2     4.04            #peak   767
 31 LYS  H      31 LYS  HB3     4.04            #peak   768
 40 GLU  H      40 GLU  HB2     3.27            #peak   831
 41 GLU  H      41 GLU  HB3     3.89            #peak   838
 43 GLU  H      43 GLU  HB3     3.76            #peak   847
 44 SER  H      44 SER  HB2     3.98            #peak   852
 44 SER  H      44 SER  HB3     3.98            #peak   853
 45 PHE  H      45 PHE  HB2     3.36            #peak   856
 45 PHE  H      45 PHE  HB3     3.36            #peak   857
 47 THR  H      47 THR  HB      3.61            #peak   871
 48 LYS  H      48 LYS  HB3     3.64            #peak   876
 50 LYS  H      50 LYS  HB2     4.04            #peak   892
 50 LYS  H      50 LYS  HB3     4.04            #peak   893
 52 LEU  H      52 LEU  HB2     4.04            #peak   908
 57 SER  H      57 SER  HB2     4.04            #peak   927
 57 SER  H      57 SER  HB3     4.04            #peak   928
 61 GLU  H      61 GLU  HB3     3.83            #peak   943
 65 VAL  H      65 VAL  HB      3.30            #peak   958
 73 GLU  H      73 GLU  HB3     3.67            #peak  1013
 77 GLU  H      77 GLU  HB2     4.07            #peak  1034
 77 GLU  H      77 GLU  HB3     4.07            #peak  1035
 78 LEU  H      78 LEU  HB2     4.01            #peak  1040
 83 THR  H      83 THR  HB      3.55            #peak  1066
 85 SER  H      85 SER  HB2     4.11            #peak  1079
 85 SER  H      85 SER  HB3     4.11            #peak  1080
 87 GLN  H      87 GLN  HB2     4.20            #peak  1087
 87 GLN  H      87 GLN  HB3     4.20            #peak  1088
 89 GLU  H      89 GLU  HB2     3.98            #peak  1098
 89 GLU  H      89 GLU  HB3     3.98            #peak  1099
 93 PHE  H      93 PHE  HB2     3.45            #peak  1124
 93 PHE  H      93 PHE  HB3     3.45            #peak  1125
 96 SER  H      96 SER  HB2     4.04            #peak  1146
 96 SER  H      96 SER  HB3     4.04            #peak  1147
 98 ARG  H      98 ARG  HB2     3.67            #peak  1157
 98 ARG  H      98 ARG  HB3     3.67            #peak  1158
100 LEU  H     100 LEU  HB3     3.83            #peak  1170
102 LEU  H     102 LEU  HB2     3.98            #peak  1179
  2 ALA  H       3 MET  H       5.50            #peak  1227
  5 ASP  H       6 VAL  H       5.34            #peak  1230
 12 THR  H      13 LYS  H       4.32            #peak  1237
 27 ASN  H      28 CYS  H       4.38            #peak  1252
 28 CYS  H      29 THR  H       3.33            #peak  1253
 29 THR  H      30 SER  H       5.50            #peak  1254
 31 LYS  H      32 PHE  H       4.72            #peak  1256
 33 SER  H      34 ARG  H       5.50            #peak  1258
 34 ARG  H      35 PHE  H       5.50            #peak  1259
 35 PHE  H      36 PHE  H       5.38            #peak  1260
 36 PHE  H      37 ALA  H       5.34            #peak  1261
 37 ALA  H      38 THR  H       3.83            #peak  1262
 41 GLU  H      42 ALA  H       3.36            #peak  1266
 42 ALA  H      43 GLU  H       3.48            #peak  1267
 45 PHE  H      46 MET  H       3.45            #peak  1270
 47 THR  H      48 LYS  H       3.73            #peak  1272
 48 LYS  H      49 LEU  H       3.70            #peak  1273
 50 LYS  H      51 GLU  H       3.58            #peak  1275
 51 GLU  H      52 LEU  H       3.42            #peak  1276
 52 LEU  H      53 ALA  H       3.70            #peak  1277
 54 ALA  H      55 ALA  H       3.58            #peak  1279
 57 SER  H      58 SER  H       4.45            #peak  1282
 59 ALA  H      60 ASP  H       4.14            #peak  1284
 63 ALA  H      64 SER  H       4.91            #peak  1288
 64 SER  H      65 VAL  H       5.41            #peak  1289
 66 ALA  H      67 TYR  H       4.85            #peak  1291
 67 TYR  H      68 LYS  H       4.66            #peak  1292
 69 ILE  H      70 LYS  H       4.91            #peak  1294
 72 LEU  H      73 GLU  H       5.07            #peak  1297
 73 GLU  H      74 GLY  H       4.60            #peak  1298
 74 GLY  H      75 GLN  H       3.55            #peak  1299
 79 ASP  H      80 ALA  H       4.79            #peak  1304
 80 ALA  H      81 ALA  H       5.04            #peak  1305
 81 ALA  H      82 PHE  H       4.82            #peak  1306
 83 THR  H      84 PHE  H       4.91            #peak  1308
 84 PHE  H      85 SER  H       5.07            #peak  1309
 85 SER  H      86 CYS  H       3.83            #peak  1310
 86 CYS  H      87 GLN  H       5.10            #peak  1311
 90 MET  H      91 ILE  H       3.64            #peak  1315
 91 ILE  H      92 ILE  H       3.76            #peak  1316
 94 GLU  H      95 LEU  H       3.79            #peak  1319
 96 SER  H      97 LEU  H       3.48            #peak  1321
 99 SER  H     100 LEU  H       3.86            #peak  1324
102 LEU  H     103 GLU  H       3.67            #peak  1327
 30 SER  H      84 PHE  H       5.50            #peak  5227
 34 ARG  H      78 LEU  H       4.01            #peak  5243
 34 ARG  H      80 ALA  H       5.50            #peak  5244
 36 PHE  H      76 VAL  H       3.67            #peak  5283
 38 THR  H      40 GLU  H       5.50            #peak  5297
 39 ARG  H      41 GLU  H       5.28            #peak  5302
 41 GLU  H      43 GLU  H       4.79            #peak  5303
 38 THR  H      41 GLU  H       4.48            #peak  5304
 42 ALA  H      44 SER  H       4.94            #peak  5317
 40 GLU  H      42 ALA  H       4.82            #peak  5318
 39 ARG  H      42 ALA  H       5.50            #peak  5319
 40 GLU  H      43 GLU  H       5.50            #peak  5335
 43 GLU  H      45 PHE  H       4.88            #peak  5341
 44 SER  H      46 MET  H       5.50            #peak  5344
 47 THR  H      50 LYS  H       5.50            #peak  5357
 48 LYS  H      50 LYS  H       5.00            #peak  5359
 46 MET  H      48 LYS  H       5.50            #peak  5360
 50 LYS  H      52 LEU  H       5.50            #peak  5389
 51 GLU  H      53 ALA  H       5.19            #peak  5393
 49 LEU  H      51 GLU  H       5.50            #peak  5394
 54 ALA  H      56 ALA  H       5.31            #peak  5425
 53 ALA  H      55 ALA  H       4.94            #peak  5432
 55 ALA  H      57 SER  H       4.38            #peak  5442
 64 SER  H      83 THR  H       3.86            #peak  5464
 66 ALA  H      81 ALA  H       3.70            #peak  5475
 70 LYS  H      77 GLU  H       4.57            #peak  5510
 72 LEU  H      77 GLU  H       4.29            #peak  5521
 72 LEU  H      75 GLN  H       4.54            #peak  5524
 71 ASP  H      77 GLU  H       5.50            #peak  5529
 73 GLU  H      75 GLN  H       5.28            #peak  5544
 68 LYS  H      79 ASP  H       4.01            #peak  5580
 32 PHE  H      80 ALA  H       4.20            #peak  5585
 32 PHE  H      81 ALA  H       5.13            #peak  5589
 30 SER  H      82 PHE  H       4.26            #peak  5600
 30 SER  H      83 THR  H       5.50            #peak  5611
 86 CYS  H      88 ALA  H       5.38            #peak  5616
 88 ALA  H      90 MET  H       5.22            #peak  5628
 86 CYS  H      89 GLU  H       5.50            #peak  5635
 87 GLN  H      89 GLU  H       5.50            #peak  5636
 87 GLN  H      90 MET  H       5.50            #peak  5641
 90 MET  H      93 PHE  H       5.50            #peak  5642
 86 CYS  H      90 MET  H       5.50            #peak  5643
 90 MET  H      92 ILE  H       5.19            #peak  5644
 89 GLU  H      91 ILE  H       5.04            #peak  5650
 91 ILE  H      93 PHE  H       5.07            #peak  5663
 93 PHE  H      95 LEU  H       5.50            #peak  5664
 95 LEU  H      98 ARG  H       5.50            #peak  5686
 94 GLU  H      96 SER  H       5.25            #peak  5689
 96 SER  H      98 ARG  H       5.50            #peak  5708
100 LEU  H     102 LEU  H       5.25            #peak  5725
 28 CYS  H      29 THR  HB      5.13            #peak  5789
 27 ASN  HA     29 THR  H       5.19            #peak  5797
 29 THR  H      83 THR  HA      5.50            #peak  5798
 30 SER  H      31 LYS  HA      5.50            #peak  5816
 30 SER  H      81 ALA  HA      5.50            #peak  5817
 30 SER  H      82 PHE  HA      4.72            #peak  5818
 31 LYS  H      81 ALA  HA      5.50            #peak  5831
 32 PHE  H      33 SER  HA      5.50            #peak  5863
 34 ARG  H      35 PHE  HA      5.50            #peak  5896
 34 ARG  H      79 ASP  HA      4.63            #peak  5897
 34 ARG  H      78 LEU  HA      5.50            #peak  5899
 35 PHE  H      77 GLU  HA      5.50            #peak  5913
 36 PHE  H      76 VAL  HA      5.50            #peak  5940
 36 PHE  H      75 GLN  HA      5.50            #peak  5941
 36 PHE  H      37 ALA  HA      5.50            #peak  5942
 37 ALA  H      75 GLN  HA      5.28            #peak  5973
 38 THR  HB     40 GLU  H       3.45            #peak  6019
 38 THR  HA     40 GLU  H       4.26            #peak  6020
 39 ARG  HA     41 GLU  H       5.38            #peak  6050
 38 THR  HB     41 GLU  H       4.88            #peak  6051
 39 ARG  HA     42 ALA  H       4.07            #peak  6078
 40 GLU  HB3    42 ALA  H       5.10            #peak  6081
 39 ARG  HA     43 GLU  H       5.13            #peak  6127
 42 ALA  HA     44 SER  H       4.85            #peak  6148
 42 ALA  HA     45 PHE  H       4.14            #peak  6157
 43 GLU  HA     46 MET  H       5.22            #peak  6180
 44 SER  HA     46 MET  H       5.50            #peak  6181
 42 ALA  HA     46 MET  H       4.82            #peak  6183
 44 SER  HA     47 THR  H       4.07            #peak  6213
 44 SER  HA     48 LYS  H       5.31            #peak  6223
 46 MET  HA     49 LEU  H       4.51            #peak  6238
 48 LYS  HA     50 LYS  H       4.60            #peak  6302
 46 MET  HA     50 LYS  H       5.41            #peak  6303
 49 LEU  HA     51 GLU  H       4.66            #peak  6326
 49 LEU  HA     52 LEU  H       4.11            #peak  6343
 50 LYS  HA     53 ALA  H       4.29            #peak  6364
 53 ALA  HA     55 ALA  H       4.76            #peak  6391
 53 ALA  HA     56 ALA  H       4.17            #peak  6396
 57 SER  HA     59 ALA  H       4.97            #peak  6449
 60 ASP  HA     62 GLY  H       4.66            #peak  6467
 66 ALA  H      67 TYR  HA      5.50            #peak  6545
 67 TYR  H      80 ALA  HA      5.38            #peak  6551
 68 LYS  H      79 ASP  HA      5.38            #peak  6594
 68 LYS  H      80 ALA  HA      4.23            #peak  6595
 68 LYS  H      78 LEU  HA      4.97            #peak  6596
 69 ILE  H      70 LYS  HA      5.44            #peak  6615
 70 LYS  H      76 VAL  HA      5.00            #peak  6651
 70 LYS  H      77 GLU  HA      4.79            #peak  6652
 71 ASP  H      76 VAL  HA      5.50            #peak  6662
 72 LEU  H      76 VAL  HA      3.45            #peak  6667
 72 LEU  H      76 VAL  HB      4.38            #peak  6668
 72 LEU  HA     74 GLY  H       5.50            #peak  6688
 72 LEU  HB2    75 GLN  H       4.79            #peak  6696
 72 LEU  HB3    75 GLN  H       4.79            #peak  6697
 35 PHE  HA     76 VAL  H       5.10            #peak  6717
 76 VAL  H      77 GLU  HA      4.82            #peak  6718
 37 ALA  HA     76 VAL  H       4.57            #peak  6719
 70 LYS  HA     77 GLU  H       5.50            #peak  6752
 69 ILE  HA     77 GLU  H       5.28            #peak  6753
 35 PHE  HA     77 GLU  H       5.50            #peak  6754
 35 PHE  HA     78 LEU  H       4.29            #peak  6763
 33 SER  HA     78 LEU  H       5.50            #peak  6764
 67 TYR  HA     79 ASP  H       4.91            #peak  6778
 67 TYR  HA     80 ALA  H       5.50            #peak  6808
 33 SER  HA     80 ALA  H       4.32            #peak  6809
 31 LYS  HA     81 ALA  H       4.69            #peak  6829
 67 TYR  HA     81 ALA  H       3.95            #peak  6830
 66 ALA  HA     81 ALA  H       5.50            #peak  6831
 65 VAL  HA     81 ALA  H       5.47            #peak  6832
 65 VAL  HA     82 PHE  H       5.50            #peak  6852
 31 LYS  HA     82 PHE  H       4.26            #peak  6853
 29 THR  HA     82 PHE  H       5.50            #peak  6854
 30 SER  HA     82 PHE  H       5.50            #peak  6876
 64 SER  HA     83 THR  H       5.44            #peak  6878
 65 VAL  HA     83 THR  H       4.23            #peak  6879
 63 ALA  HA     83 THR  H       5.50            #peak  6880
 29 THR  HA     84 PHE  H       4.32            #peak  6901
 85 SER  H      86 CYS  HA      5.50            #peak  6927
 85 SER  H      89 GLU  HB2     5.50            #peak  6928
 85 SER  H      89 GLU  HB3     5.50            #peak  6929
 84 PHE  HB2    86 CYS  H       3.98            #peak  6932
 84 PHE  HB3    86 CYS  H       3.98            #peak  6933
 86 CYS  H      89 GLU  HB2     4.82            #peak  6935
 86 CYS  H      89 GLU  HB3     4.82            #peak  6937
 86 CYS  HA     88 ALA  H       4.97            #peak  6982
 86 CYS  HB3    88 ALA  H       4.82            #peak  6984
 86 CYS  HB3    89 GLU  H       5.50            #peak  6994
 86 CYS  HB2    89 GLU  H       5.50            #peak  6995
 87 GLN  HA     90 MET  H       3.98            #peak  7012
 89 GLU  HA     92 ILE  H       4.38            #peak  7055
 88 ALA  HA     92 ILE  H       4.88            #peak  7056
 89 GLU  HA     93 PHE  H       5.07            #peak  7080
 90 MET  HA     93 PHE  H       4.35            #peak  7083
 91 ILE  HA     94 GLU  H       3.92            #peak  7115
 90 MET  HA     94 GLU  H       4.82            #peak  7117
 92 ILE  HA     96 SER  H       4.91            #peak  7174
 93 PHE  HA     97 LEU  H       4.91            #peak  7195
 94 GLU  HA     98 ARG  H       5.16            #peak  7240
 96 SER  HA     98 ARG  H       4.48            #peak  7242
 96 SER  HA     99 SER  H       5.19            #peak  7262
 97 LEU  HA     99 SER  H       5.50            #peak  7264
 98 ARG  HA    100 LEU  H       5.16            #peak  7298
 98 ARG  HA    101 ALA  H       4.54            #peak  7321
 69 ILE  H      79 ASP  H       4.97            #peak  7364
 17 ILE  HG12   18 ASP  H       5.31            #peak    91
 17 ILE  HG13   18 ASP  H       5.31            #peak    92
 19 ILE  HG13   20 GLY  H       5.50            #peak   103
 23 ILE  HG12   24 ASP  H       5.50            #peak   121
 23 ILE  HG13   24 ASP  H       5.50            #peak   122
 25 ASN  HD21   26 ASP  H       5.50            #peak   132
 25 ASN  HD22   26 ASP  H       5.50            #peak   133
 31 LYS  HG3    32 PHE  H       5.50            #peak   161
 31 LYS  HD2    32 PHE  H       5.50            #peak   162
 31 LYS  HD3    32 PHE  H       5.50            #peak   163
 39 ARG  HG3    40 GLU  H       5.50            #peak   217
 40 GLU  HG2    41 GLU  H       4.76            #peak   224
 40 GLU  HG3    41 GLU  H       4.76            #peak   225
 41 GLU  HG2    42 ALA  H       5.50            #peak   230
 43 GLU  HG3    44 SER  H       5.50            #peak   240
 46 MET  HG2    47 THR  H       5.47            #peak   258
 46 MET  HG3    47 THR  H       5.47            #peak   259
 48 LYS  HG2    49 LEU  H       4.94            #peak   268
 48 LYS  HG3    49 LEU  H       4.94            #peak   269
 50 LYS  HG2    51 GLU  H       5.50            #peak   285
 50 LYS  HG3    51 GLU  H       5.50            #peak   286
 50 LYS  HD2    51 GLU  H       5.47            #peak   287
 50 LYS  HD3    51 GLU  H       5.47            #peak   288
 51 GLU  HG2    52 LEU  H       4.82            #peak   295
 51 GLU  HG3    52 LEU  H       4.82            #peak   296
 52 LEU  HG     53 ALA  H       4.57            #peak   301
 67 TYR  QD     68 LYS  H       6.88            #peak   362
 68 LYS  HG2    69 ILE  H       4.60            #peak   367
 68 LYS  HG3    69 ILE  H       4.60            #peak   368
 69 ILE  HG12   70 LYS  H       5.50            #peak   377
 69 ILE  HG13   70 LYS  H       5.50            #peak   378
 70 LYS  HG2    71 ASP  H       5.44            #peak   384
 70 LYS  HG3    71 ASP  H       5.44            #peak   385
 72 LEU  HG     73 GLU  H       4.66            #peak   398
 73 GLU  HG3    74 GLY  H       5.50            #peak   406
 75 GLN  HG2    76 VAL  H       5.22            #peak   414
 77 GLU  HG2    78 LEU  H       4.85            #peak   427
 77 GLU  HG3    78 LEU  H       4.85            #peak   428
 78 LEU  HG     79 ASP  H       4.85            #peak   433
 82 PHE  QD     83 THR  H       7.07            #peak   450
 84 PHE  QD     85 SER  H       7.47            #peak   463
 87 GLN  HG3    88 ALA  H       5.50            #peak   481
 89 GLU  HG2    90 MET  H       5.50            #peak   491
 89 GLU  HG3    90 MET  H       5.50            #peak   492
 90 MET  HG2    91 ILE  H       5.22            #peak   497
 90 MET  HG3    91 ILE  H       5.22            #peak   498
 92 ILE  HG13   93 PHE  H       5.50            #peak   511
 93 PHE  QD     94 GLU  H       7.07            #peak   517
 94 GLU  HG2    95 LEU  H       5.50            #peak   526
 94 GLU  HG3    95 LEU  H       5.50            #peak   527
 95 LEU  HG     96 SER  H       4.88            #peak   532
 97 LEU  HG     98 ARG  H       4.57            #peak   543
 98 ARG  HG2    99 SER  H       5.22            #peak   550
 98 ARG  HG3    99 SER  H       5.22            #peak   551
100 LEU  HG    101 ALA  H       4.32            #peak   562
102 LEU  HG    103 GLU  H       5.25            #peak   572
  9 LYS  H       9 LYS  HG2     5.50            #peak   658
  9 LYS  H       9 LYS  HG3     5.50            #peak   659
 13 LYS  H      13 LYS  HG2     5.50            #peak   680
 13 LYS  H      13 LYS  HG3     5.50            #peak   681
 19 ILE  H      19 ILE  HG12    3.83            #peak   711
 19 ILE  H      19 ILE  HG13    3.83            #peak   712
 23 ILE  H      23 ILE  HG12    5.31            #peak   730
 23 ILE  H      23 ILE  HG13    5.31            #peak   731
 31 LYS  H      31 LYS  HG2     4.38            #peak   769
 31 LYS  H      31 LYS  HG3     4.38            #peak   770
 31 LYS  H      31 LYS  HD2     5.50            #peak   771
 31 LYS  H      31 LYS  HD3     5.50            #peak   772
 34 ARG  H      34 ARG  HG2     5.19            #peak   792
 34 ARG  H      34 ARG  HG3     5.19            #peak   793
 39 ARG  H      39 ARG  HG2     5.16            #peak   825
 39 ARG  H      39 ARG  HG3     5.16            #peak   826
 40 GLU  H      40 GLU  HG2     3.89            #peak   833
 40 GLU  H      40 GLU  HG3     3.89            #peak   834
 41 GLU  H      41 GLU  HG2     4.29            #peak   839
 43 GLU  H      43 GLU  HG3     3.83            #peak   849
 46 MET  H      46 MET  HG2     4.79            #peak   867
 46 MET  H      46 MET  HG3     4.79            #peak   868
 48 LYS  H      48 LYS  HG2     4.48            #peak   877
 48 LYS  H      48 LYS  HG3     4.48            #peak   878
 48 LYS  H      48 LYS  HD2     5.47            #peak   879
 50 LYS  H      50 LYS  HG2     5.50            #peak   894
 50 LYS  H      50 LYS  HD2     3.89            #peak   896
 50 LYS  H      50 LYS  HD3     3.89            #peak   897
 50 LYS  H      50 LYS  HE2     5.50            #peak   898
 50 LYS  H      50 LYS  HE3     5.50            #peak   899
 51 GLU  H      51 GLU  HG2     3.61            #peak   904
 51 GLU  H      51 GLU  HG3     3.61            #peak   905
 52 LEU  H      52 LEU  HG      2.80            #peak   910
 61 GLU  H      61 GLU  HG2     4.69            #peak   944
 61 GLU  H      61 GLU  HG3     4.69            #peak   945
 68 LYS  H      68 LYS  HG2     4.26            #peak   976
 68 LYS  H      68 LYS  HG3     4.26            #peak   977
 69 ILE  H      69 ILE  HG12    5.50            #peak   986
 69 ILE  H      69 ILE  HG13    5.50            #peak   987
 70 LYS  H      70 LYS  HG2     4.79            #peak   993
 70 LYS  H      70 LYS  HG3     4.79            #peak   994
 72 LEU  H      72 LEU  HG      3.36            #peak  1007
 73 GLU  H      73 GLU  HG2     4.82            #peak  1014
 73 GLU  H      73 GLU  HG3     4.82            #peak  1015
 75 GLN  H      75 GLN  HG2     4.48            #peak  1023
 75 GLN  H      75 GLN  HG3     4.48            #peak  1024
 77 GLU  H      77 GLU  HG2     4.79            #peak  1036
 77 GLU  H      77 GLU  HG3     4.79            #peak  1037
 78 LEU  H      78 LEU  HG      4.79            #peak  1042
 82 PHE  H      82 PHE  QE      7.63            #peak  1060
 84 PHE  H      84 PHE  QE      7.63            #peak  1073
 87 GLN  H      87 GLN  HG2     4.69            #peak  1089
 87 GLN  H      87 GLN  HG3     4.69            #peak  1090
 89 GLU  H      89 GLU  HG2     3.64            #peak  1100
 89 GLU  H      89 GLU  HG3     3.64            #peak  1101
 90 MET  H      90 MET  HG2     5.04            #peak  1106
 90 MET  H      90 MET  HG3     5.04            #peak  1107
 91 ILE  H      91 ILE  HG12    3.30            #peak  1112
 91 ILE  H      91 ILE  HG13    3.30            #peak  1113
 92 ILE  H      92 ILE  HG12    5.04            #peak  1119
 92 ILE  H      92 ILE  HG13    5.04            #peak  1120
 93 PHE  H      93 PHE  QE      7.63            #peak  1127
 94 GLU  H      94 GLU  HG2     3.95            #peak  1135
 94 GLU  H      94 GLU  HG3     3.95            #peak  1136
 97 LEU  H      97 LEU  HG      3.02            #peak  1152
 98 ARG  H      98 ARG  HG2     5.31            #peak  1159
 98 ARG  H      98 ARG  HG3     5.31            #peak  1160
 98 ARG  H      98 ARG  HD2     5.50            #peak  1161
 98 ARG  H      98 ARG  HD3     5.50            #peak  1162
100 LEU  H     100 LEU  HG      5.10            #peak  1171
102 LEU  H     102 LEU  HG      3.89            #peak  1181
103 GLU  H     103 GLU  HG3     4.91            #peak  1189
 25 ASN  HA     25 ASN  HD21    5.50            #peak  5132
 25 ASN  HA     25 ASN  HD22    5.50            #peak  5136
 25 ASN  H      25 ASN  HD21    5.50            #peak  5145
 25 ASN  H      25 ASN  HD22    5.50            #peak  5146
 75 GLN  HB2    75 GLN  HE22    5.50            #peak  5156
 75 GLN  HB3    75 GLN  HE21    5.50            #peak  5157
 75 GLN  HB3    75 GLN  HE22    5.50            #peak  5160
 87 GLN  HB3    87 GLN  HE21    5.50            #peak  5168
 87 GLN  HB2    87 GLN  HE22    5.50            #peak  5173
 87 GLN  HB3    87 GLN  HE22    5.50            #peak  5174
 30 SER  H      84 PHE  QD      7.63            #peak  5224
 30 SER  H      82 PHE  QD      7.63            #peak  5226
 32 PHE  QD     34 ARG  H       7.63            #peak  5245
 32 PHE  QE     34 ARG  H       7.63            #peak  5246
 34 ARG  H      36 PHE  QE      7.63            #peak  5247
 52 LEU  H      93 PHE  QE      7.63            #peak  5397
 53 ALA  H      93 PHE  QE      7.11            #peak  5413
 53 ALA  H      82 PHE  QD      7.29            #peak  5415
 57 SER  H      84 PHE  QE      7.63            #peak  5440
 67 TYR  QD     69 ILE  H       7.63            #peak  5495
 35 PHE  QD     76 VAL  H       7.63            #peak  5553
 36 PHE  QD     78 LEU  H       7.04            #peak  5565
 36 PHE  QE     78 LEU  H       7.63            #peak  5566
 67 TYR  QD     79 ASP  H       7.63            #peak  5581
 81 ALA  H      82 PHE  QD      7.63            #peak  5591
 84 PHE  QD     86 CYS  H       7.63            #peak  5617
 84 PHE  QD     90 MET  H       7.63            #peak  5645
 30 SER  H      82 PHE  HB2     5.50            #peak  5819
 30 SER  H      82 PHE  HB3     5.50            #peak  5822
 34 ARG  H      78 LEU  HG      5.50            #peak  5901
 36 PHE  H      75 GLN  HB2     5.38            #peak  5943
 36 PHE  H      75 GLN  HB3     5.38            #peak  5944
 36 PHE  H      76 VAL  HB      4.72            #peak  5945
 45 PHE  H      78 LEU  HG      4.63            #peak  6161
 68 LYS  H      79 ASP  HB2     5.10            #peak  6598
 68 LYS  H      79 ASP  HB3     5.10            #peak  6600
 72 LEU  HB2    75 GLN  HE21    7.23            #peak  6712
 72 LEU  HB3    75 GLN  HE21    7.23            #peak  6713
 72 LEU  HG     77 GLU  H       4.76            #peak  6751
 32 PHE  HB2    80 ALA  H       5.50            #peak  6812
 32 PHE  HB3    80 ALA  H       5.50            #peak  6813
 30 SER  HB3    82 PHE  H       5.50            #peak  6850
 30 SER  HB2    82 PHE  H       5.50            #peak  6851
 65 VAL  HB     83 THR  H       5.50            #peak  6889
 28 CYS  HB2    84 PHE  H       5.50            #peak  6902
 25 ASN  HB2    87 GLN  HE21    6.58            #peak  6968
 28 CYS  HA     87 GLN  HE21    5.50            #peak  6971
 25 ASN  HB2    87 GLN  HE22    6.58            #peak  6976
 28 CYS  HA     87 GLN  HE22    5.50            #peak  6980
 89 GLU  H      91 ILE  HG12    5.50            #peak  7001
 89 GLU  H      91 ILE  HG13    5.50            #peak  7003
 90 MET  H      91 ILE  HG12    5.50            #peak  7019
 90 MET  H      91 ILE  HG13    5.50            #peak  7021
 91 ILE  H      94 GLU  HG2     5.50            #peak  7030
 91 ILE  H      94 GLU  HG3     5.50            #peak  7031
 94 GLU  H      97 LEU  HG      4.35            #peak  7122
 19 ILE  HG13   96 SER  H       5.50            #peak  7179
 64 SER  H      83 THR  HB      4.54            #peak  7333
 32 PHE  H      82 PHE  QD      7.63            #peak  7348
 39 ARG  HB3    39 ARG  HE      5.50            #peak  7440
  7 VAL  QG1     8 ASP  H       6.52            #peak    39
  7 VAL  QG2     8 ASP  H       6.52            #peak    40
 17 ILE  QG2    18 ASP  H       5.59            #peak    90
 17 ILE  QD1    18 ASP  H       5.44            #peak    93
 19 ILE  QG2    20 GLY  H       4.91            #peak   101
 19 ILE  QD1    20 GLY  H       6.52            #peak   104
 21 THR  QG2    22 VAL  H       4.63            #peak   111
 29 THR  QG2    30 SER  H       4.10            #peak   151
 38 THR  QG2    39 ARG  H       4.13            #peak   211
 42 ALA  QB     43 GLU  H       3.73            #peak   234
 47 THR  QG2    48 LYS  H       4.53            #peak   263
 49 LEU  QD1    50 LYS  H       5.96            #peak   279
 49 LEU  QD2    50 LYS  H       5.77            #peak   280
 52 LEU  QD1    53 ALA  H       6.52            #peak   302
 52 LEU  QD2    53 ALA  H       6.05            #peak   303
 53 ALA  QB     54 ALA  H       3.70            #peak   306
 54 ALA  QB     55 ALA  H       3.88            #peak   309
 56 ALA  QB     57 SER  H       3.98            #peak   315
 59 ALA  QB     60 ASP  H       4.19            #peak   326
 63 ALA  QB     64 SER  H       3.60            #peak   342
 65 VAL  QG1    66 ALA  H       4.97            #peak   350
 65 VAL  QG2    66 ALA  H       4.16            #peak   351
 66 ALA  QB     67 TYR  H       4.16            #peak   354
 69 ILE  QG2    70 LYS  H       3.91            #peak   376
 76 VAL  QG1    77 GLU  H       4.29            #peak   421
 76 VAL  QG2    77 GLU  H       5.03            #peak   422
 78 LEU  QD1    79 ASP  H       5.71            #peak   434
 78 LEU  QD2    79 ASP  H       3.82            #peak   435
 80 ALA  QB     81 ALA  H       3.64            #peak   442
 81 ALA  QB     82 PHE  H       4.04            #peak   445
 83 THR  QG2    84 PHE  H       4.01            #peak   458
 88 ALA  QB     89 GLU  H       3.67            #peak   486
 91 ILE  QD1    92 ILE  H       5.13            #peak   505
 92 ILE  QG2    93 PHE  H       5.43            #peak   509
 92 ILE  QD1    93 PHE  H       4.72            #peak   512
 95 LEU  QD2    96 SER  H       6.02            #peak   534
 97 LEU  QD1    98 ARG  H       6.21            #peak   544
 97 LEU  QD2    98 ARG  H       6.18            #peak   545
100 LEU  QD1   101 ALA  H       5.62            #peak   563
100 LEU  QD2   101 ALA  H       5.37            #peak   564
101 ALA  QB    102 LEU  H       4.26            #peak   567
 19 ILE  H      19 ILE  QG2     4.50            #peak   710
 19 ILE  H      19 ILE  QD1     5.31            #peak   713
 21 THR  H      21 THR  QG2     4.50            #peak   720
 22 VAL  H      22 VAL  QG1     4.91            #peak   724
 22 VAL  H      22 VAL  QG2     4.91            #peak   725
 29 THR  H      29 THR  QG2     4.72            #peak   760
 37 ALA  H      37 ALA  QB      3.42            #peak   816
 42 ALA  H      42 ALA  QB      3.42            #peak   843
 47 THR  H      47 THR  QG2     4.50            #peak   872
 49 LEU  H      49 LEU  QD1     4.94            #peak   888
 49 LEU  H      49 LEU  QD2     4.97            #peak   889
 52 LEU  H      52 LEU  QD1     5.59            #peak   911
 52 LEU  H      52 LEU  QD2     4.44            #peak   912
 53 ALA  H      53 ALA  QB      3.42            #peak   915
 54 ALA  H      54 ALA  QB      3.48            #peak   918
 55 ALA  H      55 ALA  QB      3.60            #peak   921
 56 ALA  H      56 ALA  QB      3.57            #peak   924
 59 ALA  H      59 ALA  QB      3.42            #peak   935
 63 ALA  H      63 ALA  QB      3.48            #peak   951
 65 VAL  H      65 VAL  QG1     4.19            #peak   959
 65 VAL  H      65 VAL  QG2     4.57            #peak   960
 66 ALA  H      66 ALA  QB      3.54            #peak   963
 69 ILE  H      69 ILE  QG2     4.69            #peak   985
 69 ILE  H      69 ILE  QD1     6.09            #peak   988
 72 LEU  H      72 LEU  QD2     6.36            #peak  1009
 76 VAL  H      76 VAL  QG1     4.35            #peak  1030
 76 VAL  H      76 VAL  QG2     3.60            #peak  1031
 78 LEU  H      78 LEU  QD1     5.09            #peak  1043
 78 LEU  H      78 LEU  QD2     5.65            #peak  1044
 80 ALA  H      80 ALA  QB      3.67            #peak  1051
 81 ALA  H      81 ALA  QB      3.54            #peak  1054
 83 THR  H      83 THR  QG2     4.78            #peak  1067
 88 ALA  H      88 ALA  QB      3.42            #peak  1095
 91 ILE  H      91 ILE  QG2     4.69            #peak  1111
 91 ILE  H      91 ILE  QD1     4.32            #peak  1114
 92 ILE  H      92 ILE  QD1     5.25            #peak  1121
 95 LEU  H      95 LEU  QD2     4.57            #peak  1143
 97 LEU  H      97 LEU  QD1     4.91            #peak  1153
 97 LEU  H      97 LEU  QD2     4.69            #peak  1154
100 LEU  H     100 LEU  QD1     5.28            #peak  1172
100 LEU  H     100 LEU  QD2     5.46            #peak  1173
102 LEU  H     102 LEU  QD1     5.16            #peak  1182
102 LEU  H     102 LEU  QD2     5.16            #peak  1183
 46 MET  H      46 MET  QE      5.25            #peak  5177
 23 ILE  QG2    25 ASN  H       5.15            #peak  5752
 27 ASN  HD21   90 MET  QE      6.24            #peak  5786
 27 ASN  HD22   90 MET  QE      6.24            #peak  5787
 28 CYS  H      83 THR  QG2     5.15            #peak  5791
 29 THR  H      90 MET  QE      5.43            #peak  5796
 30 SER  H      83 THR  QG2     6.21            #peak  5823
 31 LYS  H      81 ALA  QB      6.36            #peak  5835
 29 THR  QG2    31 LYS  H       5.59            #peak  5836
 32 PHE  H      81 ALA  QB      5.12            #peak  5864
 36 PHE  H      42 ALA  QB      5.99            #peak  5949
 36 PHE  H      76 VAL  QG1     6.18            #peak  5950
 36 PHE  H      76 VAL  QG2     4.01            #peak  5951
 37 ALA  H      42 ALA  QB      6.52            #peak  5976
 37 ALA  H      76 VAL  QG1     6.52            #peak  5977
 37 ALA  H      76 VAL  QG2     5.53            #peak  5978
 39 ARG  H      76 VAL  QG1     4.13            #peak  5990
 39 ARG  H      69 ILE  QG2     6.21            #peak  5991
 39 ARG  H      76 VAL  QG2     4.91            #peak  5992
 38 THR  QG2    40 GLU  H       4.50            #peak  6021
 40 GLU  H      76 VAL  QG1     6.52            #peak  6022
 40 GLU  H      69 ILE  QG2     6.52            #peak  6023
 40 GLU  H      76 VAL  QG2     6.52            #peak  6024
 40 GLU  H      69 ILE  QD1     6.52            #peak  6028
 37 ALA  QB     41 GLU  H       6.52            #peak  6044
 41 GLU  H      76 VAL  QG1     6.52            #peak  6047
 41 GLU  H      76 VAL  QG2     6.52            #peak  6048
 42 ALA  H      69 ILE  QD1     5.31            #peak  6085
 42 ALA  H      69 ILE  QG2     6.52            #peak  6086
 42 ALA  H      76 VAL  QG2     4.97            #peak  6087
 43 GLU  H      78 LEU  QD2     6.52            #peak  6120
 43 GLU  H      69 ILE  QD1     4.38            #peak  6121
 43 GLU  H      69 ILE  QG2     6.52            #peak  6122
 43 GLU  H      76 VAL  QG2     6.52            #peak  6123
 42 ALA  QB     44 SER  H       5.65            #peak  6152
 45 PHE  H      78 LEU  QD1     6.52            #peak  6164
 46 MET  H      78 LEU  QD1     5.12            #peak  6185
 46 MET  H      78 LEU  QD2     5.87            #peak  6186
 46 MET  H      69 ILE  QD1     6.52            #peak  6187
 48 LYS  H     100 LEU  QD2     6.12            #peak  6227
 50 LYS  H      65 VAL  QG2     6.52            #peak  6296
 47 THR  QG2    50 LYS  H       5.99            #peak  6297
 51 GLU  H      54 ALA  QB      6.46            #peak  6327
 47 THR  QG2    51 GLU  H       5.56            #peak  6328
 51 GLU  H      52 LEU  QD2     6.46            #peak  6330
 53 ALA  QB     55 ALA  H       5.93            #peak  6389
 53 ALA  QB     56 ALA  H       6.52            #peak  6400
 56 ALA  H      92 ILE  QD1     5.28            #peak  6401
 55 ALA  QB     57 SER  H       5.22            #peak  6423
 57 SER  H      92 ILE  QD1     6.52            #peak  6425
 57 SER  H      63 ALA  QB      5.81            #peak  6426
 58 SER  H      63 ALA  QB      6.36            #peak  6442
 58 SER  H      59 ALA  QB      5.19            #peak  6443
 59 ALA  QB     61 GLU  H       4.44            #peak  6464
 59 ALA  QB     62 GLY  H       4.47            #peak  6469
 62 GLY  H      63 ALA  QB      6.52            #peak  6470
 53 ALA  QB     63 ALA  H       6.46            #peak  6476
 59 ALA  QB     63 ALA  H       6.21            #peak  6477
 63 ALA  H      65 VAL  QG1     6.52            #peak  6500
 65 VAL  H      66 ALA  QB      6.52            #peak  6518
 65 VAL  QG2    67 TYR  H       5.74            #peak  6553
 65 VAL  QG1    67 TYR  H       6.52            #peak  6554
 68 LYS  H      78 LEU  QD2     4.97            #peak  6604
 69 ILE  H      78 LEU  QD2     5.93            #peak  6619
 71 ASP  H      72 LEU  QD2     6.36            #peak  6663
 71 ASP  H      76 VAL  QG1     6.21            #peak  6664
 72 LEU  H      76 VAL  QG1     4.10            #peak  6670
 72 LEU  H      76 VAL  QG2     6.49            #peak  6672
 72 LEU  QD1    75 GLN  H       6.52            #peak  6698
 75 GLN  H      76 VAL  QG1     6.52            #peak  6699
 75 GLN  H      76 VAL  QG2     6.52            #peak  6700
 72 LEU  QD1    75 GLN  HE21    5.12            #peak  6714
 72 LEU  QD1    75 GLN  HE22    5.12            #peak  6716
 72 LEU  QD1    76 VAL  H       5.93            #peak  6723
 69 ILE  QG2    77 GLU  H       4.91            #peak  6748
 72 LEU  QD1    77 GLU  H       4.66            #peak  6749
 42 ALA  QB     77 GLU  H       6.52            #peak  6750
 76 VAL  QG2    78 LEU  H       6.52            #peak  6765
 72 LEU  QD1    78 LEU  H       6.52            #peak  6770
 69 ILE  QG2    79 ASP  H       6.33            #peak  6784
 78 LEU  QD1    80 ALA  H       5.96            #peak  6816
 78 LEU  QD2    80 ALA  H       6.15            #peak  6817
 29 THR  QG2    82 PHE  H       4.41            #peak  6846
 49 LEU  QD1    82 PHE  H       6.52            #peak  6847
 80 ALA  QB     82 PHE  H       5.99            #peak  6848
 63 ALA  QB     83 THR  H       4.72            #peak  6892
 63 ALA  QB     85 SER  H       6.43            #peak  6930
 87 GLN  H      88 ALA  QB      5.53            #peak  6944
 87 GLN  HE21   91 ILE  QG2     5.68            #peak  6966
 87 GLN  HE22   91 ILE  QG2     5.68            #peak  6974
 88 ALA  H      91 ILE  QG2     6.52            #peak  6985
 56 ALA  QB     89 GLU  H       6.52            #peak  7002
 89 GLU  H      92 ILE  QG2     5.50            #peak  7004
 88 ALA  QB     90 MET  H       5.40            #peak  7020
 90 MET  H      92 ILE  QG2     6.52            #peak  7022
 90 MET  H      91 ILE  QG2     6.52            #peak  7023
 88 ALA  QB     91 ILE  H       6.52            #peak  7032
 88 ALA  QB     92 ILE  H       6.36            #peak  7061
 56 ALA  QB     92 ILE  H       6.05            #peak  7062
 56 ALA  QB     93 PHE  H       4.10            #peak  7084
 56 ALA  QB     94 GLU  H       6.52            #peak  7120
 92 ILE  QG2    94 GLU  H       6.52            #peak  7146
 92 ILE  QD1    95 LEU  H       6.52            #peak  7160
 52 LEU  QD1    96 SER  H       6.52            #peak  7181
 95 LEU  QD2    97 LEU  H       6.52            #peak  7201
 52 LEU  QD1    97 LEU  H       6.18            #peak  7202
 52 LEU  QD2    97 LEU  H       5.87            #peak  7203
 19 ILE  QD1    98 ARG  H       6.02            #peak  7244
 52 LEU  QD1    98 ARG  H       6.52            #peak  7245
 64 SER  H      83 THR  QG2     6.05            #peak  7334
 19 ILE  QG2    21 THR  H       4.81            #peak  7337
 70 LYS  H      76 VAL  QG1     5.68            #peak  7353
 53 ALA  H      97 LEU  QD2     6.52            #peak  7428
  7 VAL  H       7 VAL  HB      3.24            #peak  1527
 19 ILE  H      19 ILE  HB      3.58            #peak  1855
 25 ASN  H      25 ASN  HB2     4.20            #peak  1988
 25 ASN  H      25 ASN  HB3     4.20            #peak  1994
 26 ASP  H      26 ASP  HB2     4.07            #peak  2004
 28 CYS  H      28 CYS  HB2     4.14            #peak  2034
 28 CYS  H      28 CYS  HB3     4.14            #peak  2038
 32 PHE  H      32 PHE  HB2     4.11            #peak  2165
 32 PHE  H      32 PHE  HB3     4.11            #peak  2174
 35 PHE  H      35 PHE  HB2     3.79            #peak  2305
 35 PHE  H      35 PHE  HB3     3.79            #peak  2314
 39 ARG  H      39 ARG  HB2     3.58            #peak  2466
 39 ARG  H      39 ARG  HB3     3.58            #peak  2474
 40 GLU  H      40 GLU  HB3     3.55            #peak  2526
 41 GLU  H      41 GLU  HB2     3.89            #peak  2550
 43 GLU  H      43 GLU  HB2     3.76            #peak  2586
 48 LYS  H      48 LYS  HB2     3.64            #peak  2746
 51 GLU  H      51 GLU  HB2     3.83            #peak  2964
 51 GLU  H      51 GLU  HB3     3.83            #peak  2970
 52 LEU  H      52 LEU  HB3     4.04            #peak  3002
 61 GLU  H      61 GLU  HB2     3.83            #peak  3102
 68 LYS  H      68 LYS  HB2     4.04            #peak  3242
 68 LYS  H      68 LYS  HB3     4.04            #peak  3252
 69 ILE  H      69 ILE  HB      3.42            #peak  3329
 70 LYS  H      70 LYS  HB2     3.76            #peak  3374
 70 LYS  H      70 LYS  HB3     3.76            #peak  3384
 71 ASP  H      71 ASP  HB2     3.48            #peak  3458
 71 ASP  H      71 ASP  HB3     3.48            #peak  3462
 73 GLU  H      73 GLU  HB2     3.67            #peak  3514
 78 LEU  H      78 LEU  HB3     4.01            #peak  3648
 79 ASP  H      79 ASP  HB2     3.92            #peak  3680
 79 ASP  H      79 ASP  HB3     3.92            #peak  3684
 91 ILE  H      91 ILE  HB      3.52            #peak  3993
 92 ILE  H      92 ILE  HB      3.58            #peak  4035
 95 LEU  H      95 LEU  HB2     3.67            #peak  4179
 95 LEU  H      95 LEU  HB3     3.67            #peak  4186
100 LEU  H     100 LEU  HB2     3.83            #peak  4343
102 LEU  H     102 LEU  HB3     3.98            #peak  4398
  1 MET  HB2     2 ALA  H       5.19            #peak  4637
  5 ASP  HB2     6 VAL  H       5.50            #peak  4658
  5 ASP  HB3     6 VAL  H       5.50            #peak  4659
  7 VAL  HB      8 ASP  H       4.85            #peak  4665
 10 CYS  HB2    11 SER  H       5.50            #peak  4681
 10 CYS  HB3    11 SER  H       5.50            #peak  4682
 25 ASN  HB3    26 ASP  H       4.54            #peak  4740
 26 ASP  HB2    27 ASN  H       4.97            #peak  4742
 27 ASN  HB2    28 CYS  H       4.88            #peak  4745
 29 THR  HB     30 SER  H       5.50            #peak  4751
 31 LYS  HB2    32 PHE  H       4.38            #peak  4757
 31 LYS  HB3    32 PHE  H       4.38            #peak  4758
 32 PHE  HB2    33 SER  H       4.76            #peak  4766
 39 ARG  HB2    40 GLU  H       4.26            #peak  4805
 39 ARG  HB3    40 GLU  H       4.26            #peak  4806
 40 GLU  HB2    41 GLU  H       3.95            #peak  4812
 41 GLU  HB2    42 ALA  H       3.92            #peak  4817
 41 GLU  HB3    42 ALA  H       3.92            #peak  4818
 43 GLU  HB2    44 SER  H       4.11            #peak  4824
 46 MET  HB2    47 THR  H       5.10            #peak  4840
 48 LYS  HB2    49 LEU  H       4.20            #peak  4848
 48 LYS  HB3    49 LEU  H       4.20            #peak  4849
 51 GLU  HB3    52 LEU  H       3.86            #peak  4873
 60 ASP  HB2    61 GLU  H       4.14            #peak  4899
 60 ASP  HB3    61 GLU  H       4.14            #peak  4900
 64 SER  HB2    65 VAL  H       5.50            #peak  4911
 64 SER  HB3    65 VAL  H       5.50            #peak  4912
 68 LYS  HB2    69 ILE  H       4.04            #peak  4927
 68 LYS  HB3    69 ILE  H       4.04            #peak  4928
 72 LEU  HB2    73 GLU  H       3.73            #peak  4954
 72 LEU  HB3    73 GLU  H       3.73            #peak  4955
 73 GLU  HB2    74 GLY  H       4.85            #peak  4960
 75 GLN  HB2    76 VAL  H       3.64            #peak  4967
 75 GLN  HB3    76 VAL  H       3.64            #peak  4968
 79 ASP  HB2    80 ALA  H       4.54            #peak  4987
 79 ASP  HB3    80 ALA  H       4.54            #peak  4988
 82 PHE  HB2    83 THR  H       4.66            #peak  4994
 84 PHE  HB3    85 SER  H       4.82            #peak  5006
 86 CYS  HB2    87 GLN  H       3.89            #peak  5016
 86 CYS  HB3    87 GLN  H       3.89            #peak  5017
 89 GLU  HB3    90 MET  H       5.19            #peak  5027
 91 ILE  HB     92 ILE  H       3.76            #peak  5036
 93 PHE  HB2    94 GLU  H       4.26            #peak  5048
 98 ARG  HB2    99 SER  H       5.44            #peak  5076
 99 SER  HB2   100 LEU  H       5.50            #peak  5083
 99 SER  HB3   100 LEU  H       5.50            #peak  5084
100 LEU  HB2   101 ALA  H       4.88            #peak  5086
100 LEU  HB3   101 ALA  H       4.88            #peak  5087
102 LEU  HB3   103 GLU  H       4.42            #peak  5095
 40 GLU  HA     43 GLU  H       4.11            #peak  5298
 40 GLU  HA     44 SER  H       4.51            #peak  5299
 41 GLU  HA     44 SER  H       5.50            #peak  5307
 38 THR  H      41 GLU  HB2     3.70            #peak  5309
 38 THR  H      41 GLU  HB3     3.70            #peak  5311
 47 THR  HA     50 LYS  H       4.82            #peak  5358
 48 LYS  HA     51 GLU  H       4.42            #peak  5362
 49 LEU  HA     53 ALA  H       4.94            #peak  5365
 50 LYS  HA     54 ALA  H       4.82            #peak  5383
 52 LEU  HA     55 ALA  H       4.04            #peak  5395
 52 LEU  HA     56 ALA  H       5.50            #peak  5396
 53 ALA  HA     57 SER  H       5.50            #peak  5416
 54 ALA  HA     57 SER  H       4.54            #peak  5426
 54 ALA  H      55 ALA  HA      5.38            #peak  5433
 73 GLU  HA     75 GLN  H       4.54            #peak  5547
 32 PHE  H      81 ALA  HA      4.48            #peak  5592
 86 CYS  HB2    88 ALA  H       4.82            #peak  5618
 87 GLN  HA     89 GLU  H       5.41            #peak  5621
 87 GLN  HA     91 ILE  H       4.94            #peak  5623
 88 ALA  HA     91 ILE  H       4.14            #peak  5631
 91 ILE  HA     95 LEU  H       5.50            #peak  5652
 92 ILE  HA     95 LEU  H       4.29            #peak  5655
 93 PHE  HA     96 SER  H       5.50            #peak  5666
 94 GLU  HA     96 SER  H       5.50            #peak  5670
 94 GLU  HA     97 LEU  H       4.14            #peak  5671
 95 LEU  HA     99 SER  H       5.50            #peak  5688
 97 LEU  HA    100 LEU  H       4.29            #peak  5694
 97 LEU  HA    101 ALA  H       5.50            #peak  5695
 99 SER  HA    102 LEU  H       5.22            #peak  5710
 99 SER  HA    101 ALA  H       5.50            #peak  5711
101 ALA  HA    103 GLU  H       5.19            #peak  5720
100 LEU  HB2   102 LEU  H       5.31            #peak  5728
100 LEU  HB3   102 LEU  H       5.31            #peak  5729
 46 MET  HA     49 LEU  HB2     4.60            #peak  5743
 29 THR  HA     83 THR  HA      3.45            #peak  5799
 29 THR  HA     30 SER  HB2     5.50            #peak  5825
 29 THR  HA     30 SER  HB3     5.50            #peak  5830
 33 SER  HA     34 ARG  HB3     5.50            #peak  5887
 33 SER  HA     34 ARG  HB2     5.50            #peak  5905
 35 PHE  HA     77 GLU  HA      5.50            #peak  5915
 39 ARG  HA     71 ASP  HA      5.50            #peak  5993
 42 ALA  HA     45 PHE  HB3     4.29            #peak  6068
 42 ALA  HA     45 PHE  HB2     4.29            #peak  6069
 48 LYS  HA     51 GLU  HB2     5.50            #peak  6230
 48 LYS  HA     51 GLU  HB3     5.50            #peak  6231
 46 MET  HA     49 LEU  HB3     4.60            #peak  6265
 47 THR  HA     50 LYS  HB2     4.69            #peak  6308
 47 THR  HA     50 LYS  HB3     4.69            #peak  6309
 49 LEU  HA     52 LEU  HB2     4.11            #peak  6345
 49 LEU  HA     52 LEU  HB3     4.11            #peak  6352
 65 VAL  HA     82 PHE  HA      3.48            #peak  6521
 67 TYR  HA     80 ALA  HA      3.14            #peak  6556
 68 LYS  HA     69 ILE  HB      4.97            #peak  6625
 69 ILE  HA     70 LYS  HB2     4.88            #peak  6659
 69 ILE  HA     70 LYS  HB3     4.88            #peak  6661
 71 ASP  HA     76 VAL  HA      3.83            #peak  6727
 72 LEU  HB3    76 VAL  HA      4.91            #peak  6730
 72 LEU  HB2    76 VAL  HA      4.91            #peak  6731
 77 GLU  HA     78 LEU  HB2     5.50            #peak  6766
 77 GLU  HA     78 LEU  HB3     5.50            #peak  6767
 33 SER  HA     79 ASP  HA      3.58            #peak  6789
 78 LEU  HA     79 ASP  HA      4.94            #peak  6790
 31 LYS  HA     81 ALA  HA      3.36            #peak  6839
 28 CYS  HA     87 GLN  HA      5.50            #peak  6945
 88 ALA  HA     91 ILE  HB      5.50            #peak  7039
 92 ILE  HA     93 PHE  HA      5.10            #peak  7063
 89 GLU  HA     92 ILE  HB      4.76            #peak  7067
 91 ILE  HA     94 GLU  HB2     5.47            #peak  7136
 91 ILE  HA     94 GLU  HB3     5.47            #peak  7137
 92 ILE  HA     95 LEU  HB2     4.45            #peak  7163
 92 ILE  HA     95 LEU  HB3     4.45            #peak  7164
  8 ASP  HA      9 LYS  HB3     5.38            #peak  7187
  8 ASP  HA      9 LYS  HB2     5.38            #peak  7188
 94 GLU  HA     97 LEU  HB3     4.69            #peak  7210
 94 GLU  HA     97 LEU  HB2     4.69            #peak  7212
 97 LEU  HA    100 LEU  HB2     4.35            #peak  7302
 97 LEU  HA    100 LEU  HB3     4.35            #peak  7303
 40 GLU  HA     42 ALA  H       5.50            #peak  7351
 31 LYS  HA     31 LYS  HD3     5.50            #peak  2073
 31 LYS  HB3    31 LYS  HE2     7.26            #peak  2094
 31 LYS  HB3    31 LYS  HE3     7.26            #peak  2095
 31 LYS  HA     31 LYS  HD2     5.50            #peak  2117
 32 PHE  H      32 PHE  QE      7.63            #peak  2192
 34 ARG  HA     34 ARG  HD2     5.50            #peak  2281
 34 ARG  HA     34 ARG  HD3     5.50            #peak  2289
 39 ARG  H      39 ARG  HD2     5.50            #peak  2498
 39 ARG  HA     39 ARG  HD2     5.50            #peak  2499
 39 ARG  H      39 ARG  HD3     5.50            #peak  2506
 39 ARG  HA     39 ARG  HD3     5.50            #peak  2507
 40 GLU  HA     40 GLU  HG2     3.55            #peak  2533
 40 GLU  HA     40 GLU  HG3     3.55            #peak  2539
 41 GLU  HA     41 GLU  HG2     3.79            #peak  2563
 41 GLU  H      41 GLU  HG3     4.29            #peak  2568
 41 GLU  HA     41 GLU  HG3     3.79            #peak  2569
 43 GLU  H      43 GLU  HG2     3.83            #peak  2598
 43 GLU  HA     43 GLU  HG2     3.86            #peak  2599
 43 GLU  HA     43 GLU  HG3     3.86            #peak  2605
 48 LYS  HB3    48 LYS  HE2     7.26            #peak  2764
 48 LYS  HB3    48 LYS  HE3     7.26            #peak  2765
 48 LYS  HA     48 LYS  HD2     5.31            #peak  2787
 48 LYS  H      48 LYS  HD3     5.47            #peak  2796
 48 LYS  HA     48 LYS  HD3     5.31            #peak  2797
 49 LEU  H      49 LEU  HG      4.35            #peak  2847
 50 LYS  HA     50 LYS  HD2     5.50            #peak  2874
 50 LYS  HA     50 LYS  HD3     5.50            #peak  2875
 50 LYS  H      50 LYS  HG3     5.50            #peak  2908
 51 GLU  HA     51 GLU  HG2     3.61            #peak  2977
 51 GLU  HA     51 GLU  HG3     3.61            #peak  2983
 52 LEU  HA     52 LEU  HG      3.95            #peak  3010
 67 TYR  H      67 TYR  QE      7.63            #peak  3208
 72 LEU  HA     72 LEU  HG      4.11            #peak  3488
 75 GLN  HB2    75 GLN  HE21    5.50            #peak  3558
 87 GLN  HB2    87 GLN  HE21    5.50            #peak  3894
 95 LEU  H      95 LEU  HG      3.48            #peak  4193
 95 LEU  HA     95 LEU  HG      4.04            #peak  4194
 98 ARG  HA     98 ARG  HD2     4.57            #peak  4309
 98 ARG  HA     98 ARG  HD3     4.57            #peak  4317
103 GLU  H     103 GLU  HG2     4.91            #peak  4444
 19 ILE  HG12   20 GLY  H       5.50            #peak  4717
 31 LYS  HG2    32 PHE  H       5.50            #peak  4759
 32 PHE  QD     33 SER  H       7.63            #peak  4768
 32 PHE  QE     33 SER  H       7.63            #peak  4769
 34 ARG  HD2    35 PHE  H       5.50            #peak  4781
 34 ARG  HD3    35 PHE  H       5.50            #peak  4782
 35 PHE  QD     36 PHE  H       7.63            #peak  4786
 35 PHE  QE     36 PHE  H       7.63            #peak  4787
 39 ARG  HG2    40 GLU  H       5.50            #peak  4807
 41 GLU  HG3    42 ALA  H       5.50            #peak  4820
 43 GLU  HG2    44 SER  H       5.50            #peak  4826
 45 PHE  QD     46 MET  H       7.63            #peak  4834
 48 LYS  HD2    49 LEU  H       5.50            #peak  4852
 48 LYS  HD3    49 LEU  H       5.50            #peak  4853
 49 LEU  HG     50 LYS  H       5.50            #peak  4859
 61 GLU  HG2    62 GLY  H       5.50            #peak  4904
 61 GLU  HG3    62 GLY  H       5.50            #peak  4905
 73 GLU  HG2    74 GLY  H       5.50            #peak  4962
 75 GLN  HG3    76 VAL  H       5.22            #peak  4970
 87 GLN  HG2    88 ALA  H       5.50            #peak  5021
 92 ILE  HG12   93 PHE  H       5.50            #peak  5044
 19 ILE  HG12   96 SER  H       5.50            #peak  5203
 28 CYS  HB3    84 PHE  H       5.50            #peak  5217
 30 SER  HB3    93 PHE  QE      7.63            #peak  5231
 32 PHE  HB2    82 PHE  QD      7.63            #peak  5236
 32 PHE  HB3    82 PHE  QD      7.63            #peak  5237
 32 PHE  QD     33 SER  HA      7.63            #peak  5239
 32 PHE  HZ     34 ARG  HA      5.50            #peak  5248
 32 PHE  HZ     34 ARG  HB2     5.28            #peak  5249
 32 PHE  QD     34 ARG  HB2     7.63            #peak  5250
 34 ARG  HB2    36 PHE  HZ      4.72            #peak  5251
 34 ARG  HB3    36 PHE  HZ      4.72            #peak  5255
 32 PHE  HZ     34 ARG  HD2     5.50            #peak  5267
 34 ARG  HD2    45 PHE  QD      7.63            #peak  5268
 32 PHE  HZ     34 ARG  HD3     5.50            #peak  5274
 34 ARG  HD3    45 PHE  QD      7.63            #peak  5275
 34 ARG  HD3    36 PHE  HZ      5.50            #peak  5278
 39 ARG  HB2    39 ARG  HE      5.50            #peak  5290
 38 THR  H      41 GLU  HG2     4.88            #peak  5314
 38 THR  H      41 GLU  HG3     4.88            #peak  5315
 36 PHE  QD     42 ALA  HA      7.32            #peak  5321
 49 LEU  HA     93 PHE  QE      7.63            #peak  5364
 49 LEU  HB2    82 PHE  QE      7.63            #peak  5366
 49 LEU  HB2    82 PHE  QD      7.63            #peak  5367
 49 LEU  HB3    82 PHE  QE      7.63            #peak  5368
 49 LEU  HB3    82 PHE  QD      7.63            #peak  5369
 50 LYS  HG2    82 PHE  QD      7.63            #peak  5390
 50 LYS  HG3    82 PHE  QD      7.63            #peak  5391
 52 LEU  HB2    93 PHE  QE      7.63            #peak  5398
 52 LEU  HB3    93 PHE  QE      7.63            #peak  5399
 52 LEU  HB3    93 PHE  QD      7.63            #peak  5400
 52 LEU  HB2    93 PHE  QD      7.63            #peak  5401
 52 LEU  HG     93 PHE  QD      7.63            #peak  5403
 53 ALA  HA     84 PHE  QD      7.63            #peak  5417
 53 ALA  HA     93 PHE  QD      6.98            #peak  5419
 57 SER  HB2    63 ALA  H       5.50            #peak  5444
 57 SER  HB2    84 PHE  QE      7.63            #peak  5445
 57 SER  HB2    84 PHE  QD      7.63            #peak  5446
 57 SER  HB3    84 PHE  QE      7.63            #peak  5448
 57 SER  HB3    63 ALA  H       5.50            #peak  5449
 67 TYR  QD     69 ILE  HG12    7.63            #peak  5501
 67 TYR  QE     69 ILE  HB      7.63            #peak  5502
 70 LYS  HB2    77 GLU  H       5.16            #peak  5515
 70 LYS  HB3    77 GLU  H       5.16            #peak  5516
 72 LEU  HG     75 GLN  H       5.50            #peak  5532
 39 ARG  H      76 VAL  HB      5.50            #peak  5555
 36 PHE  QD     78 LEU  HB2     7.63            #peak  5568
 36 PHE  QE     78 LEU  HB2     7.63            #peak  5569
 82 PHE  QD     84 PHE  HZ      7.63            #peak  5609
 84 PHE  QE     90 MET  HA      7.63            #peak  5646
 93 PHE  QD     94 GLU  HA      7.63            #peak  5672
 45 PHE  QE    101 ALA  HA      7.63            #peak  5719
 30 SER  HB2    82 PHE  HB2     5.50            #peak  5826
 30 SER  HB3    82 PHE  HB2     5.50            #peak  5847
 30 SER  HB3    82 PHE  HB3     5.50            #peak  5851
 31 LYS  HG2    81 ALA  HA      5.50            #peak  5855
 31 LYS  HG3    81 ALA  HA      5.50            #peak  5856
 32 PHE  QD     34 ARG  HB3     7.63            #peak  5871
 32 PHE  QE     34 ARG  HA      7.63            #peak  5873
 32 PHE  HZ     34 ARG  HB3     5.28            #peak  5876
 33 SER  HB2    79 ASP  HA      5.50            #peak  5888
 33 SER  HB3    77 GLU  HG3     7.26            #peak  5893
 33 SER  HB2    77 GLU  HG3     7.26            #peak  5894
 35 PHE  HB2    77 GLU  HA      5.50            #peak  5920
 35 PHE  HB2    75 GLN  HB3     7.26            #peak  5921
 35 PHE  HB3    77 GLU  HA      5.50            #peak  5922
 35 PHE  HB3    75 GLN  HB3     7.26            #peak  5924
 35 PHE  QD     77 GLU  HB3     7.63            #peak  5925
 35 PHE  QD     77 GLU  HB2     7.63            #peak  5926
 36 PHE  HB2    41 GLU  HB3     6.98            #peak  5952
 36 PHE  HB3    41 GLU  HB3     6.98            #peak  5956
 36 PHE  QD     41 GLU  HA      7.63            #peak  5959
 36 PHE  QD     76 VAL  HB      7.63            #peak  5962
 36 PHE  QD     78 LEU  HB3     7.63            #peak  5964
 36 PHE  QE     78 LEU  HB3     7.63            #peak  5970
 38 THR  HB     39 ARG  HB2     5.50            #peak  6001
 38 THR  HB     39 ARG  HB3     5.50            #peak  6002
 39 ARG  HB3    71 ASP  HA      5.50            #peak  6003
 39 ARG  HB2    71 ASP  HA      5.50            #peak  6004
 39 ARG  HG3    43 GLU  HG3     6.98            #peak  6013
 38 THR  HB     40 GLU  HB2     5.50            #peak  6030
 38 THR  HB     40 GLU  HB3     5.50            #peak  6034
 36 PHE  HA     41 GLU  HB2     5.50            #peak  6054
 36 PHE  HA     41 GLU  HB3     5.50            #peak  6055
 36 PHE  HB2    41 GLU  HB2     6.98            #peak  6057
 38 THR  HB     41 GLU  HG3     5.50            #peak  6090
 38 THR  HA     41 GLU  HG3     5.34            #peak  6091
 36 PHE  HB2    41 GLU  HG3     7.26            #peak  6093
 38 THR  HA     41 GLU  HG2     5.34            #peak  6099
 38 THR  HB     41 GLU  HG2     5.50            #peak  6100
 36 PHE  HB2    41 GLU  HG2     7.26            #peak  6101
 39 ARG  HG2    43 GLU  HG2     6.98            #peak  6140
 39 ARG  HG2    43 GLU  HG3     6.98            #peak  6141
 48 LYS  HG2    49 LEU  HA      5.50            #peak  6245
 48 LYS  HG3    49 LEU  HA      5.50            #peak  6246
 47 THR  HB     48 LYS  HG3     5.50            #peak  6247
 47 THR  HB     48 LYS  HG2     5.50            #peak  6248
 46 MET  HA     49 LEU  HG      5.50            #peak  6268
 57 SER  HB2    84 PHE  HA      5.50            #peak  6427
 57 SER  HB3    84 PHE  HA      5.50            #peak  6433
 64 SER  HB2    82 PHE  HA      5.50            #peak  6489
 64 SER  HB3    82 PHE  HA      5.50            #peak  6490
 65 VAL  HB     82 PHE  HA      5.38            #peak  6524
 67 TYR  QD     80 ALA  HA      7.63            #peak  6566
 66 ALA  HA     67 TYR  QD      7.63            #peak  6567
 67 TYR  QD     78 LEU  HA      7.63            #peak  6568
 67 TYR  QD     68 LYS  HA      7.63            #peak  6569
 46 MET  HG2    67 TYR  QD      7.63            #peak  6570
 67 TYR  QD     69 ILE  HG13    7.63            #peak  6575
 67 TYR  QE     68 LYS  HA      7.63            #peak  6580
 46 MET  HG2    67 TYR  QE      7.63            #peak  6582
 46 MET  HG3    67 TYR  QE      7.63            #peak  6583
 46 MET  HG3    67 TYR  QD      7.63            #peak  6584
 68 LYS  HB2    79 ASP  HB2     7.14            #peak  6612
 72 LEU  HB2    75 GLN  HG3     4.85            #peak  6673
 72 LEU  HB2    75 GLN  HG2     4.85            #peak  6674
 72 LEU  HB3    75 GLN  HG3     4.85            #peak  6677
 72 LEU  HB3    75 GLN  HG2     4.85            #peak  6678
 72 LEU  HG     76 VAL  HA      4.85            #peak  6680
 73 GLU  HG3    74 GLY  HA2     7.26            #peak  6693
 73 GLU  HG3    74 GLY  HA3     7.26            #peak  6695
 71 ASP  HA     76 VAL  HB      4.54            #peak  6734
 33 SER  HB3    79 ASP  HA      5.50            #peak  6792
 68 LYS  HB3    79 ASP  HB2     7.14            #peak  6802
 68 LYS  HB3    79 ASP  HB3     7.14            #peak  6803
 68 LYS  HD3    79 ASP  HB3     7.27            #peak  6804
 68 LYS  HD3    79 ASP  HB2     7.27            #peak  6806
 81 ALA  HA     82 PHE  QD      7.63            #peak  6861
 31 LYS  HA     82 PHE  QD      7.63            #peak  6862
 65 VAL  HA     82 PHE  QD      7.63            #peak  6864
 30 SER  HB2    82 PHE  QD      7.63            #peak  6865
 30 SER  HB3    82 PHE  QD      7.63            #peak  6866
 50 LYS  HA     82 PHE  QD      7.63            #peak  6867
 30 SER  HB2    82 PHE  HB3     5.50            #peak  6868
 65 VAL  HB     82 PHE  QD      7.63            #peak  6869
 29 THR  HA     83 THR  HB      5.50            #peak  6896
 84 PHE  HB2    89 GLU  HB2     7.26            #peak  6904
 84 PHE  HB2    89 GLU  HB3     7.26            #peak  6905
 83 THR  HA     84 PHE  QD      7.63            #peak  6907
 57 SER  HB3    84 PHE  QD      7.63            #peak  6911
 84 PHE  QD     90 MET  HA      7.63            #peak  6912
 84 PHE  QD     89 GLU  HB2     7.63            #peak  6915
 84 PHE  QD     89 GLU  HB3     7.63            #peak  6917
 53 ALA  HA     84 PHE  QE      7.57            #peak  6922
 87 GLN  HG2    91 ILE  HG12    5.50            #peak  6952
 87 GLN  HG3    91 ILE  HG12    5.50            #peak  6958
 88 ALA  HA     91 ILE  HG13    5.50            #peak  6986
 88 ALA  HA     91 ILE  HG12    5.50            #peak  6989
 91 ILE  HA     94 GLU  HG3     5.50            #peak  7035
 87 GLN  HG2    91 ILE  HG13    5.50            #peak  7045
 87 GLN  HG3    91 ILE  HG13    5.50            #peak  7046
 56 ALA  HA     92 ILE  HB      5.50            #peak  7068
 30 SER  HB2    93 PHE  QE      7.63            #peak  7098
 94 GLU  HA     97 LEU  HG      3.95            #peak  7130
 91 ILE  HA     94 GLU  HG2     5.50            #peak  7147
 49 LEU  HA     52 LEU  HG      4.57            #peak  7165
 92 ILE  HA     95 LEU  HG      5.07            #peak  7166
100 LEU  HG    101 ALA  HA      5.50            #peak  7327
 45 PHE  QD     49 LEU  HG      7.63            #peak  7350
 53 ALA  HA     84 PHE  HZ      5.50            #peak  7381
 84 PHE  HZ     93 PHE  HB2     5.50            #peak  7382
 84 PHE  HZ     93 PHE  HB3     5.50            #peak  7383
 34 ARG  HD2    36 PHE  HZ      5.50            #peak  7391
 49 LEU  HA     49 LEU  QD1     5.06            #peak  2855
 49 LEU  HA     49 LEU  QD2     4.75            #peak  2862
 52 LEU  HA     52 LEU  QD1     6.52            #peak  2993
 52 LEU  HA     52 LEU  QD2     5.43            #peak  3024
 72 LEU  H      72 LEU  QD1     6.52            #peak  3494
 72 LEU  HA     72 LEU  QD1     5.47            #peak  3495
 72 LEU  HA     72 LEU  QD2     3.91            #peak  3502
 78 LEU  HA     78 LEU  QD1     6.49            #peak  3663
 78 LEU  HA     78 LEU  QD2     4.19            #peak  3670
 95 LEU  H      95 LEU  QD1     6.46            #peak  4200
 95 LEU  HA     95 LEU  QD1     5.43            #peak  4201
 95 LEU  HA     95 LEU  QD2     4.10            #peak  4208
 97 LEU  HA     97 LEU  QD1     5.53            #peak  4255
 97 LEU  HA     97 LEU  QD2     4.44            #peak  4262
100 LEU  HA    100 LEU  QD1     4.81            #peak  4365
100 LEU  HA    100 LEU  QD2     4.57            #peak  4372
102 LEU  HA    102 LEU  QD1     5.34            #peak  4413
102 LEU  HA    102 LEU  QD2     5.34            #peak  4420
 12 THR  QG2    13 LYS  H       6.52            #peak  4688
 22 VAL  QG1    23 ILE  H       6.52            #peak  4727
 22 VAL  QG2    23 ILE  H       6.52            #peak  4728
 69 ILE  QD1    70 LYS  H       6.52            #peak  4940
 72 LEU  QD1    73 GLU  H       6.52            #peak  4957
 72 LEU  QD2    73 GLU  H       5.93            #peak  4958
 91 ILE  QG2    92 ILE  H       6.52            #peak  5037
 95 LEU  QD1    96 SER  H       6.52            #peak  5064
102 LEU  QD1   103 GLU  H       6.52            #peak  5097
102 LEU  QD2   103 GLU  H       6.52            #peak  5098
 46 MET  HB3    46 MET  QE      6.52            #peak  5186
 46 MET  HB2    46 MET  QE      6.52            #peak  5187
 46 MET  HA     46 MET  QE      6.52            #peak  5188
 29 THR  QG2    83 THR  H       6.52            #peak  5222
 28 CYS  H      29 THR  QG2     6.52            #peak  5223
 32 PHE  QD     78 LEU  QD1     7.81            #peak  5260
 38 THR  QG2    41 GLU  H       6.52            #peak  5287
 36 PHE  QD     42 ALA  QB      7.56            #peak  5327
 36 PHE  QE     42 ALA  QB      8.65            #peak  5328
 41 GLU  H      42 ALA  QB      6.52            #peak  5329
 42 ALA  QB     78 LEU  H       6.52            #peak  5332
 42 ALA  QB     70 LYS  H       6.52            #peak  5333
 46 MET  QE     49 LEU  H       6.52            #peak  5347
 46 MET  QE     66 ALA  H       6.52            #peak  5348
 46 MET  QE     50 LYS  H       6.52            #peak  5349
 46 MET  QE     81 ALA  H       6.52            #peak  5350
 46 MET  QE     82 PHE  QE      8.65            #peak  5351
 46 MET  QE     82 PHE  QD      8.65            #peak  5352
 45 PHE  QD     49 LEU  QD1     7.87            #peak  5372
 32 PHE  QD     49 LEU  QD1     8.65            #peak  5373
 49 LEU  QD1    82 PHE  QE      8.50            #peak  5374
 49 LEU  QD1    82 PHE  QD      8.55            #peak  5375
 49 LEU  QD2    52 LEU  H       6.52            #peak  5376
 49 LEU  QD1    53 ALA  H       6.52            #peak  5378
 32 PHE  QD     49 LEU  QD2     7.00            #peak  5379
 49 LEU  QD2    93 PHE  QE      7.47            #peak  5380
 52 LEU  QD2   100 LEU  H       6.52            #peak  5406
 53 ALA  QB     57 SER  H       6.52            #peak  5420
 53 ALA  QB     84 PHE  QD      8.65            #peak  5421
 53 ALA  QB     82 PHE  QD      6.88            #peak  5423
 50 LYS  H      53 ALA  QB      6.52            #peak  5424
 51 GLU  H      53 ALA  QB      6.52            #peak  5428
 53 ALA  H      54 ALA  QB      6.52            #peak  5429
 54 ALA  QB     57 SER  H       6.52            #peak  5430
 56 ALA  QB     84 PHE  QD      8.65            #peak  5435
 56 ALA  QB     84 PHE  QE      7.84            #peak  5436
 56 ALA  QB     93 PHE  QD      8.31            #peak  5437
 55 ALA  H      56 ALA  QB      6.52            #peak  5438
 63 ALA  QB     84 PHE  QD      8.59            #peak  5461
 63 ALA  QB     82 PHE  QD      8.65            #peak  5463
 65 VAL  QG1    81 ALA  H       6.52            #peak  5468
 65 VAL  QG1    82 PHE  QD      8.65            #peak  5469
 65 VAL  QG2    81 ALA  H       6.52            #peak  5472
 65 VAL  QG2    82 PHE  QD      7.66            #peak  5473
 65 VAL  QG2    67 TYR  QD      7.75            #peak  5474
 66 ALA  QB     81 ALA  H       5.40            #peak  5478
 66 ALA  QB     82 PHE  H       6.52            #peak  5479
 79 ASP  H      80 ALA  QB      6.52            #peak  5498
 69 ILE  QG2    71 ASP  H       6.52            #peak  5500
 69 ILE  QD1    79 ASP  H       6.52            #peak  5506
 36 PHE  QD     69 ILE  QD1     8.65            #peak  5508
 35 PHE  HZ     72 LEU  QD1     5.31            #peak  5535
 35 PHE  QD     72 LEU  QD1     8.55            #peak  5536
 35 PHE  QE     72 LEU  QD2     8.65            #peak  5537
 35 PHE  QD     72 LEU  QD2     8.65            #peak  5539
 72 LEU  QD2    77 GLU  H       6.52            #peak  5541
 70 LYS  H      72 LEU  QD2     6.52            #peak  5543
 38 THR  H      76 VAL  QG2     6.52            #peak  5560
 70 LYS  H      78 LEU  QD2     6.52            #peak  5574
 45 PHE  QD     78 LEU  QD2     8.65            #peak  5576
 36 PHE  QD     78 LEU  QD2     8.65            #peak  5577
 36 PHE  HZ     78 LEU  QD2     6.52            #peak  5578
 67 TYR  QD     78 LEU  QD2     6.94            #peak  5579
 30 SER  H      81 ALA  QB      6.52            #peak  5596
 66 ALA  H      81 ALA  QB      6.18            #peak  5597
 81 ALA  QB     82 PHE  QD      8.65            #peak  5598
 92 ILE  QD1    96 SER  H       6.52            #peak  5669
 33 SER  H      97 LEU  QD1     6.52            #peak  5696
 94 GLU  H      97 LEU  QD1     6.52            #peak  5697
 32 PHE  QD     97 LEU  QD1     7.90            #peak  5698
 93 PHE  QD     97 LEU  QD1     8.65            #peak  5700
 93 PHE  QE     97 LEU  QD2     8.65            #peak  5702
 52 LEU  H      97 LEU  QD2     6.52            #peak  5704
 94 GLU  H      97 LEU  QD2     6.52            #peak  5705
 45 PHE  QE    100 LEU  QD2     8.65            #peak  5716
 45 PHE  QE    100 LEU  QD1     8.65            #peak  5718
101 ALA  QB    103 GLU  H       6.52            #peak  5722
 45 PHE  QE    101 ALA  QB      8.65            #peak  5723
 97 LEU  H     100 LEU  QD1     6.52            #peak  5727
 27 ASN  HB2    83 THR  QG2     6.52            #peak  5781
 27 ASN  HB3    83 THR  QG2     6.52            #peak  5784
 28 CYS  HB2    83 THR  QG2     6.49            #peak  5794
 28 CYS  HB3    83 THR  QG2     6.49            #peak  5795
 29 THR  QG2    31 LYS  HA      6.52            #peak  5803
 29 THR  QG2    30 SER  HA      6.52            #peak  5805
 29 THR  QG2    82 PHE  HA      6.52            #peak  5806
 29 THR  QG2    31 LYS  QE      7.40            #peak  5807
 29 THR  QG2    31 LYS  HG3     6.15            #peak  5811
 29 THR  HB     83 THR  QG2     6.52            #peak  5814
 29 THR  HA     81 ALA  QB      6.52            #peak  5815
 29 THR  QG2    31 LYS  HG2     6.15            #peak  5858
 32 PHE  HB2    80 ALA  QB      5.53            #peak  5866
 32 PHE  HB2    49 LEU  QD2     6.52            #peak  5867
 32 PHE  HB3    49 LEU  QD2     6.52            #peak  5869
 32 PHE  HB3    49 LEU  QD1     6.52            #peak  5870
 32 PHE  HZ     78 LEU  QD1     6.52            #peak  5875
 32 PHE  HZ     49 LEU  QD2     6.52            #peak  5879
 46 MET  HA     78 LEU  QD1     6.52            #peak  5906
 49 LEU  QD1    78 LEU  QD1     6.89            #peak  5908
 35 PHE  HA     76 VAL  QG2     6.52            #peak  5919
 36 PHE  HB2    76 VAL  QG2     5.84            #peak  5955
 36 PHE  HB3    42 ALA  QB      5.87            #peak  5957
 36 PHE  HB3    76 VAL  QG2     5.84            #peak  5958
 36 PHE  QD     76 VAL  QG2     8.21            #peak  5966
 36 PHE  HZ     78 LEU  QD1     6.52            #peak  5969
 37 ALA  QB     38 THR  HB      6.52            #peak  5981
 36 PHE  HA     37 ALA  QB      6.52            #peak  5982
 37 ALA  QB     75 GLN  HA      6.21            #peak  5983
 37 ALA  QB     38 THR  QG2     7.54            #peak  5984
 39 ARG  HA     42 ALA  QB      4.75            #peak  5996
 39 ARG  HA     76 VAL  QG1     5.09            #peak  5998
 39 ARG  HA     76 VAL  QG2     4.69            #peak  6000
 39 ARG  HB2    76 VAL  QG1     6.40            #peak  6005
 39 ARG  HB2    69 ILE  QG2     6.52            #peak  6006
 39 ARG  HB2    76 VAL  QG2     6.52            #peak  6007
 39 ARG  HB3    76 VAL  QG1     6.40            #peak  6008
 39 ARG  HB3    69 ILE  QG2     6.52            #peak  6009
 39 ARG  HD2    69 ILE  QD1     6.52            #peak  6016
 39 ARG  HD2    69 ILE  QG2     6.52            #peak  6018
 40 GLU  HA     69 ILE  QD1     6.52            #peak  6027
 37 ALA  QB     41 GLU  HB2     6.52            #peak  6058
 37 ALA  QB     41 GLU  HB3     6.52            #peak  6059
 41 GLU  HB3    42 ALA  QB      6.52            #peak  6060
 41 GLU  HB2    76 VAL  QG2     6.52            #peak  6062
 37 ALA  QB     41 GLU  HG3     6.52            #peak  6094
 38 THR  QG2    41 GLU  HG3     6.52            #peak  6097
 37 ALA  QB     41 GLU  HG2     6.52            #peak  6104
 38 THR  QG2    41 GLU  HG2     6.52            #peak  6106
 36 PHE  HB2    42 ALA  QB      5.87            #peak  6108
 42 ALA  QB     43 GLU  HA      6.36            #peak  6110
 42 ALA  QB     77 GLU  HA      6.52            #peak  6111
 42 ALA  QB     78 LEU  HA      6.21            #peak  6112
 41 GLU  HB2    42 ALA  QB      6.52            #peak  6114
 42 ALA  QB     76 VAL  QG2     6.61            #peak  6117
 42 ALA  QB     43 GLU  HG3     6.52            #peak  6142
 42 ALA  QB     43 GLU  HG2     6.52            #peak  6144
 43 GLU  HG2    69 ILE  QD1     4.85            #peak  6145
 43 GLU  HG2    69 ILE  QG2     6.52            #peak  6146
 45 PHE  HB2    78 LEU  QD1     6.52            #peak  6170
 45 PHE  HB3    78 LEU  QD1     6.52            #peak  6171
 45 PHE  QD     78 LEU  QD1     8.65            #peak  6173
 46 MET  QE     80 ALA  HA      6.52            #peak  6196
 46 MET  QE     65 VAL  QG2     7.54            #peak  6201
 46 MET  QE     49 LEU  QD1     7.54            #peak  6202
 46 MET  QE     49 LEU  QD2     7.54            #peak  6203
 46 MET  QE     69 ILE  QD1     7.54            #peak  6204
 46 MET  QE     78 LEU  QD2     7.54            #peak  6205
 47 THR  QG2    48 LYS  HA      6.52            #peak  6232
 48 LYS  HA    100 LEU  QD2     6.52            #peak  6233
 38 THR  QG2    75 GLN  HA      6.52            #peak  6234
 48 LYS  HB3   100 LEU  QD2     6.52            #peak  6241
 48 LYS  HB2   100 LEU  QD2     6.52            #peak  6243
 48 LYS  HG3   100 LEU  QD2     6.52            #peak  6249
 48 LYS  HG3   100 LEU  QD1     6.52            #peak  6250
 48 LYS  HG2   100 LEU  QD1     6.52            #peak  6251
 48 LYS  HG2   100 LEU  QD2     6.52            #peak  6252
 48 LYS  HD3   100 LEU  QD2     6.52            #peak  6253
 48 LYS  HD3   100 LEU  QD1     6.52            #peak  6254
 48 LYS  HD2   100 LEU  QD1     6.52            #peak  6255
 48 LYS  HD2   100 LEU  QD2     6.52            #peak  6256
 48 LYS  HD2    49 LEU  QD2     6.52            #peak  6257
 49 LEU  HA     52 LEU  QD1     6.52            #peak  6263
 49 LEU  QD1    52 LEU  QD1     7.54            #peak  6270
 49 LEU  QD1    52 LEU  HB3     5.34            #peak  6272
 49 LEU  QD1    52 LEU  HB2     5.34            #peak  6276
 32 PHE  HB2    49 LEU  QD1     6.52            #peak  6278
 49 LEU  QD1    50 LYS  HA      6.52            #peak  6279
 49 LEU  QD1    52 LEU  HA      6.52            #peak  6280
 49 LEU  QD1    53 ALA  HA      6.52            #peak  6281
 46 MET  HA     49 LEU  QD1     5.78            #peak  6283
 45 PHE  HA     49 LEU  QD2     6.52            #peak  6285
 46 MET  HA     49 LEU  QD2     6.52            #peak  6286
 49 LEU  QD2    93 PHE  HZ      5.74            #peak  6288
 49 LEU  QD2    97 LEU  HA      6.52            #peak  6289
 49 LEU  QD2    52 LEU  HG      6.52            #peak  6291
 49 LEU  QD2    78 LEU  HG      6.15            #peak  6293
 48 LYS  HD3    49 LEU  QD2     6.52            #peak  6294
 49 LEU  QD2    52 LEU  QD1     7.35            #peak  6295
 50 LYS  HG2    65 VAL  QG1     6.52            #peak  6317
 50 LYS  HG2    65 VAL  QG2     6.52            #peak  6318
 50 LYS  HE3    65 VAL  QG1     6.52            #peak  6324
 50 LYS  HE3    65 VAL  QG2     6.52            #peak  6325
 51 GLU  HA     54 ALA  QB      4.60            #peak  6334
 52 LEU  HB3    97 LEU  QD2     6.52            #peak  6350
 52 LEU  HG     97 LEU  QD2     6.52            #peak  6353
 52 LEU  QD2   100 LEU  HG      5.84            #peak  6355
 48 LYS  HE3    52 LEU  QD2     6.52            #peak  6359
 48 LYS  HE2    52 LEU  QD2     6.52            #peak  6360
 52 LEU  QD2    96 SER  HB2     6.52            #peak  6362
 53 ALA  HA     56 ALA  QB      5.84            #peak  6371
 50 LYS  HA     53 ALA  QB      4.41            #peak  6373
 53 ALA  QB     54 ALA  HA      5.96            #peak  6374
 53 ALA  QB     82 PHE  HB2     6.52            #peak  6376
 53 ALA  QB     82 PHE  HB3     6.52            #peak  6377
 49 LEU  QD1    53 ALA  QB      7.54            #peak  6380
 53 ALA  QB     65 VAL  QG2     7.54            #peak  6381
 53 ALA  QB     97 LEU  QD2     7.54            #peak  6382
 53 ALA  QB     82 PHE  HA      6.52            #peak  6383
 52 LEU  QD1    55 ALA  QB      7.54            #peak  6392
 53 ALA  QB     56 ALA  QB      7.54            #peak  6407
 56 ALA  QB     92 ILE  QG2     7.54            #peak  6409
 56 ALA  QB     89 GLU  HA      6.33            #peak  6411
 56 ALA  QB     92 ILE  HA      6.52            #peak  6412
 56 ALA  QB     93 PHE  HB2     5.53            #peak  6413
 56 ALA  QB     90 MET  HA      6.52            #peak  6414
 56 ALA  QB     93 PHE  HB3     5.53            #peak  6416
 56 ALA  QB     57 SER  HA      6.52            #peak  6418
 56 ALA  QB     57 SER  HB2     6.52            #peak  6430
 53 ALA  QB     57 SER  HB2     6.52            #peak  6431
 57 SER  HB2    63 ALA  QB      6.02            #peak  6432
 56 ALA  QB     57 SER  HB3     6.52            #peak  6435
 53 ALA  QB     57 SER  HB3     6.52            #peak  6436
 57 SER  HB3    63 ALA  QB      6.02            #peak  6437
 58 SER  HB3    59 ALA  QB      6.52            #peak  6447
 58 SER  HB2    59 ALA  QB      6.52            #peak  6448
 59 ALA  QB     60 ASP  HA      6.52            #peak  6460
 57 SER  HA     63 ALA  QB      6.52            #peak  6481
 63 ALA  QB     84 PHE  HA      6.52            #peak  6482
 63 ALA  QB     84 PHE  HZ      6.52            #peak  6483
 63 ALA  QB     82 PHE  HB2     6.52            #peak  6486
 53 ALA  QB     63 ALA  QB      7.54            #peak  6487
 64 SER  HB3    83 THR  QG2     6.52            #peak  6493
 63 ALA  QB     64 SER  HB3     6.52            #peak  6494
 64 SER  HB3    65 VAL  QG1     6.52            #peak  6495
 64 SER  HB2    83 THR  QG2     6.52            #peak  6496
 64 SER  HB2    65 VAL  QG1     6.52            #peak  6498
 63 ALA  QB     64 SER  HB2     6.52            #peak  6505
 63 ALA  QB     82 PHE  HB3     6.52            #peak  6506
 54 ALA  HA     63 ALA  QB      6.52            #peak  6507
 59 ALA  HA     63 ALA  QB      6.52            #peak  6508
 64 SER  HB3    66 ALA  QB      6.52            #peak  6509
 64 SER  HB2    66 ALA  QB      6.52            #peak  6513
 53 ALA  QB     65 VAL  HB      6.52            #peak  6527
 50 LYS  HG3    65 VAL  QG1     6.52            #peak  6528
 50 LYS  HE2    65 VAL  QG1     6.52            #peak  6529
 50 LYS  HA     65 VAL  QG1     6.52            #peak  6530
 64 SER  HA     65 VAL  QG1     6.49            #peak  6531
 65 VAL  QG1    82 PHE  HA      6.52            #peak  6532
 65 VAL  QG2    82 PHE  HA      6.52            #peak  6534
 65 VAL  QG2    80 ALA  HA      6.52            #peak  6535
 50 LYS  HA     65 VAL  QG2     6.52            #peak  6536
 50 LYS  HE2    65 VAL  QG2     6.52            #peak  6537
 50 LYS  HG3    65 VAL  QG2     6.52            #peak  6541
 66 ALA  QB     80 ALA  HA      6.36            #peak  6547
 65 VAL  HA     66 ALA  QB      6.33            #peak  6549
 46 MET  QE     67 TYR  HA      6.52            #peak  6562
 66 ALA  QB     67 TYR  HA      6.52            #peak  6563
 46 MET  QE     67 TYR  QD      8.65            #peak  6571
 67 TYR  QD     78 LEU  QD1     8.65            #peak  6572
 67 TYR  QD     69 ILE  QD1     8.65            #peak  6574
 67 TYR  QD     69 ILE  QG2     8.65            #peak  6576
 65 VAL  QG1    67 TYR  QD      8.65            #peak  6577
 46 MET  QE     67 TYR  QE      8.65            #peak  6586
 42 ALA  QB     67 TYR  QE      8.65            #peak  6587
 67 TYR  QE     78 LEU  QD2     8.56            #peak  6588
 67 TYR  QE     69 ILE  QD1     8.65            #peak  6589
 67 TYR  QE     69 ILE  QG2     8.65            #peak  6591
 65 VAL  QG1    67 TYR  QE      8.65            #peak  6592
 65 VAL  QG2    67 TYR  QE      8.65            #peak  6593
 69 ILE  HA     78 LEU  QD2     6.52            #peak  6621
 69 ILE  HB     78 LEU  QD2     6.52            #peak  6622
 42 ALA  QB     69 ILE  HB      6.46            #peak  6623
 69 ILE  QG2    76 VAL  HA      6.33            #peak  6626
 69 ILE  QG2    71 ASP  HA      6.52            #peak  6627
 69 ILE  QG2    70 LYS  HA      6.52            #peak  6628
 68 LYS  HA     69 ILE  QG2     6.52            #peak  6629
 39 ARG  HA     69 ILE  QG2     5.03            #peak  6630
 39 ARG  HD3    69 ILE  QG2     6.52            #peak  6631
 69 ILE  QG2    76 VAL  HB      4.41            #peak  6632
 43 GLU  HG3    69 ILE  QG2     6.52            #peak  6634
 42 ALA  QB     69 ILE  QG2     6.92            #peak  6636
 69 ILE  QG2    78 LEU  QD2     7.54            #peak  6637
 43 GLU  HA     69 ILE  QD1     6.52            #peak  6641
 39 ARG  HA     69 ILE  QD1     5.96            #peak  6642
 39 ARG  HD3    69 ILE  QD1     6.52            #peak  6643
 42 ALA  HA     69 ILE  QD1     6.52            #peak  6645
 43 GLU  HG3    69 ILE  QD1     4.85            #peak  6646
 39 ARG  HB2    69 ILE  QD1     6.52            #peak  6647
 39 ARG  HB3    69 ILE  QD1     6.52            #peak  6648
 42 ALA  QB     69 ILE  QD1     6.27            #peak  6650
 70 LYS  HB2    72 LEU  QD2     5.53            #peak  6654
 69 ILE  QG2    70 LYS  HB2     6.52            #peak  6655
 70 LYS  HB3    72 LEU  QD2     5.53            #peak  6656
 69 ILE  QG2    70 LYS  HB3     6.52            #peak  6657
 72 LEU  QD1    75 GLN  HB3     6.52            #peak  6683
 72 LEU  QD1    77 GLU  HB3     4.88            #peak  6684
 72 LEU  QD1    77 GLU  HB2     4.88            #peak  6685
 72 LEU  QD2    76 VAL  HA      6.52            #peak  6687
 72 LEU  QD1    75 GLN  HB2     6.52            #peak  6702
 72 LEU  QD1    75 GLN  HG2     6.27            #peak  6707
 72 LEU  QD1    75 GLN  HG3     6.27            #peak  6711
 72 LEU  QD1    76 VAL  HA      6.52            #peak  6726
 69 ILE  QD1    76 VAL  HB      6.52            #peak  6732
 38 THR  HA     76 VAL  QG1     6.52            #peak  6737
 38 THR  HB     76 VAL  QG1     6.52            #peak  6738
 75 GLN  HA     76 VAL  QG1     6.52            #peak  6739
 75 GLN  HA     76 VAL  QG2     6.52            #peak  6740
 38 THR  HA     76 VAL  QG2     6.36            #peak  6741
 41 GLU  HB3    76 VAL  QG2     6.52            #peak  6745
 39 ARG  HB3    76 VAL  QG2     6.52            #peak  6746
 42 ALA  HA     78 LEU  QD2     6.52            #peak  6772
 68 LYS  HA     78 LEU  QD2     6.52            #peak  6774
 67 TYR  HA     78 LEU  QD2     6.52            #peak  6777
 79 ASP  HA     80 ALA  QB      6.52            #peak  6794
 78 LEU  QD2    79 ASP  HA      6.52            #peak  6795
 78 LEU  QD1    80 ALA  HA      6.52            #peak  6821
 78 LEU  QD2    80 ALA  HA      6.52            #peak  6822
 31 LYS  HA     80 ALA  QB      6.02            #peak  6823
 67 TYR  HA     80 ALA  QB      5.12            #peak  6824
 33 SER  HA     80 ALA  QB      6.52            #peak  6825
 32 PHE  HB3    80 ALA  QB      5.53            #peak  6827
 49 LEU  QD1    80 ALA  QB      7.04            #peak  6828
 29 THR  QG2    81 ALA  HA      5.65            #peak  6836
 65 VAL  QG2    80 ALA  QB      7.54            #peak  6841
 49 LEU  QD2    80 ALA  QB      7.54            #peak  6842
 31 LYS  HA     81 ALA  QB      5.59            #peak  6843
 31 LYS  QE     81 ALA  QB      7.40            #peak  6845
 80 ALA  QB     82 PHE  QD      7.87            #peak  6870
 53 ALA  QB     82 PHE  QE      8.65            #peak  6875
 28 CYS  HA     83 THR  QG2     6.52            #peak  6899
 29 THR  HA     83 THR  QG2     6.52            #peak  6900
 53 ALA  QB     84 PHE  QE      8.65            #peak  6925
 63 ALA  QB     84 PHE  QE      8.65            #peak  6926
 87 GLN  HG2    88 ALA  QB      6.52            #peak  6953
 87 GLN  HG2    91 ILE  QG2     5.56            #peak  6955
 87 GLN  HG3    88 ALA  QB      6.52            #peak  6959
 87 GLN  HG3    91 ILE  QG2     5.56            #peak  6961
 88 ALA  HA     91 ILE  QD1     5.93            #peak  6987
 88 ALA  QB     89 GLU  HA      6.52            #peak  7007
 89 GLU  HA     92 ILE  QD1     6.52            #peak  7009
 88 ALA  HA     91 ILE  QG2     6.52            #peak  7040
 56 ALA  QB     92 ILE  HB      5.46            #peak  7065
 89 GLU  HA     92 ILE  QG2     6.52            #peak  7069
 56 ALA  HA     92 ILE  QG2     6.52            #peak  7070
 56 ALA  QB     92 ILE  QD1     7.54            #peak  7075
 56 ALA  HA     92 ILE  QD1     6.52            #peak  7079
 56 ALA  QB     93 PHE  HA      5.09            #peak  7087
 93 PHE  QD     97 LEU  QD2     8.65            #peak  7097
 49 LEU  QD1    93 PHE  QE      8.65            #peak  7102
 93 PHE  QE     97 LEU  QD1     8.65            #peak  7103
 49 LEU  QD1    93 PHE  HZ      6.15            #peak  7109
 94 GLU  HA     95 LEU  QD2     6.52            #peak  7131
 94 GLU  HA     97 LEU  QD1     5.06            #peak  7132
 94 GLU  HA     97 LEU  QD2     6.43            #peak  7133
 94 GLU  HB2    95 LEU  QD2     6.52            #peak  7140
 94 GLU  HB3    95 LEU  QD2     6.52            #peak  7141
 92 ILE  HA     95 LEU  QD1     5.50            #peak  7168
 92 ILE  HA     95 LEU  QD2     6.52            #peak  7170
 52 LEU  QD1    96 SER  HB2     6.52            #peak  7190
 52 LEU  QD1    96 SER  HB3     6.52            #peak  7192
 52 LEU  QD2    96 SER  HB3     6.52            #peak  7193
 52 LEU  QD1    97 LEU  HA      6.52            #peak  7208
 52 LEU  QD2    97 LEU  HA      6.52            #peak  7209
 93 PHE  HA     97 LEU  QD1     6.52            #peak  7219
 97 LEU  QD2   100 LEU  HB3     6.52            #peak  7230
 52 LEU  HB2    97 LEU  QD2     6.52            #peak  7231
 93 PHE  HA     97 LEU  QD2     6.52            #peak  7236
 93 PHE  HZ     97 LEU  QD2     5.43            #peak  7239
 95 LEU  QD2    98 ARG  HD3     5.68            #peak  7257
 95 LEU  QD2    98 ARG  HD2     5.68            #peak  7258
 52 LEU  QD1    99 SER  HB3     6.52            #peak  7285
 52 LEU  QD1    99 SER  HB2     6.52            #peak  7288
 97 LEU  QD2   100 LEU  HB2     6.52            #peak  7305
 48 LYS  HA    100 LEU  QD1     6.52            #peak  7311
 97 LEU  HA    100 LEU  QD1     5.53            #peak  7312
 97 LEU  QD2   100 LEU  QD1     6.64            #peak  7314
 49 LEU  QD2   100 LEU  QD2     7.54            #peak  7315
 97 LEU  HA    100 LEU  QD2     6.52            #peak  7317
 19 ILE  QG2    21 THR  HB      6.52            #peak  7342
 56 ALA  QB     84 PHE  HZ      6.52            #peak  7385
 53 ALA  QB     84 PHE  HZ      6.52            #peak  7386
 87 GLN  HA     90 MET  QE      6.52            #peak  7412
 90 MET  H      90 MET  QE      6.52            #peak  7417
 84 PHE  QD     90 MET  QE      8.65            #peak  7420
 90 MET  QE     93 PHE  H       6.52            #peak  7423
 90 MET  QE     91 ILE  H       6.52            #peak  7424
  8 ASP  HA      9 LYS  QB      5.18            #peak  7187
  9 LYS  H       9 LYS  QB      3.82            #peak   657
 17 ILE  QG1    18 ASP  H       4.97            #peak    91
 18 ASP  H      18 ASP  QB      3.40            #peak   706
 19 ILE  H      19 ILE  QG1     3.51            #peak   712
 19 ILE  QG1    20 GLY  H       5.37            #peak   103
 19 ILE  QG1    21 THR  H       6.16            #peak  7338
 19 ILE  QG1    96 SER  H       5.20            #peak  5203
 21 THR  HA     22 VAL  QQG     8.07            #peak  7343
 23 ILE  H      23 ILE  QG1     4.95            #peak   731
 25 ASN  H      25 ASN  QD2     5.32            #peak  5145
 25 ASN  QB     26 ASP  H       4.34            #peak  4740
 25 ASN  QB     87 GLN  QE2     5.63            #peak  6976
 25 ASN  HB3    87 GLN  HE21    6.58            #peak  6976
 25 ASN  HB3    87 GLN  HE22    6.58            #peak  6976
 26 ASP  H      26 ASP  QB      3.83            #peak   746
 26 ASP  QB     28 CYS  H       6.38            #peak  5790
 26 ASP  QB     29 THR  H       6.38            #peak  5813
 27 ASN  H      27 ASN  QB      3.88            #peak  2018
 27 ASN  H      27 ASN  QD2     6.36            #peak   751
 27 ASN  QD2    90 MET  QE      5.83            #peak  5786
 28 CYS  HA     87 GLN  QE2     5.01            #peak  6971
 28 CYS  QB     83 THR  QG2     6.31            #peak  5795
 28 CYS  QB     84 PHE  H       4.95            #peak  6902
 28 CYS  QB     87 GLN  HA      6.38            #peak  5792
 28 CYS  QB     87 GLN  QB      7.04            #peak  5793
 29 THR  HA     30 SER  QB      5.08            #peak  5825
 29 THR  QG2    31 LYS  QG      5.82            #peak  5858
 29 THR  QG2    31 LYS  QD      7.40            #peak  5808
 30 SER  H      82 PHE  QB      5.22            #peak  5822
 30 SER  H      90 MET  QG      6.38            #peak  5821
 30 SER  QB     53 ALA  QB      7.40            #peak  5853
 30 SER  QB     84 PHE  QD      8.51            #peak  6910
 30 SER  QB     84 PHE  QE      8.51            #peak  6921
 30 SER  QB     90 MET  QG      7.26            #peak  5828
 30 SER  QB     94 GLU  QB      7.26            #peak  5848
 30 SER  QB     94 GLU  QG      7.26            #peak  7148
 30 SER  QB     97 LEU  QD1     7.40            #peak  7220
 31 LYS  H      31 LYS  QB      3.88            #peak   768
 31 LYS  H      31 LYS  QG      4.12            #peak   769
 31 LYS  H      31 LYS  QD      5.35            #peak   772
 31 LYS  H      31 LYS  QE      6.38            #peak   774
 31 LYS  HA     32 PHE  QB      6.22            #peak  5839
 31 LYS  QB     31 LYS  QE      6.32            #peak  2094
 31 LYS  HB2    31 LYS  HE2     7.26            #peak  2094
 31 LYS  HB2    31 LYS  HE3     7.26            #peak  2094
 31 LYS  QB     81 ALA  HA      6.38            #peak  5841
 31 LYS  QB     81 ALA  QB      7.40            #peak  5843
 31 LYS  QG     32 PHE  H       4.94            #peak   161
 31 LYS  QG     81 ALA  QB      7.40            #peak  5857
 31 LYS  QD     81 ALA  HA      6.38            #peak  5860
 31 LYS  QD     82 PHE  H       6.07            #peak  6849
 31 LYS  QE     81 ALA  HA      6.38            #peak  6838
 32 PHE  HA     33 SER  QB      6.38            #peak  5891
 32 PHE  QB     80 ALA  QB      5.36            #peak  6827
 32 PHE  QB     82 PHE  QD      7.45            #peak  5236
 32 PHE  QB     97 LEU  QD2     7.40            #peak  7235
 32 PHE  HZ     34 ARG  QB      5.09            #peak  5876
 32 PHE  HZ     34 ARG  QD      5.37            #peak  5267
 33 SER  HA     78 LEU  QB      6.38            #peak  5885
 33 SER  QB     34 ARG  H       4.38            #peak   178
 33 SER  QB     77 GLU  QG      6.32            #peak  5894
 33 SER  HB2    77 GLU  HG2     7.26            #peak  5894
 33 SER  HB3    77 GLU  HG2     7.26            #peak  5894
 33 SER  QB     80 ALA  H       6.38            #peak  5240
 34 ARG  H      34 ARG  QB      3.89            #peak   791
 34 ARG  H      34 ARG  QG      5.00            #peak   792
 34 ARG  H      34 ARG  QD      6.38            #peak   794
 34 ARG  H      78 LEU  QB      5.26            #peak  5900
 34 ARG  HA     34 ARG  QD      5.29            #peak  2281
 34 ARG  HA     35 PHE  QB      6.38            #peak  5923
 34 ARG  QB     35 PHE  H       3.77            #peak   182
 34 ARG  QB     36 PHE  HZ      4.44            #peak  5255
 34 ARG  QG     35 PHE  H       4.49            #peak   184
 34 ARG  QG     36 PHE  HZ      4.36            #peak  5261
 34 ARG  QG     45 PHE  QE      8.51            #peak  5265
 34 ARG  QD     36 PHE  HZ      5.05            #peak  5278
 34 ARG  QD     45 PHE  QD      7.45            #peak  5268
 35 PHE  QB     36 PHE  H       3.77            #peak   189
 35 PHE  QB     75 GLN  QB      6.32            #peak  5921
 35 PHE  HB2    75 GLN  HB2     7.26            #peak  5921
 35 PHE  HB3    75 GLN  HB2     7.26            #peak  5921
 35 PHE  QB     76 VAL  H       6.38            #peak  6720
 36 PHE  H      75 GLN  QB      4.83            #peak  5944
 36 PHE  QB     37 ALA  H       3.82            #peak   198
 36 PHE  QB     37 ALA  QB      7.40            #peak  5979
 36 PHE  QB     41 GLU  H       6.38            #peak  6049
 36 PHE  QB     41 GLU  QB      5.46            #peak  5952
 36 PHE  HB3    41 GLU  HB2     6.98            #peak  5952
 36 PHE  QB     41 GLU  QG      6.32            #peak  6093
 36 PHE  HB3    41 GLU  HG2     7.26            #peak  6093
 36 PHE  HB3    41 GLU  HG3     7.26            #peak  6093
 36 PHE  QB     42 ALA  H       5.23            #peak  6079
 36 PHE  QB     42 ALA  QB      5.72            #peak  5957
 36 PHE  QB     76 VAL  H       6.38            #peak  6721
 36 PHE  QB     76 VAL  QG2     5.48            #peak  5958
 36 PHE  QD     41 GLU  QB      8.51            #peak  5961
 36 PHE  QD     41 GLU  QG      8.51            #peak  5960
 36 PHE  QE     78 LEU  QB      7.24            #peak  5569
 36 PHE  HZ     78 LEU  QB      6.38            #peak  5968
 37 ALA  H      41 GLU  QB      5.11            #peak  5975
 37 ALA  H      41 GLU  QG      6.38            #peak  5974
 37 ALA  HA     75 GLN  QB      6.38            #peak  6703
 38 THR  H      41 GLU  QG      4.64            #peak  5314
 38 THR  HA     41 GLU  QG      4.95            #peak  6099
 38 THR  HB     40 GLU  QG      6.38            #peak  6042
 38 THR  QG2    40 GLU  QG      7.40            #peak  6041
 39 ARG  QB     40 GLU  H       4.11            #peak  4805
 39 ARG  QB     42 ALA  QB      7.40            #peak  6115
 39 ARG  QB     71 ASP  QB      7.17            #peak  7355
 39 ARG  QB     76 VAL  QG1     6.00            #peak  6005
 39 ARG  QG     40 GLU  H       5.35            #peak   217
 39 ARG  QG     40 GLU  HA      6.38            #peak  6026
 39 ARG  QG     43 GLU  H       6.38            #peak  6126
 39 ARG  QG     43 GLU  QG      5.66            #peak  6140
 39 ARG  HG3    43 GLU  HG2     6.98            #peak  6140
 39 ARG  QG     69 ILE  QG2     7.40            #peak  6635
 39 ARG  QG     69 ILE  QD1     7.40            #peak  6649
 39 ARG  QG     76 VAL  QG1     7.40            #peak  6735
 39 ARG  QD     71 ASP  HA      4.99            #peak  6015
 39 ARG  QD     76 VAL  QG1     7.40            #peak  6017
 40 GLU  H      40 GLU  QG      3.54            #peak   834
 40 GLU  H      41 GLU  QG      6.38            #peak  5313
 40 GLU  HB2    41 GLU  QG      5.23            #peak  6102
 40 GLU  HB3    41 GLU  QG      6.38            #peak  6103
 41 GLU  H      41 GLU  QB      3.66            #peak   838
 41 GLU  H      41 GLU  QG      3.94            #peak   839
 41 GLU  HA     41 GLU  QG      3.47            #peak  2563
 41 GLU  QB     42 ALA  HA      6.38            #peak  6066
 42 ALA  HA     45 PHE  QB      4.06            #peak  6068
 42 ALA  HA     78 LEU  QB      6.38            #peak  6064
 42 ALA  QB     43 GLU  QB      7.40            #peak  6139
 42 ALA  QB     78 LEU  QB      7.40            #peak  6113
 43 GLU  H      43 GLU  QB      3.55            #peak   847
 43 GLU  H      43 GLU  QG      3.65            #peak   849
 43 GLU  HA     43 GLU  QG      3.69            #peak  2599
 43 GLU  QB     45 PHE  H       5.92            #peak  6159
 43 GLU  QB     47 THR  H       5.70            #peak  6209
 43 GLU  QB     69 ILE  QD1     7.28            #peak  6138
 43 GLU  QB     78 LEU  QD2     7.40            #peak  6788
 43 GLU  QG     69 ILE  QD1     4.52            #peak  6646
 44 SER  H      45 PHE  QB      6.38            #peak  6150
 45 PHE  H      45 PHE  QB      3.15            #peak   856
 45 PHE  H      46 MET  QB      5.57            #peak  6160
 45 PHE  HA     48 LYS  QB      6.38            #peak  6165
 45 PHE  HA     48 LYS  QG      5.70            #peak  6167
 45 PHE  HA     48 LYS  QD      6.38            #peak  6166
 45 PHE  QB     46 MET  H       3.87            #peak   248
 45 PHE  QB     78 LEU  HG      6.38            #peak  6169
 45 PHE  QB     78 LEU  QD2     7.40            #peak  6771
 46 MET  H      46 MET  QB      3.86            #peak   865
 46 MET  HA     49 LEU  QB      4.08            #peak  5743
 46 MET  QB     67 TYR  QD      8.51            #peak  6585
 46 MET  QB     78 LEU  QD1     6.69            #peak  5907
 46 MET  QB     78 LEU  QD2     6.53            #peak  6787
 46 MET  QG     47 THR  H       4.96            #peak   259
 46 MET  QG     47 THR  HA      5.48            #peak  6219
 46 MET  QG     50 LYS  H       6.07            #peak  6298
 46 MET  QG     65 VAL  QG2     7.00            #peak  6540
 46 MET  QG     67 TYR  QD      7.07            #peak  6570
 46 MET  QE     67 TYR  QB      7.40            #peak  6198
 47 THR  HA     50 LYS  QG      6.38            #peak  6314
 47 THR  HA     50 LYS  QD      6.38            #peak  6218
 47 THR  HB     48 LYS  QG      5.29            #peak  6248
 48 LYS  H      48 LYS  QB      3.47            #peak  2746
 48 LYS  H      48 LYS  QG      4.07            #peak   878
 48 LYS  H      48 LYS  QD      5.27            #peak   879
 48 LYS  HA     48 LYS  QD      4.89            #peak  2797
 48 LYS  HA     51 GLU  QG      6.38            #peak  6229
 48 LYS  QB     48 LYS  QE      6.32            #peak  2765
 48 LYS  HB2    48 LYS  HE2     7.26            #peak  2765
 48 LYS  HB2    48 LYS  HE3     7.26            #peak  2765
 48 LYS  QB     49 LEU  QD2     7.40            #peak  6292
 48 LYS  QB    100 LEU  QD2     6.32            #peak  6241
 48 LYS  QG     49 LEU  H       4.66            #peak   269
 48 LYS  QG    100 LEU  QD2     6.11            #peak  6249
 48 LYS  QD     49 LEU  QD1     6.75            #peak  6273
 48 LYS  QE    100 LEU  QD1     7.40            #peak  7313
 48 LYS  QE    100 LEU  QD2     7.40            #peak  7316
 49 LEU  H      49 LEU  QB      3.90            #peak  2833
 49 LEU  H      52 LEU  QB      6.19            #peak  6236
 49 LEU  HA     52 LEU  QB      3.95            #peak  6345
 49 LEU  QB     50 LYS  H       4.43            #peak   276
 49 LEU  QD1    52 LEU  QB      5.18            #peak  6276
 49 LEU  QD1    82 PHE  QB      7.40            #peak  6856
 49 LEU  QD2    52 LEU  QB      6.75            #peak  6290
 50 LYS  H      50 LYS  QB      3.73            #peak   893
 50 LYS  H      50 LYS  QG      5.08            #peak   894
 50 LYS  H      51 GLU  QG      5.95            #peak  6299
 50 LYS  QB     51 GLU  H       4.21            #peak   284
 50 LYS  QB     51 GLU  HA      5.48            #peak  6332
 50 LYS  QB     65 VAL  QG2     7.40            #peak  6539
 50 LYS  QG     65 VAL  HB      5.14            #peak  6525
 50 LYS  QG     65 VAL  QG1     5.97            #peak  6528
 50 LYS  QD     51 GLU  H       5.11            #peak   288
 50 LYS  QD     65 VAL  QG2     7.40            #peak  6322
 50 LYS  QE     65 VAL  QG1     6.02            #peak  6324
 50 LYS  QE     65 VAL  QG2     5.97            #peak  6325
 51 GLU  H      51 GLU  QB      3.54            #peak  2964
 51 GLU  H      51 GLU  QG      3.28            #peak   904
 51 GLU  HA     51 GLU  QG      3.43            #peak  2983
 51 GLU  QB     52 LEU  HA      6.01            #peak  6342
 51 GLU  QB     52 LEU  QD2     7.40            #peak  6357
 51 GLU  QB     53 ALA  H       6.38            #peak  6367
 51 GLU  QG     54 ALA  QB      7.34            #peak  6337
 52 LEU  H      52 LEU  QB      3.62            #peak   908
 52 LEU  QB     53 ALA  QB      7.12            #peak  6378
 52 LEU  QB     93 PHE  HA      6.38            #peak  6346
 52 LEU  QB     93 PHE  QE      7.41            #peak  5398
 52 LEU  QB     97 LEU  H       6.13            #peak  7200
 52 LEU  QB     97 LEU  HA      6.38            #peak  7206
 52 LEU  QB     97 LEU  HG      6.38            #peak  6348
 52 LEU  QD1    96 SER  QB      6.36            #peak  7190
 52 LEU  QD2    96 SER  QB      6.18            #peak  6362
 52 LEU  QD2   100 LEU  QB      6.72            #peak  6356
 54 ALA  HA     57 SER  QB      6.38            #peak  6428
 54 ALA  QB     62 GLY  QA      7.06            #peak  6386
 56 ALA  HA     89 GLU  QB      6.38            #peak  6403
 56 ALA  QB     89 GLU  QB      7.40            #peak  6417
 56 ALA  QB     93 PHE  QB      5.09            #peak  6416
 57 SER  H      57 SER  QB      3.70            #peak   928
 57 SER  H      89 GLU  QB      6.38            #peak  6422
 57 SER  HA     89 GLU  QG      6.38            #peak  7010
 57 SER  QB     63 ALA  QB      5.80            #peak  6432
 58 SER  H      89 GLU  QB      6.38            #peak  6441
 58 SER  QB     59 ALA  H       4.14            #peak   322
 58 SER  QB     60 ASP  H       5.64            #peak  6457
 59 ALA  HA     60 ASP  QB      6.38            #peak  6453
 59 ALA  QB     62 GLY  QA      7.15            #peak  6471
 60 ASP  H      60 ASP  QB      3.86            #peak   939
 61 GLU  H      61 GLU  QB      3.65            #peak   943
 62 GLY  QA     63 ALA  QB      7.40            #peak  6474
 63 ALA  QB     84 PHE  QB      7.40            #peak  6504
 64 SER  QB     83 THR  H       4.55            #peak  6906
 65 VAL  HB     82 PHE  QB      6.38            #peak  6526
 65 VAL  QG2    82 PHE  QB      7.40            #peak  6855
 67 TYR  HA     68 LYS  QB      6.38            #peak  6561
 67 TYR  HA     79 ASP  QB      6.38            #peak  6560
 67 TYR  QB     78 LEU  QD2     5.91            #peak  6773
 67 TYR  QB     79 ASP  H       6.38            #peak  6781
 67 TYR  QB     80 ALA  H       6.38            #peak  6814
 67 TYR  QB     80 ALA  HA      6.38            #peak  6820
 67 TYR  QB     81 ALA  H       5.17            #peak  6833
 67 TYR  QE     69 ILE  QG1     8.51            #peak  6590
 68 LYS  H      68 LYS  QG      4.09            #peak   977
 68 LYS  H      69 ILE  QG1     6.38            #peak  6605
 68 LYS  H      79 ASP  QB      4.49            #peak  6598
 68 LYS  QB     69 ILE  H       3.87            #peak  4927
 68 LYS  QB     79 ASP  H       6.38            #peak  6786
 68 LYS  QB     79 ASP  QB      5.79            #peak  6803
 68 LYS  HB2    79 ASP  HB3     7.14            #peak  6803
 68 LYS  QG     69 ILE  H       4.34            #peak   367
 68 LYS  QG     69 ILE  HA      6.38            #peak  6620
 68 LYS  QG     79 ASP  QB      6.21            #peak  6805
 68 LYS  QD     79 ASP  QB      6.31            #peak  6806
 68 LYS  HD2    79 ASP  HB2     7.27            #peak  6806
 68 LYS  HD2    79 ASP  HB3     7.27            #peak  6806
 68 LYS  QE     79 ASP  QB      6.92            #peak  6807
 69 ILE  H      69 ILE  QG1     4.72            #peak   987
 69 ILE  HA     70 LYS  QB      4.67            #peak  6661
 69 ILE  HA     79 ASP  QB      6.38            #peak  6799
 69 ILE  QG2    78 LEU  QB      7.40            #peak  6638
 69 ILE  QG1    70 LYS  H       5.14            #peak   378
 69 ILE  QG1    79 ASP  H       6.38            #peak  6783
 70 LYS  H      70 LYS  QG      4.55            #peak   994
 70 LYS  H      77 GLU  QB      4.80            #peak  6653
 70 LYS  QB     77 GLU  H       4.66            #peak  5516
 70 LYS  QB     77 GLU  HA      6.38            #peak  6658
 70 LYS  QG     71 ASP  H       5.03            #peak   384
 71 ASP  H      71 ASP  QB      3.31            #peak  3462
 71 ASP  QB     72 LEU  H       4.29            #peak   392
 72 LEU  QB     73 GLU  H       3.45            #peak  4954
 72 LEU  QB     73 GLU  HA      6.32            #peak  6675
 72 LEU  QB     75 GLN  QG      4.43            #peak  6677
 72 LEU  QB     75 GLN  QE2     6.30            #peak  6712
 72 LEU  HB2    75 GLN  HE22    7.23            #peak  6712
 72 LEU  HB3    75 GLN  HE22    7.23            #peak  6712
 72 LEU  QB     76 VAL  HA      4.65            #peak  6730
 72 LEU  QD1    75 GLN  QB      6.05            #peak  6683
 72 LEU  QD1    75 GLN  QG      5.89            #peak  6711
 72 LEU  QD1    75 GLN  QE2     4.82            #peak  6714
 72 LEU  QD1    77 GLU  QG      7.37            #peak  6760
 73 GLU  H      73 GLU  QB      3.49            #peak  3514
 73 GLU  HA     74 GLY  QA      5.11            #peak  6690
 73 GLU  QG     74 GLY  H       5.30            #peak   406
 73 GLU  QG     74 GLY  QA      6.18            #peak  6695
 73 GLU  HG2    74 GLY  HA2     7.26            #peak  6695
 73 GLU  HG2    74 GLY  HA3     7.26            #peak  6695
 74 GLY  QA     75 GLN  HA      6.32            #peak  6692
 75 GLN  QB     76 VAL  H       3.44            #peak  4968
 75 GLN  QG     76 VAL  H       4.56            #peak   414
 77 GLU  H      77 GLU  QG      4.52            #peak  1037
 77 GLU  QG     78 LEU  H       4.28            #peak   428
 77 GLU  QG     78 LEU  HA      6.38            #peak  6757
 77 GLU  QG     79 ASP  H       5.48            #peak  6785
 78 LEU  H      78 LEU  QB      3.70            #peak  1040
 78 LEU  HA     79 ASP  QB      6.16            #peak  6801
 79 ASP  QB     80 ALA  H       4.39            #peak  4987
 82 PHE  QB     83 THR  H       4.19            #peak   449
 82 PHE  QB     84 PHE  H       6.38            #peak  7332
 82 PHE  QB     84 PHE  QD      8.51            #peak  6916
 82 PHE  QB     84 PHE  QE      8.51            #peak  6923
 82 PHE  QB     84 PHE  HZ      6.38            #peak  7384
 84 PHE  H      90 MET  QB      6.38            #peak  6903
 84 PHE  QB     85 SER  H       4.39            #peak   461
 84 PHE  QB     86 CYS  H       3.79            #peak  6932
 84 PHE  QB     89 GLU  H       6.38            #peak  6997
 84 PHE  QB     89 GLU  QB      6.04            #peak  6904
 84 PHE  HB3    89 GLU  HB2     7.26            #peak  6904
 84 PHE  HB3    89 GLU  HB3     7.26            #peak  6904
 84 PHE  QB     90 MET  H       5.57            #peak  7015
 84 PHE  QD     90 MET  QB      8.51            #peak  6918
 84 PHE  QD     90 MET  QG      8.51            #peak  6914
 85 SER  H      85 SER  QB      3.90            #peak  1080
 85 SER  H      89 GLU  QB      5.27            #peak  6928
 85 SER  QB     86 CYS  QB      7.26            #peak  6939
 86 CYS  H      89 GLU  QB      4.61            #peak  6935
 86 CYS  H      89 GLU  QG      5.92            #peak  6934
 86 CYS  HA     87 GLN  QB      6.38            #peak  6938
 86 CYS  QB     87 GLN  H       3.68            #peak  5017
 86 CYS  QB     88 ALA  H       4.49            #peak  6984
 87 GLN  H      87 GLN  QB      3.92            #peak  1088
 87 GLN  H      87 GLN  QG      4.53            #peak  1090
 87 GLN  QB     88 ALA  H       4.24            #peak   479
 87 GLN  QB     88 ALA  HA      6.38            #peak  6991
 87 GLN  QB     89 GLU  H       6.38            #peak  6999
 87 GLN  QB     91 ILE  QG2     7.40            #peak  7052
 87 GLN  QG     88 ALA  H       5.22            #peak   481
 87 GLN  QG     88 ALA  HA      6.38            #peak  6992
 87 GLN  QG     91 ILE  H       5.85            #peak  7029
 87 GLN  QG     91 ILE  QG2     5.33            #peak  6961
 87 GLN  QG     91 ILE  QG1     5.25            #peak  6958
 87 GLN  QG     91 ILE  QD1     7.40            #peak  6962
 87 GLN  QE2    90 MET  QB      7.24            #peak  6973
 87 GLN  QE2    91 ILE  QG2     5.43            #peak  6974
 87 GLN  QE2    91 ILE  QD1     7.38            #peak  6967
 88 ALA  HA     91 ILE  QG1     5.23            #peak  6986
 88 ALA  QB     89 GLU  QG      7.40            #peak  7011
 89 GLU  H      89 GLU  QB      3.82            #peak  1098
 89 GLU  H      89 GLU  QG      3.47            #peak  1101
 89 GLU  HA     91 ILE  QG1     6.38            #peak  7043
 89 GLU  HA     93 PHE  QB      6.38            #peak  7095
 89 GLU  QG     90 MET  H       5.17            #peak   492
 89 GLU  QG     92 ILE  QG2     7.40            #peak  7071
 90 MET  H      90 MET  QG      4.77            #peak  1106
 90 MET  H      91 ILE  QG1     5.35            #peak  7019
 90 MET  HA     93 PHE  QB      5.54            #peak  7093
 90 MET  QB     91 ILE  H       4.06            #peak   495
 90 MET  QG     91 ILE  H       4.63            #peak   497
 90 MET  QG     94 GLU  H       6.38            #peak  7126
 91 ILE  H      91 ILE  QG1     3.04            #peak  1112
 91 ILE  H      94 GLU  QG      4.87            #peak  7031
 91 ILE  HA     91 ILE  QG1     3.98            #peak  4015
 91 ILE  HA     94 GLU  QB      5.21            #peak  7137
 91 ILE  HA     94 GLU  QG      4.77            #peak  7035
 91 ILE  QG1    92 ILE  H       4.21            #peak   504
 91 ILE  QG1    92 ILE  HA      5.92            #peak  7041
 91 ILE  QG1    92 ILE  HB      5.20            #peak  7047
 91 ILE  QG1    93 PHE  H       5.79            #peak  7085
 92 ILE  H      92 ILE  QG1     4.77            #peak  1119
 92 ILE  H      93 PHE  QB      6.38            #peak  7060
 92 ILE  HA     95 LEU  QB      4.04            #peak  7163
 92 ILE  HB     95 LEU  QB      6.38            #peak  7066
 92 ILE  QD1    95 LEU  QB      7.40            #peak  7074
 92 ILE  QD1    96 SER  QB      7.40            #peak  7077
 93 PHE  QB     94 GLU  H       4.09            #peak   516
 93 PHE  QD     94 GLU  QB      8.51            #peak  5680
 93 PHE  QD     94 GLU  QG      8.51            #peak  5681
 93 PHE  QE     94 GLU  QB      8.51            #peak  5679
 94 GLU  H      94 GLU  QG      3.50            #peak  1136
 94 GLU  H      95 LEU  QB      6.38            #peak  7119
 94 GLU  HA     94 GLU  QG      3.95            #peak  4161
 94 GLU  HA     97 LEU  QB      4.55            #peak  7210
 94 GLU  QB     97 LEU  QD1     7.40            #peak  7226
 94 GLU  QG     95 LEU  H       4.77            #peak   527
 94 GLU  QG     95 LEU  HG      6.19            #peak  7167
 94 GLU  QG     95 LEU  QD2     7.40            #peak  7151
 94 GLU  QG     97 LEU  QD1     7.40            #peak  7227
 95 LEU  H      95 LEU  QB      3.44            #peak  4179
 95 LEU  HA     98 ARG  QB      6.38            #peak  7162
 95 LEU  QB     97 LEU  H       6.19            #peak  7198
 95 LEU  QD1    99 SER  QB      7.40            #peak  7282
 95 LEU  QD2    98 ARG  QB      6.31            #peak  7252
 97 LEU  H     100 LEU  QB      6.38            #peak  7199
 97 LEU  HA    100 LEU  QB      4.18            #peak  7302
 97 LEU  QD1    98 ARG  QG      7.40            #peak  7228
 97 LEU  QD1    98 ARG  QD      7.40            #peak  7260
 97 LEU  QD2   100 LEU  QB      6.37            #peak  7230
 98 ARG  H      98 ARG  QB      3.42            #peak  1157
 98 ARG  H      98 ARG  QG      4.90            #peak  1159
 98 ARG  H      98 ARG  QD      5.33            #peak  1162
 98 ARG  H      99 SER  QB      6.38            #peak  7241
 98 ARG  HA    102 LEU  QQD     8.07            #peak  7246
 98 ARG  QB    100 LEU  H       6.32            #peak  7295
 98 ARG  QB    102 LEU  HG      6.38            #peak  7250
 98 ARG  QG     99 SER  H       5.02            #peak   550
 99 SER  HA    102 LEU  QQD     8.07            #peak  7284
 99 SER  QB    102 LEU  H       6.38            #peak  5712
 99 SER  QB    102 LEU  QB      7.26            #peak  7280
 99 SER  QB    102 LEU  QQD     8.95            #peak  7283
100 LEU  H     100 LEU  QB      3.49            #peak  1170
100 LEU  QB    102 LEU  H       5.13            #peak  5728
102 LEU  H     102 LEU  QB      3.46            #peak  1179
102 LEU  H     102 LEU  QQD     4.82            #peak  1183
102 LEU  HA    102 LEU  QQD     4.43            #peak  4420
102 LEU  QB    103 GLU  H       4.24            #peak   570

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1  41.670  10.135  26.616
    2    H1   MET   1           H1       MET   1  42.533  11.999  25.342
    3    H2   MET   1           H2       MET   1  41.376  11.719  24.134
    4    H3   MET   1           H3       MET   1  42.564  10.548  24.464
    5    HB2  MET   1           HB2      MET   1  40.901  12.509  26.935
    6    HB3  MET   1           HB3      MET   1  39.523  12.147  25.907
    7    HG2  MET   1           HG2      MET   1  38.688  10.548  27.484
    8    HG3  MET   1           HG3      MET   1  40.141  10.697  28.469
    9    HE1  MET   1           HE1      MET   1  37.045  14.086  27.955
   10    HE2  MET   1           HE2      MET   1  36.886  12.502  27.198
   11    HE3  MET   1           HE3      MET   1  38.163  13.602  26.679
   12    H    ALA   2           H        ALA   2  40.831  10.103  23.412
   13    HA   ALA   2           HA       ALA   2  38.811   8.004  23.866
   14    HB1  ALA   2           HB1      ALA   2  37.908   8.515  21.658
   15    HB2  ALA   2           HB2      ALA   2  39.122   9.775  21.441
   16    HB3  ALA   2           HB3      ALA   2  37.886   9.948  22.687
   17    H    MET   3           H        MET   3  39.122   6.033  22.862
   18    HA   MET   3           HA       MET   3  41.595   5.745  21.289
   19    HB2  MET   3           HB2      MET   3  40.775   3.985  23.610
   20    HB3  MET   3           HB3      MET   3  42.100   3.637  22.513
   21    HG2  MET   3           HG2      MET   3  43.137   4.518  24.385
   22    HG3  MET   3           HG3      MET   3  43.071   5.878  23.269
   23    HE1  MET   3           HE1      MET   3  40.193   5.367  26.847
   24    HE2  MET   3           HE2      MET   3  41.491   4.231  26.478
   25    HE3  MET   3           HE3      MET   3  40.112   4.378  25.388
   26    H    LYS   4           H        LYS   4  38.338   4.778  21.914
   27    HA   LYS   4           HA       LYS   4  38.597   2.367  20.278
   28    HB2  LYS   4           HB2      LYS   4  36.304   3.361  21.977
   29    HB3  LYS   4           HB3      LYS   4  36.334   1.832  21.108
   30    HG2  LYS   4           HG2      LYS   4  38.173   1.057  22.467
   31    HG3  LYS   4           HG3      LYS   4  38.251   2.614  23.293
   32    HD2  LYS   4           HD2      LYS   4  35.876   0.756  23.310
   33    HD3  LYS   4           HD3      LYS   4  37.064   0.887  24.607
   34    HE2  LYS   4           HE2      LYS   4  36.459   3.217  24.949
   35    HE3  LYS   4           HE3      LYS   4  35.315   3.136  23.609
   36    HZ1  LYS   4           HZ1      LYS   4  34.012   1.537  24.821
   37    HZ2  LYS   4           HZ2      LYS   4  34.244   2.911  25.790
   38    HZ3  LYS   4           HZ3      LYS   4  35.145   1.504  26.086
   39    H    ASP   5           H        ASP   5  38.491   2.853  18.165
   40    HA   ASP   5           HA       ASP   5  35.882   3.788  17.253
   41    HB2  ASP   5           HB2      ASP   5  37.620   5.681  17.115
   42    HB3  ASP   5           HB3      ASP   5  38.385   4.723  15.851
   43    H    VAL   6           H        VAL   6  35.420   1.640  16.816
   44    HA   VAL   6           HA       VAL   6  36.451   0.668  14.309
   45    HB   VAL   6           HB       VAL   6  38.180  -0.215  15.734
   46   HG11  VAL   6          HG11      VAL   6  37.045  -0.145  17.874
   47   HG12  VAL   6          HG12      VAL   6  37.713  -1.752  17.584
   48   HG13  VAL   6          HG13      VAL   6  35.985  -1.465  17.378
   49   HG21  VAL   6          HG21      VAL   6  36.224  -2.370  14.954
   50   HG22  VAL   6          HG22      VAL   6  37.934  -2.617  15.310
   51   HG23  VAL   6          HG23      VAL   6  37.454  -1.642  13.921
   52    H    VAL   7           H        VAL   7  34.793  -0.096  13.236
   53    HA   VAL   7           HA       VAL   7  32.922  -1.909  14.472
   54    HB   VAL   7           HB       VAL   7  31.952   0.346  14.907
   55   HG11  VAL   7          HG11      VAL   7  31.009   1.631  13.048
   56   HG12  VAL   7          HG12      VAL   7  31.765   0.520  11.906
   57   HG13  VAL   7          HG13      VAL   7  32.767   1.523  12.954
   58   HG21  VAL   7          HG21      VAL   7  30.379  -1.386  13.002
   59   HG22  VAL   7          HG22      VAL   7  29.699  -0.173  14.087
   60   HG23  VAL   7          HG23      VAL   7  30.499  -1.598  14.750
   61    H    ASP   8           H        ASP   8  32.053  -3.317  12.978
   62    HA   ASP   8           HA       ASP   8  32.319  -2.766  10.161
   63    HB2  ASP   8           HB2      ASP   8  33.649  -4.850   9.719
   64    HB3  ASP   8           HB3      ASP   8  34.546  -3.568  10.521
   65    H    LYS   9           H        LYS   9  30.180  -3.039   9.888
   66    HA   LYS   9           HA       LYS   9  29.356  -5.753   9.457
   67    HB2  LYS   9           HB2      LYS   9  28.805  -5.424  11.878
   68    HB3  LYS   9           HB3      LYS   9  27.737  -4.105  11.413
   69    HG2  LYS   9           HG2      LYS   9  26.479  -5.740  10.003
   70    HG3  LYS   9           HG3      LYS   9  27.458  -7.018  10.724
   71    HD2  LYS   9           HD2      LYS   9  25.565  -7.028  12.059
   72    HD3  LYS   9           HD3      LYS   9  26.669  -6.005  12.976
   73    HE2  LYS   9           HE2      LYS   9  24.508  -5.027  11.113
   74    HE3  LYS   9           HE3      LYS   9  24.387  -5.086  12.870
   75    HZ1  LYS   9           HZ1      LYS   9  24.951  -2.878  12.199
   76    HZ2  LYS   9           HZ2      LYS   9  26.247  -3.426  11.265
   77    HZ3  LYS   9           HZ3      LYS   9  26.313  -3.555  12.954
   78    H    CYS  10           H        CYS  10  29.175  -5.067   7.336
   79    HA   CYS  10           HA       CYS  10  26.930  -3.218   6.822
   80    HG   CYS  10           HG       CYS  10  29.067  -1.717   7.719
   81    HB2  CYS  10           HB2      CYS  10  29.417  -3.628   5.140
   82    HB3  CYS  10           HB3      CYS  10  28.080  -2.553   4.748
   83    H    SER  11           H        SER  11  27.141  -6.203   7.125
   84    HA   SER  11           HA       SER  11  26.770  -7.258   4.476
   85    HG   SER  11           HG       SER  11  28.617  -7.960   5.635
   86    HB2  SER  11           HB2      SER  11  26.427  -8.570   7.177
   87    HB3  SER  11           HB3      SER  11  26.447  -9.405   5.623
   88    H    THR  12           H        THR  12  24.990  -5.963   3.857
   89    HA   THR  12           HA       THR  12  22.505  -7.371   4.355
   90    HB   THR  12           HB       THR  12  22.356  -5.492   5.930
   91    HG1  THR  12           HG1      THR  12  20.354  -4.842   5.278
   92   HG21  THR  12          HG21      THR  12  23.888  -3.936   4.833
   93   HG22  THR  12          HG22      THR  12  22.327  -3.174   5.142
   94   HG23  THR  12          HG23      THR  12  22.736  -3.720   3.515
   95    H    LYS  13           H        LYS  13  21.294  -7.524   2.475
   96    HA   LYS  13           HA       LYS  13  22.716  -6.468   0.126
   97    HB2  LYS  13           HB2      LYS  13  22.578  -8.983   0.519
   98    HB3  LYS  13           HB3      LYS  13  20.865  -8.848   0.142
   99    HG2  LYS  13           HG2      LYS  13  21.317  -8.150  -2.076
  100    HG3  LYS  13           HG3      LYS  13  23.032  -7.923  -1.725
  101    HD2  LYS  13           HD2      LYS  13  23.198 -10.364  -1.272
  102    HD3  LYS  13           HD3      LYS  13  21.522 -10.531  -1.802
  103    HE2  LYS  13           HE2      LYS  13  22.070  -9.782  -4.003
  104    HE3  LYS  13           HE3      LYS  13  23.704  -9.345  -3.503
  105    HZ1  LYS  13           HZ1      LYS  13  22.572 -12.089  -3.658
  106    HZ2  LYS  13           HZ2      LYS  13  24.110 -11.714  -3.043
  107    HZ3  LYS  13           HZ3      LYS  13  23.757 -11.421  -4.672
  108    H    GLY  14           H        GLY  14  19.608  -6.696   1.677
  109    HA2  GLY  14           HA2      GLY  14  17.736  -5.370   1.327
  110    HA3  GLY  14           HA3      GLY  14  18.587  -4.584   0.003
  111    H    CYS  15           H        CYS  15  17.584  -7.923   0.659
  112    HA   CYS  15           HA       CYS  15  16.902  -8.385  -2.076
  113    HG   CYS  15           HG       CYS  15  18.657 -11.531  -0.997
  114    HB2  CYS  15           HB2      CYS  15  16.190 -10.067   0.332
  115    HB3  CYS  15           HB3      CYS  15  16.286 -10.601  -1.344
  116    H    ALA  16           H        ALA  16  15.194  -7.386   0.784
  117    HA   ALA  16           HA       ALA  16  12.600  -7.686  -0.524
  118    HB1  ALA  16           HB1      ALA  16  11.677  -6.940   1.632
  119    HB2  ALA  16           HB2      ALA  16  13.317  -6.725   2.245
  120    HB3  ALA  16           HB3      ALA  16  12.740  -8.335   1.814
  121    H    ILE  17           H        ILE  17  11.506  -6.024  -1.407
  122    HA   ILE  17           HA       ILE  17  12.894  -3.552  -1.807
  123    HB   ILE  17           HB       ILE  17  10.802  -2.888  -3.067
  124   HG12  ILE  17          HG12      ILE  17  10.063  -5.787  -2.586
  125   HG13  ILE  17          HG13      ILE  17   9.244  -4.405  -1.869
  126   HG21  ILE  17          HG21      ILE  17  12.747  -3.748  -4.204
  127   HG22  ILE  17          HG22      ILE  17  11.294  -4.411  -4.951
  128   HG23  ILE  17          HG23      ILE  17  12.259  -5.407  -3.861
  129   HD11  ILE  17          HD11      ILE  17   9.395  -5.025  -4.812
  130   HD12  ILE  17          HD12      ILE  17   8.557  -3.657  -4.080
  131   HD13  ILE  17          HD13      ILE  17   8.007  -5.302  -3.760
  132    H    ASP  18           H        ASP  18  13.061  -2.331  -0.036
  133    HA   ASP  18           HA       ASP  18  10.548  -1.351   1.132
  134    HB2  ASP  18           HB2      ASP  18  11.611  -2.808   2.770
  135    HB3  ASP  18           HB3      ASP  18  13.136  -1.952   2.585
  136    H    ILE  19           H        ILE  19  10.357   0.810   1.241
  137    HA   ILE  19           HA       ILE  19  12.331   2.400  -0.137
  138    HB   ILE  19           HB       ILE  19   9.908   3.491   1.286
  139   HG12  ILE  19          HG12      ILE  19  10.008   2.172  -1.443
  140   HG13  ILE  19          HG13      ILE  19   9.047   1.674  -0.059
  141   HG21  ILE  19          HG21      ILE  19  11.522   5.104   0.432
  142   HG22  ILE  19          HG22      ILE  19  10.006   5.197  -0.463
  143   HG23  ILE  19          HG23      ILE  19  11.402   4.389  -1.176
  144   HD11  ILE  19          HD11      ILE  19   7.692   2.793  -1.733
  145   HD12  ILE  19          HD12      ILE  19   8.706   4.231  -1.605
  146   HD13  ILE  19          HD13      ILE  19   7.733   3.714  -0.228
  147    H    GLY  20           H        GLY  20  11.630   1.535   3.090
  148    HA2  GLY  20           HA2      GLY  20  13.133   2.019   4.878
  149    HA3  GLY  20           HA3      GLY  20  13.580   3.513   4.061
  150    H    THR  21           H        THR  21  10.279   2.484   4.385
  151    HA   THR  21           HA       THR  21   9.744   4.875   5.985
  152    HB   THR  21           HB       THR  21   7.636   3.128   4.734
  153    HG1  THR  21           HG1      THR  21   9.474   4.847   3.473
  154   HG21  THR  21          HG21      THR  21   6.407   5.221   4.569
  155   HG22  THR  21          HG22      THR  21   7.798   6.111   5.187
  156   HG23  THR  21          HG23      THR  21   6.946   4.973   6.230
  157    H    VAL  22           H        VAL  22   7.795   4.550   7.533
  158    HA   VAL  22           HA       VAL  22   8.539   2.587   9.464
  159    HB   VAL  22           HB       VAL  22   6.630   3.455  10.780
  160   HG11  VAL  22          HG11      VAL  22   7.509   5.724  11.079
  161   HG12  VAL  22          HG12      VAL  22   8.397   5.578   9.562
  162   HG13  VAL  22          HG13      VAL  22   8.808   4.541  10.929
  163   HG21  VAL  22          HG21      VAL  22   6.165   5.216   8.374
  164   HG22  VAL  22          HG22      VAL  22   5.358   5.372   9.934
  165   HG23  VAL  22          HG23      VAL  22   5.096   3.935   8.946
  166    H    ILE  23           H        ILE  23   6.764   1.278  10.566
  167    HA   ILE  23           HA       ILE  23   5.387  -0.266   8.471
  168    HB   ILE  23           HB       ILE  23   6.347  -1.118  11.215
  169   HG12  ILE  23          HG12      ILE  23   7.656  -2.797   9.737
  170   HG13  ILE  23          HG13      ILE  23   7.311  -1.685   8.419
  171   HG21  ILE  23          HG21      ILE  23   4.878  -2.737   9.137
  172   HG22  ILE  23          HG22      ILE  23   4.254  -2.231  10.707
  173   HG23  ILE  23          HG23      ILE  23   5.592  -3.376  10.617
  174   HD11  ILE  23          HD11      ILE  23   8.481   0.087   9.598
  175   HD12  ILE  23          HD12      ILE  23   9.520  -1.318   9.361
  176   HD13  ILE  23          HD13      ILE  23   8.803  -1.008  10.942
  177    H    ASP  24           H        ASP  24   3.202  -0.331   8.488
  178    HA   ASP  24           HA       ASP  24   1.735   0.838  10.694
  179    HB2  ASP  24           HB2      ASP  24   0.904   1.217   8.419
  180    HB3  ASP  24           HB3      ASP  24   0.724  -0.521   8.180
  181    H    ASN  25           H        ASN  25   1.110  -0.257  12.420
  182    HA   ASN  25           HA       ASN  25   1.163  -3.187  12.266
  183    HB2  ASN  25           HB2      ASN  25   2.847  -2.450  13.771
  184    HB3  ASN  25           HB3      ASN  25   1.758  -1.301  14.537
  185   HD21  ASN  25          HD21      ASN  25   0.364  -1.984  16.091
  186   HD22  ASN  25          HD22      ASN  25   0.412  -3.567  16.786
  187    H    ASP  26           H        ASP  26  -0.799  -3.973  12.068
  188    HA   ASP  26           HA       ASP  26  -2.484  -4.056  14.271
  189    HB2  ASP  26           HB2      ASP  26  -3.078  -1.707  13.409
  190    HB3  ASP  26           HB3      ASP  26  -3.834  -2.526  12.043
  191    H    ASN  27           H        ASN  27  -2.501  -4.158  10.709
  192    HA   ASN  27           HA       ASN  27  -3.864  -6.769  10.879
  193    HB2  ASN  27           HB2      ASN  27  -4.327  -4.598   8.822
  194    HB3  ASN  27           HB3      ASN  27  -5.043  -6.204   8.776
  195   HD21  ASN  27          HD21      ASN  27  -5.133  -3.072  10.171
  196   HD22  ASN  27          HD22      ASN  27  -6.577  -3.287  11.100
  197    H    CYS  28           H        CYS  28  -3.780  -7.844   8.643
  198    HA   CYS  28           HA       CYS  28  -1.212  -7.355   7.290
  199    HG   CYS  28           HG       CYS  28  -2.885 -11.712   7.486
  200    HB2  CYS  28           HB2      CYS  28  -1.310  -9.763   6.603
  201    HB3  CYS  28           HB3      CYS  28  -1.127  -9.535   8.338
  202    H    THR  29           H        THR  29  -4.589  -7.460   7.160
  203    HA   THR  29           HA       THR  29  -4.674  -7.363   4.237
  204    HB   THR  29           HB       THR  29  -6.899  -7.353   6.294
  205    HG1  THR  29           HG1      THR  29  -6.285  -9.415   6.235
  206   HG21  THR  29          HG21      THR  29  -8.407  -7.714   4.375
  207   HG22  THR  29          HG22      THR  29  -7.044  -7.482   3.280
  208   HG23  THR  29          HG23      THR  29  -7.593  -6.151   4.298
  209    H    SER  30           H        SER  30  -4.524  -5.424   3.263
  210    HA   SER  30           HA       SER  30  -4.911  -3.026   4.909
  211    HG   SER  30           HG       SER  30  -2.992  -1.130   2.615
  212    HB2  SER  30           HB2      SER  30  -2.757  -3.363   3.593
  213    HB3  SER  30           HB3      SER  30  -3.718  -3.149   2.130
  214    H    LYS  31           H        LYS  31  -6.209  -1.302   4.180
  215    HA   LYS  31           HA       LYS  31  -8.168  -2.052   2.115
  216    HB2  LYS  31           HB2      LYS  31  -8.955  -0.226   4.347
  217    HB3  LYS  31           HB3      LYS  31  -9.961  -1.269   3.359
  218    HG2  LYS  31           HG2      LYS  31 -10.025  -2.248   5.451
  219    HG3  LYS  31           HG3      LYS  31  -8.811  -3.204   4.597
  220    HD2  LYS  31           HD2      LYS  31  -7.038  -2.166   5.706
  221    HD3  LYS  31           HD3      LYS  31  -8.040  -0.811   6.215
  222    HE2  LYS  31           HE2      LYS  31  -7.580  -2.212   8.123
  223    HE3  LYS  31           HE3      LYS  31  -9.284  -2.365   7.704
  224    HZ1  LYS  31           HZ1      LYS  31  -7.150  -4.297   6.962
  225    HZ2  LYS  31           HZ2      LYS  31  -8.798  -4.448   6.588
  226    HZ3  LYS  31           HZ3      LYS  31  -8.288  -4.508   8.205
  227    H    PHE  32           H        PHE  32  -7.942  -0.770   0.485
  228    HA   PHE  32           HA       PHE  32  -6.829   1.918   0.898
  229    HD1  PHE  32           HD2      PHE  32  -4.599   2.867  -0.481
  230    HD2  PHE  32           HD1      PHE  32  -7.516   1.637  -3.329
  231    HE1  PHE  32           HE2      PHE  32  -4.059   4.820  -1.873
  232    HE2  PHE  32           HE1      PHE  32  -6.977   3.588  -4.726
  233    HZ   PHE  32           HZ       PHE  32  -5.250   5.185  -3.999
  234    HB2  PHE  32           HB2      PHE  32  -5.497   0.518  -0.584
  235    HB3  PHE  32           HB3      PHE  32  -6.907   0.189  -1.585
  236    H    SER  33           H        SER  33  -8.253   3.498   0.892
  237    HA   SER  33           HA       SER  33 -10.652   3.249  -0.778
  238    HG   SER  33           HG       SER  33 -10.076   3.677   2.815
  239    HB2  SER  33           HB2      SER  33 -11.401   5.154   0.916
  240    HB3  SER  33           HB3      SER  33 -11.556   3.446   1.328
  241    H    ARG  34           H        ARG  34 -11.061   4.688  -2.268
  242    HA   ARG  34           HA       ARG  34  -9.940   7.373  -2.115
  243    HE   ARG  34           HE       ARG  34  -8.933   8.926  -2.287
  244    HB2  ARG  34           HB2      ARG  34  -9.204   5.346  -4.123
  245    HB3  ARG  34           HB3      ARG  34  -9.677   6.898  -4.791
  246    HG2  ARG  34           HG2      ARG  34  -7.683   6.821  -2.577
  247    HG3  ARG  34           HG3      ARG  34  -7.182   6.390  -4.211
  248    HD2  ARG  34           HD2      ARG  34  -6.759   8.734  -3.827
  249    HD3  ARG  34           HD3      ARG  34  -8.040   8.550  -5.021
  250   HH11  ARG  34          HH11      ARG  34  -8.075  10.485  -5.314
  251   HH12  ARG  34          HH12      ARG  34  -9.017  11.913  -4.987
  252   HH21  ARG  34          HH21      ARG  34 -10.166  10.801  -1.861
  253   HH22  ARG  34          HH22      ARG  34 -10.226  12.085  -3.037
  254    H    PHE  35           H        PHE  35 -11.185   8.898  -3.238
  255    HA   PHE  35           HA       PHE  35 -13.864   7.914  -3.934
  256    HD1  PHE  35           HD2      PHE  35 -15.183   7.953  -1.687
  257    HD2  PHE  35           HD1      PHE  35 -12.132  10.845  -1.031
  258    HE1  PHE  35           HE2      PHE  35 -15.091   7.314   0.688
  259    HE2  PHE  35           HE1      PHE  35 -12.035  10.211   1.343
  260    HZ   PHE  35           HZ       PHE  35 -13.517   8.446   2.206
  261    HB2  PHE  35           HB2      PHE  35 -13.137  10.726  -3.104
  262    HB3  PHE  35           HB3      PHE  35 -14.747  10.029  -3.231
  263    H    PHE  36           H        PHE  36 -14.509   8.124  -5.958
  264    HA   PHE  36           HA       PHE  36 -12.975   9.926  -7.719
  265    HD1  PHE  36           HD1      PHE  36 -10.927   8.836  -9.212
  266    HD2  PHE  36           HD2      PHE  36 -12.904   5.776  -7.008
  267    HE1  PHE  36           HE1      PHE  36  -8.750   7.841  -8.645
  268    HE2  PHE  36           HE2      PHE  36 -10.728   4.778  -6.438
  269    HZ   PHE  36           HZ       PHE  36  -8.651   5.811  -7.258
  270    HB2  PHE  36           HB2      PHE  36 -14.152   7.221  -8.382
  271    HB3  PHE  36           HB3      PHE  36 -13.356   8.293  -9.532
  272    H    ALA  37           H        ALA  37 -14.222  10.509  -9.734
  273    HA   ALA  37           HA       ALA  37 -16.766  11.557  -8.907
  274    HB1  ALA  37           HB1      ALA  37 -16.787  12.711 -11.032
  275    HB2  ALA  37           HB2      ALA  37 -15.435  11.733 -11.604
  276    HB3  ALA  37           HB3      ALA  37 -15.203  12.867 -10.274
  277    H    THR  38           H        THR  38 -15.680   8.919 -10.930
  278    HA   THR  38           HA       THR  38 -18.500   8.153 -11.272
  279    HB   THR  38           HB       THR  38 -17.942   7.177 -13.475
  280    HG1  THR  38           HG1      THR  38 -15.774   8.439 -14.184
  281   HG21  THR  38          HG21      THR  38 -17.783   9.276 -14.743
  282   HG22  THR  38          HG22      THR  38 -17.341  10.129 -13.264
  283   HG23  THR  38          HG23      THR  38 -18.940   9.401 -13.417
  284    H    ARG  39           H        ARG  39 -18.888   5.891 -11.359
  285    HA   ARG  39           HA       ARG  39 -17.221   4.246  -9.796
  286    HE   ARG  39           HE       ARG  39 -19.061  -0.678 -11.172
  287    HB2  ARG  39           HB2      ARG  39 -19.530   3.702  -9.955
  288    HB3  ARG  39           HB3      ARG  39 -19.475   3.632 -11.707
  289    HG2  ARG  39           HG2      ARG  39 -18.115   1.618 -11.601
  290    HG3  ARG  39           HG3      ARG  39 -18.105   1.708  -9.837
  291    HD2  ARG  39           HD2      ARG  39 -20.547   1.477  -9.825
  292    HD3  ARG  39           HD3      ARG  39 -20.539   1.362 -11.585
  293   HH11  ARG  39          HH11      ARG  39 -21.521   0.418  -8.927
  294   HH12  ARG  39          HH12      ARG  39 -21.866  -1.180  -8.329
  295   HH21  ARG  39          HH21      ARG  39 -19.533  -2.794 -10.399
  296   HH22  ARG  39          HH22      ARG  39 -20.769  -3.002  -9.183
  297    H    GLU  40           H        GLU  40 -17.302   4.974 -13.190
  298    HA   GLU  40           HA       GLU  40 -15.637   2.983 -14.216
  299    HB2  GLU  40           HB2      GLU  40 -15.869   5.901 -14.947
  300    HB3  GLU  40           HB3      GLU  40 -14.977   4.716 -15.886
  301    HG2  GLU  40           HG2      GLU  40 -17.018   3.468 -16.277
  302    HG3  GLU  40           HG3      GLU  40 -17.923   4.632 -15.308
  303    H    GLU  41           H        GLU  41 -14.791   6.208 -13.000
  304    HA   GLU  41           HA       GLU  41 -12.034   6.056 -13.082
  305    HB2  GLU  41           HB2      GLU  41 -13.926   7.438 -11.199
  306    HB3  GLU  41           HB3      GLU  41 -12.187   7.615 -11.033
  307    HG2  GLU  41           HG2      GLU  41 -13.654   8.234 -13.574
  308    HG3  GLU  41           HG3      GLU  41 -13.394   9.422 -12.299
  309    H    ALA  42           H        ALA  42 -14.257   4.677 -10.764
  310    HA   ALA  42           HA       ALA  42 -12.314   4.019  -8.790
  311    HB1  ALA  42           HB1      ALA  42 -14.059   2.683  -7.769
  312    HB2  ALA  42           HB2      ALA  42 -15.028   2.785  -9.238
  313    HB3  ALA  42           HB3      ALA  42 -14.717   4.237  -8.286
  314    H    GLU  43           H        GLU  43 -13.981   2.081 -11.273
  315    HA   GLU  43           HA       GLU  43 -12.497  -0.277 -10.678
  316    HB2  GLU  43           HB2      GLU  43 -14.232   0.465 -13.032
  317    HB3  GLU  43           HB3      GLU  43 -13.512  -1.126 -12.816
  318    HG2  GLU  43           HG2      GLU  43 -14.699  -1.315 -10.649
  319    HG3  GLU  43           HG3      GLU  43 -15.497   0.217 -10.995
  320    H    SER  44           H        SER  44 -11.942   2.446 -12.757
  321    HA   SER  44           HA       SER  44  -9.937   1.231 -14.382
  322    HG   SER  44           HG       SER  44 -12.155   3.246 -14.716
  323    HB2  SER  44           HB2      SER  44 -10.328   4.156 -13.684
  324    HB3  SER  44           HB3      SER  44  -9.337   3.532 -15.003
  325    H    PHE  45           H        PHE  45  -9.959   2.816 -11.256
  326    HA   PHE  45           HA       PHE  45  -7.100   3.000 -11.108
  327    HD1  PHE  45           HD2      PHE  45  -6.940   5.687 -10.439
  328    HD2  PHE  45           HD1      PHE  45  -7.077   3.034  -7.119
  329    HE1  PHE  45           HE2      PHE  45  -4.993   6.827  -9.456
  330    HE2  PHE  45           HE1      PHE  45  -5.132   4.169  -6.128
  331    HZ   PHE  45           HZ       PHE  45  -4.086   6.065  -7.297
  332    HB2  PHE  45           HB2      PHE  45  -8.987   4.357  -9.845
  333    HB3  PHE  45           HB3      PHE  45  -8.834   3.052  -8.673
  334    H    MET  46           H        MET  46  -9.542   0.682 -10.297
  335    HA   MET  46           HA       MET  46  -8.133  -0.967  -8.526
  336    HB2  MET  46           HB2      MET  46 -10.533  -1.209  -8.923
  337    HB3  MET  46           HB3      MET  46 -10.228  -1.706 -10.581
  338    HG2  MET  46           HG2      MET  46 -10.752  -3.616  -9.187
  339    HG3  MET  46           HG3      MET  46  -9.096  -3.709  -9.783
  340    HE1  MET  46           HE1      MET  46 -11.361  -2.737  -6.749
  341    HE2  MET  46           HE2      MET  46 -10.300  -1.334  -6.884
  342    HE3  MET  46           HE3      MET  46 -10.170  -2.407  -5.490
  343    H    THR  47           H        THR  47  -8.058  -0.697 -12.017
  344    HA   THR  47           HA       THR  47  -6.728  -3.019 -12.720
  345    HB   THR  47           HB       THR  47  -6.279  -0.279 -13.922
  346    HG1  THR  47           HG1      THR  47  -8.215  -0.480 -14.749
  347   HG21  THR  47          HG21      THR  47  -4.653  -1.955 -14.659
  348   HG22  THR  47          HG22      THR  47  -5.752  -1.528 -15.970
  349   HG23  THR  47          HG23      THR  47  -5.966  -3.046 -15.098
  350    H    LYS  48           H        LYS  48  -5.281   0.136 -11.841
  351    HA   LYS  48           HA       LYS  48  -2.641  -0.905 -12.026
  352    HB2  LYS  48           HB2      LYS  48  -1.913   1.236 -11.029
  353    HB3  LYS  48           HB3      LYS  48  -2.896   1.396 -12.473
  354    HG2  LYS  48           HG2      LYS  48  -4.854   1.800 -10.918
  355    HG3  LYS  48           HG3      LYS  48  -3.653   1.970  -9.633
  356    HD2  LYS  48           HD2      LYS  48  -3.848   3.603 -12.162
  357    HD3  LYS  48           HD3      LYS  48  -4.172   4.140 -10.519
  358    HE2  LYS  48           HE2      LYS  48  -1.899   4.017  -9.911
  359    HE3  LYS  48           HE3      LYS  48  -1.494   3.072 -11.341
  360    HZ1  LYS  48           HZ1      LYS  48  -2.261   5.946 -11.272
  361    HZ2  LYS  48           HZ2      LYS  48  -2.047   5.046 -12.693
  362    HZ3  LYS  48           HZ3      LYS  48  -0.738   5.300 -11.654
  363    H    LEU  49           H        LEU  49  -4.943  -0.663  -9.429
  364    HA   LEU  49           HA       LEU  49  -3.200  -1.273  -7.296
  365    HG   LEU  49           HG       LEU  49  -6.383  -0.447  -5.655
  366    HB2  LEU  49           HB2      LEU  49  -6.114  -1.528  -7.795
  367    HB3  LEU  49           HB3      LEU  49  -5.453  -2.547  -6.533
  368   HD11  LEU  49          HD11      LEU  49  -3.390  -0.614  -5.369
  369   HD12  LEU  49          HD12      LEU  49  -4.560  -1.592  -4.483
  370   HD13  LEU  49          HD13      LEU  49  -4.515   0.156  -4.247
  371   HD21  LEU  49          HD21      LEU  49  -5.256   1.670  -6.072
  372   HD22  LEU  49          HD22      LEU  49  -5.917   0.995  -7.562
  373   HD23  LEU  49          HD23      LEU  49  -4.188   0.881  -7.232
  374    H    LYS  50           H        LYS  50  -4.956  -3.380  -9.571
  375    HA   LYS  50           HA       LYS  50  -4.027  -5.823  -8.558
  376    HB2  LYS  50           HB2      LYS  50  -4.773  -5.085 -11.392
  377    HB3  LYS  50           HB3      LYS  50  -4.549  -6.728 -10.810
  378    HG2  LYS  50           HG2      LYS  50  -6.709  -4.773 -10.099
  379    HG3  LYS  50           HG3      LYS  50  -6.861  -6.384 -10.806
  380    HD2  LYS  50           HD2      LYS  50  -5.782  -7.212  -8.632
  381    HD3  LYS  50           HD3      LYS  50  -6.181  -5.624  -7.988
  382    HE2  LYS  50           HE2      LYS  50  -7.929  -7.197  -7.423
  383    HE3  LYS  50           HE3      LYS  50  -8.540  -6.000  -8.563
  384    HZ1  LYS  50           HZ1      LYS  50  -7.595  -8.708  -9.341
  385    HZ2  LYS  50           HZ2      LYS  50  -8.371  -7.570 -10.336
  386    HZ3  LYS  50           HZ3      LYS  50  -9.220  -8.306  -9.067
  387    H    GLU  51           H        GLU  51  -2.651  -3.632 -10.981
  388    HA   GLU  51           HA       GLU  51  -0.457  -5.188 -11.750
  389    HB2  GLU  51           HB2      GLU  51  -0.553  -2.175 -11.477
  390    HB3  GLU  51           HB3      GLU  51   0.576  -3.092 -12.463
  391    HG2  GLU  51           HG2      GLU  51  -1.273  -3.873 -13.852
  392    HG3  GLU  51           HG3      GLU  51  -2.401  -2.943 -12.869
  393    H    LEU  52           H        LEU  52  -0.846  -2.872  -9.121
  394    HA   LEU  52           HA       LEU  52   1.804  -3.110  -8.128
  395    HG   LEU  52           HG       LEU  52   0.371  -0.642  -8.715
  396    HB2  LEU  52           HB2      LEU  52  -0.750  -2.019  -6.985
  397    HB3  LEU  52           HB3      LEU  52   0.738  -2.036  -6.063
  398   HD11  LEU  52          HD11      LEU  52   0.499   0.481  -5.919
  399   HD12  LEU  52          HD12      LEU  52  -0.929   0.428  -6.952
  400   HD13  LEU  52          HD13      LEU  52   0.454   1.422  -7.409
  401   HD21  LEU  52          HD21      LEU  52   2.650  -0.596  -6.740
  402   HD22  LEU  52          HD22      LEU  52   2.542   0.355  -8.222
  403   HD23  LEU  52          HD23      LEU  52   2.660  -1.403  -8.308
  404    H    ALA  53           H        ALA  53  -1.241  -4.704  -7.346
  405    HA   ALA  53           HA       ALA  53  -0.434  -6.017  -5.007
  406    HB1  ALA  53           HB1      ALA  53  -2.770  -5.869  -5.728
  407    HB2  ALA  53           HB2      ALA  53  -2.297  -7.536  -5.400
  408    HB3  ALA  53           HB3      ALA  53  -2.425  -6.967  -7.064
  409    H    ALA  54           H        ALA  54  -0.110  -6.929  -8.402
  410    HA   ALA  54           HA       ALA  54   0.853  -9.547  -7.982
  411    HB1  ALA  54           HB1      ALA  54   1.603  -9.461 -10.293
  412    HB2  ALA  54           HB2      ALA  54   1.390  -7.711 -10.313
  413    HB3  ALA  54           HB3      ALA  54  -0.012  -8.768 -10.141
  414    H    ALA  55           H        ALA  55   2.430  -6.430  -7.947
  415    HA   ALA  55           HA       ALA  55   5.094  -7.494  -8.046
  416    HB1  ALA  55           HB1      ALA  55   4.145  -4.759  -7.203
  417    HB2  ALA  55           HB2      ALA  55   4.604  -5.231  -8.839
  418    HB3  ALA  55           HB3      ALA  55   5.812  -5.217  -7.554
  419    H    ALA  56           H        ALA  56   2.975  -6.206  -5.510
  420    HA   ALA  56           HA       ALA  56   4.836  -6.516  -3.391
  421    HB1  ALA  56           HB1      ALA  56   2.917  -4.971  -3.311
  422    HB2  ALA  56           HB2      ALA  56   2.961  -6.061  -1.925
  423    HB3  ALA  56           HB3      ALA  56   1.828  -6.357  -3.243
  424    H    SER  57           H        SER  57   2.023  -8.444  -4.381
  425    HA   SER  57           HA       SER  57   3.097 -10.674  -2.789
  426    HG   SER  57           HG       SER  57   0.393  -9.486  -4.478
  427    HB2  SER  57           HB2      SER  57   0.725 -11.515  -2.767
  428    HB3  SER  57           HB3      SER  57   0.962  -9.994  -1.904
  429    H    SER  58           H        SER  58   3.899 -12.284  -3.947
  430    HA   SER  58           HA       SER  58   3.625 -12.366  -6.780
  431    HG   SER  58           HG       SER  58   5.861 -12.107  -5.866
  432    HB2  SER  58           HB2      SER  58   4.722 -14.545  -4.993
  433    HB3  SER  58           HB3      SER  58   5.099 -14.260  -6.693
  434    H    ALA  59           H        ALA  59   3.159 -15.242  -4.789
  435    HA   ALA  59           HA       ALA  59   1.662 -16.901  -4.801
  436    HB1  ALA  59           HB1      ALA  59  -0.252 -14.613  -5.258
  437    HB2  ALA  59           HB2      ALA  59   0.309 -15.204  -3.694
  438    HB3  ALA  59           HB3      ALA  59  -0.695 -16.232  -4.716
  439    H    ASP  60           H        ASP  60  -0.616 -17.340  -6.127
  440    HA   ASP  60           HA       ASP  60   0.247 -17.917  -8.816
  441    HB2  ASP  60           HB2      ASP  60  -2.356 -18.399  -7.361
  442    HB3  ASP  60           HB3      ASP  60  -2.131 -18.802  -9.060
  443    H    GLU  61           H        GLU  61  -2.307 -15.947  -7.341
  444    HA   GLU  61           HA       GLU  61  -2.358 -14.294  -9.783
  445    HB2  GLU  61           HB2      GLU  61  -4.718 -15.214  -8.130
  446    HB3  GLU  61           HB3      GLU  61  -4.808 -14.064  -9.460
  447    HG2  GLU  61           HG2      GLU  61  -4.156 -15.734 -11.036
  448    HG3  GLU  61           HG3      GLU  61  -3.796 -16.879  -9.746
  449    H    GLY  62           H        GLY  62  -1.195 -14.152  -6.939
  450    HA2  GLY  62           HA2      GLY  62  -0.562 -12.188  -5.815
  451    HA3  GLY  62           HA3      GLY  62  -1.954 -11.369  -6.514
  452    H    ALA  63           H        ALA  63  -1.799 -10.733  -4.074
  453    HA   ALA  63           HA       ALA  63  -2.817 -12.522  -2.131
  454    HB1  ALA  63           HB1      ALA  63  -3.144 -10.536  -0.758
  455    HB2  ALA  63           HB2      ALA  63  -2.892  -9.508  -2.169
  456    HB3  ALA  63           HB3      ALA  63  -1.569 -10.498  -1.553
  457    H    SER  64           H        SER  64  -4.903 -12.076  -0.942
  458    HA   SER  64           HA       SER  64  -7.090 -12.325  -2.766
  459    HG   SER  64           HG       SER  64  -6.398 -14.071  -1.381
  460    HB2  SER  64           HB2      SER  64  -7.120 -11.994   0.245
  461    HB3  SER  64           HB3      SER  64  -8.448 -12.581  -0.755
  462    H    VAL  65           H        VAL  65  -8.730 -10.863  -3.205
  463    HA   VAL  65           HA       VAL  65  -8.424  -8.176  -2.088
  464    HB   VAL  65           HB       VAL  65  -7.194  -8.057  -4.141
  465   HG11  VAL  65          HG11      VAL  65  -9.633  -9.167  -5.524
  466   HG12  VAL  65          HG12      VAL  65  -8.104 -10.010  -5.273
  467   HG13  VAL  65          HG13      VAL  65  -8.166  -8.591  -6.318
  468   HG21  VAL  65          HG21      VAL  65  -8.434  -6.330  -5.341
  469   HG22  VAL  65          HG22      VAL  65  -8.594  -6.131  -3.595
  470   HG23  VAL  65          HG23      VAL  65  -9.919  -6.825  -4.530
  471    H    ALA  66           H        ALA  66 -10.264  -7.673  -1.193
  472    HA   ALA  66           HA       ALA  66 -12.769  -8.322  -2.616
  473    HB1  ALA  66           HB1      ALA  66 -12.364  -7.896   0.348
  474    HB2  ALA  66           HB2      ALA  66 -12.625  -9.449  -0.445
  475    HB3  ALA  66           HB3      ALA  66 -13.902  -8.233  -0.447
  476    H    TYR  67           H        TYR  67 -13.431  -6.535  -3.668
  477    HA   TYR  67           HA       TYR  67 -12.560  -3.956  -2.575
  478    HD1  TYR  67           HD2      TYR  67 -15.122  -3.233  -5.751
  479    HD2  TYR  67           HD1      TYR  67 -12.342  -6.438  -6.083
  480    HE1  TYR  67           HE2      TYR  67 -16.490  -4.225  -7.533
  481    HE2  TYR  67           HE1      TYR  67 -13.706  -7.435  -7.874
  482    HH   TYR  67           HH       TYR  67 -16.005  -7.390  -8.696
  483    HB2  TYR  67           HB2      TYR  67 -12.825  -3.062  -4.826
  484    HB3  TYR  67           HB3      TYR  67 -11.770  -4.467  -4.830
  485    H    LYS  68           H        LYS  68 -13.923  -2.248  -2.307
  486    HA   LYS  68           HA       LYS  68 -16.799  -2.817  -2.485
  487    HB2  LYS  68           HB2      LYS  68 -15.321  -0.652  -0.985
  488    HB3  LYS  68           HB3      LYS  68 -17.067  -0.836  -1.025
  489    HG2  LYS  68           HG2      LYS  68 -17.011  -2.769   0.259
  490    HG3  LYS  68           HG3      LYS  68 -15.287  -3.011  -0.035
  491    HD2  LYS  68           HD2      LYS  68 -14.890  -0.837   1.165
  492    HD3  LYS  68           HD3      LYS  68 -16.593  -0.859   1.616
  493    HE2  LYS  68           HE2      LYS  68 -16.313  -2.811   2.923
  494    HE3  LYS  68           HE3      LYS  68 -14.701  -3.103   2.264
  495    HZ1  LYS  68           HZ1      LYS  68 -15.471  -0.782   3.954
  496    HZ2  LYS  68           HZ2      LYS  68 -13.921  -1.095   3.334
  497    HZ3  LYS  68           HZ3      LYS  68 -14.602  -2.135   4.488
  498    H    ILE  69           H        ILE  69 -18.049  -1.670  -3.740
  499    HA   ILE  69           HA       ILE  69 -17.073   0.855  -4.866
  500    HB   ILE  69           HB       ILE  69 -18.568  -1.233  -6.474
  501   HG12  ILE  69          HG12      ILE  69 -15.750  -0.169  -6.763
  502   HG13  ILE  69          HG13      ILE  69 -16.185  -1.779  -6.201
  503   HG21  ILE  69          HG21      ILE  69 -19.276   1.032  -7.018
  504   HG22  ILE  69          HG22      ILE  69 -18.323   0.353  -8.338
  505   HG23  ILE  69          HG23      ILE  69 -17.596   1.520  -7.235
  506   HD11  ILE  69          HD11      ILE  69 -17.154  -2.280  -8.381
  507   HD12  ILE  69          HD12      ILE  69 -15.459  -1.812  -8.518
  508   HD13  ILE  69          HD13      ILE  69 -16.726  -0.663  -8.943
  509    H    LYS  70           H        LYS  70 -18.341   2.211  -3.764
  510    HA   LYS  70           HA       LYS  70 -21.205   1.582  -3.579
  511    HB2  LYS  70           HB2      LYS  70 -20.038   2.003  -1.451
  512    HB3  LYS  70           HB3      LYS  70 -19.602   3.607  -2.018
  513    HG2  LYS  70           HG2      LYS  70 -21.887   4.300  -2.025
  514    HG3  LYS  70           HG3      LYS  70 -22.438   2.657  -1.685
  515    HD2  LYS  70           HD2      LYS  70 -21.333   2.724   0.486
  516    HD3  LYS  70           HD3      LYS  70 -20.731   4.346   0.141
  517    HE2  LYS  70           HE2      LYS  70 -22.696   4.409   1.598
  518    HE3  LYS  70           HE3      LYS  70 -23.010   5.193   0.051
  519    HZ1  LYS  70           HZ1      LYS  70 -23.818   2.416   0.742
  520    HZ2  LYS  70           HZ2      LYS  70 -24.187   3.246  -0.691
  521    HZ3  LYS  70           HZ3      LYS  70 -24.843   3.766   0.780
  522    H    ASP  71           H        ASP  71 -22.499   2.539  -4.881
  523    HA   ASP  71           HA       ASP  71 -21.589   4.649  -6.628
  524    HB2  ASP  71           HB2      ASP  71 -24.397   3.548  -6.495
  525    HB3  ASP  71           HB3      ASP  71 -23.553   4.231  -7.872
  526    H    LEU  72           H        LEU  72 -21.438   6.548  -5.446
  527    HA   LEU  72           HA       LEU  72 -23.700   7.332  -3.766
  528    HG   LEU  72           HG       LEU  72 -21.015   6.424  -2.727
  529    HB2  LEU  72           HB2      LEU  72 -20.938   8.504  -4.092
  530    HB3  LEU  72           HB3      LEU  72 -22.177   9.189  -3.058
  531   HD11  LEU  72          HD11      LEU  72 -19.847   7.366  -0.790
  532   HD12  LEU  72          HD12      LEU  72 -20.445   8.971  -1.213
  533   HD13  LEU  72          HD13      LEU  72 -19.334   8.131  -2.294
  534   HD21  LEU  72          HD21      LEU  72 -22.155   6.473  -0.576
  535   HD22  LEU  72          HD22      LEU  72 -23.305   6.671  -1.898
  536   HD23  LEU  72          HD23      LEU  72 -22.807   8.069  -0.945
  537    H    GLU  73           H        GLU  73 -23.765   9.954  -3.807
  538    HA   GLU  73           HA       GLU  73 -24.744  10.545  -6.491
  539    HB2  GLU  73           HB2      GLU  73 -26.154  10.884  -4.436
  540    HB3  GLU  73           HB3      GLU  73 -25.043  12.158  -3.957
  541    HG2  GLU  73           HG2      GLU  73 -25.580  13.336  -6.072
  542    HG3  GLU  73           HG3      GLU  73 -26.805  12.107  -6.393
  543    H    GLY  74           H        GLY  74 -22.982  11.111  -7.693
  544    HA2  GLY  74           HA2      GLY  74 -21.811  13.008  -8.553
  545    HA3  GLY  74           HA3      GLY  74 -21.696  13.638  -6.916
  546    H    GLN  75           H        GLN  75 -20.955  10.705  -6.197
  547    HA   GLN  75           HA       GLN  75 -18.304  10.489  -7.334
  548    HB2  GLN  75           HB2      GLN  75 -17.164  10.517  -5.148
  549    HB3  GLN  75           HB3      GLN  75 -17.890  12.072  -5.526
  550    HG2  GLN  75           HG2      GLN  75 -19.662  11.712  -3.987
  551    HG3  GLN  75           HG3      GLN  75 -19.208  10.023  -3.766
  552   HE21  GLN  75          HE21      GLN  75 -17.484   9.510  -2.455
  553   HE22  GLN  75          HE22      GLN  75 -16.755  10.646  -1.380
  554    H    VAL  76           H        VAL  76 -17.138   8.591  -6.170
  555    HA   VAL  76           HA       VAL  76 -19.046   6.601  -5.161
  556    HB   VAL  76           HB       VAL  76 -17.903   4.822  -6.468
  557   HG11  VAL  76          HG11      VAL  76 -19.014   5.283  -8.595
  558   HG12  VAL  76          HG12      VAL  76 -19.188   6.978  -8.139
  559   HG13  VAL  76          HG13      VAL  76 -20.035   5.728  -7.228
  560   HG21  VAL  76          HG21      VAL  76 -16.557   5.445  -8.416
  561   HG22  VAL  76          HG22      VAL  76 -15.806   5.962  -6.906
  562   HG23  VAL  76          HG23      VAL  76 -16.639   7.137  -7.924
  563    H    GLU  77           H        GLU  77 -18.095   4.978  -3.847
  564    HA   GLU  77           HA       GLU  77 -15.467   5.724  -2.770
  565    HB2  GLU  77           HB2      GLU  77 -17.774   4.168  -1.627
  566    HB3  GLU  77           HB3      GLU  77 -16.162   4.040  -0.938
  567    HG2  GLU  77           HG2      GLU  77 -16.137   6.411  -0.491
  568    HG3  GLU  77           HG3      GLU  77 -17.715   6.584  -1.244
  569    H    LEU  78           H        LEU  78 -13.849   4.665  -3.617
  570    HA   LEU  78           HA       LEU  78 -14.180   1.817  -4.271
  571    HG   LEU  78           HG       LEU  78 -11.631   2.013  -6.943
  572    HB2  LEU  78           HB2      LEU  78 -13.265   3.416  -6.015
  573    HB3  LEU  78           HB3      LEU  78 -11.862   3.620  -4.989
  574   HD11  LEU  78          HD11      LEU  78 -10.305   0.395  -5.689
  575   HD12  LEU  78          HD12      LEU  78 -11.049   0.949  -4.189
  576   HD13  LEU  78          HD13      LEU  78 -10.024   2.040  -5.120
  577   HD21  LEU  78          HD21      LEU  78 -13.782   0.909  -6.759
  578   HD22  LEU  78          HD22      LEU  78 -13.343   0.282  -5.170
  579   HD23  LEU  78          HD23      LEU  78 -12.471  -0.259  -6.604
  580    H    ASP  79           H        ASP  79 -13.676   0.543  -2.655
  581    HA   ASP  79           HA       ASP  79 -11.327   1.184  -1.006
  582    HB2  ASP  79           HB2      ASP  79 -13.308   1.891   0.279
  583    HB3  ASP  79           HB3      ASP  79 -14.001   0.283   0.105
  584    H    ALA  80           H        ALA  80  -9.988  -0.385  -1.591
  585    HA   ALA  80           HA       ALA  80 -11.084  -3.079  -2.006
  586    HB1  ALA  80           HB1      ALA  80  -9.042  -3.529  -3.273
  587    HB2  ALA  80           HB2      ALA  80  -8.459  -1.906  -2.907
  588    HB3  ALA  80           HB3      ALA  80  -9.897  -2.122  -3.905
  589    H    ALA  81           H        ALA  81 -10.743  -4.584  -0.546
  590    HA   ALA  81           HA       ALA  81  -8.683  -4.177   1.484
  591    HB1  ALA  81           HB1      ALA  81 -10.983  -4.712   2.204
  592    HB2  ALA  81           HB2      ALA  81  -9.808  -5.914   2.739
  593    HB3  ALA  81           HB3      ALA  81 -10.861  -6.260   1.366
  594    H    PHE  82           H        PHE  82  -6.763  -4.991   1.089
  595    HA   PHE  82           HA       PHE  82  -6.522  -7.392  -0.587
  596    HD1  PHE  82           HD1      PHE  82  -4.665  -7.186  -2.938
  597    HD2  PHE  82           HD2      PHE  82  -5.796  -3.530  -1.071
  598    HE1  PHE  82           HE1      PHE  82  -5.173  -6.219  -5.144
  599    HE2  PHE  82           HE2      PHE  82  -6.304  -2.561  -3.272
  600    HZ   PHE  82           HZ       PHE  82  -5.994  -3.904  -5.312
  601    HB2  PHE  82           HB2      PHE  82  -4.570  -5.208   0.137
  602    HB3  PHE  82           HB3      PHE  82  -4.060  -6.704  -0.630
  603    H    THR  83           H        THR  83  -6.388  -9.224   0.497
  604    HA   THR  83           HA       THR  83  -5.332  -9.244   3.212
  605    HB   THR  83           HB       THR  83  -6.579 -11.477   1.588
  606    HG1  THR  83           HG1      THR  83  -7.582  -9.605   3.458
  607   HG21  THR  83          HG21      THR  83  -5.911 -11.354   4.534
  608   HG22  THR  83          HG22      THR  83  -5.043 -12.302   3.327
  609   HG23  THR  83          HG23      THR  83  -6.722 -12.686   3.706
  610    H    PHE  84           H        PHE  84  -3.173  -9.213   3.242
  611    HA   PHE  84           HA       PHE  84  -1.660 -10.821   1.350
  612    HD1  PHE  84           HD1      PHE  84   0.517  -9.302   0.095
  613    HD2  PHE  84           HD2      PHE  84  -2.044  -6.991   2.584
  614    HE1  PHE  84           HE1      PHE  84   0.391  -7.574  -1.648
  615    HE2  PHE  84           HE2      PHE  84  -2.177  -5.255   0.840
  616    HZ   PHE  84           HZ       PHE  84  -0.959  -5.549  -1.279
  617    HB2  PHE  84           HB2      PHE  84  -0.819  -8.846   3.479
  618    HB3  PHE  84           HB3      PHE  84   0.320  -9.754   2.491
  619    H    SER  85           H        SER  85   0.229 -12.062   2.292
  620    HA   SER  85           HA       SER  85  -0.834 -13.794   4.396
  621    HG   SER  85           HG       SER  85  -0.148 -14.102   1.347
  622    HB2  SER  85           HB2      SER  85   1.648 -14.171   2.703
  623    HB3  SER  85           HB3      SER  85   0.830 -15.392   3.677
  624    H    CYS  86           H        CYS  86   1.647 -11.474   3.759
  625    HA   CYS  86           HA       CYS  86   2.692 -11.842   6.493
  626    HG   CYS  86           HG       CYS  86   4.291 -12.861   2.833
  627    HB2  CYS  86           HB2      CYS  86   4.306 -10.687   4.228
  628    HB3  CYS  86           HB3      CYS  86   4.878 -11.362   5.750
  629    H    GLN  87           H        GLN  87   3.551  -9.800   7.444
  630    HA   GLN  87           HA       GLN  87   1.835  -7.572   6.768
  631    HB2  GLN  87           HB2      GLN  87   2.272  -8.005   9.112
  632    HB3  GLN  87           HB3      GLN  87   4.005  -7.848   8.852
  633    HG2  GLN  87           HG2      GLN  87   3.874  -5.544   8.559
  634    HG3  GLN  87           HG3      GLN  87   2.143  -5.586   8.240
  635   HE21  GLN  87          HE21      GLN  87   0.712  -5.861   9.963
  636   HE22  GLN  87          HE22      GLN  87   1.182  -5.534  11.599
  637    H    ALA  88           H        ALA  88   5.170  -8.508   6.384
  638    HA   ALA  88           HA       ALA  88   6.343  -6.120   5.635
  639    HB1  ALA  88           HB1      ALA  88   6.904  -8.855   4.491
  640    HB2  ALA  88           HB2      ALA  88   7.582  -8.205   5.984
  641    HB3  ALA  88           HB3      ALA  88   7.982  -7.461   4.437
  642    H    GLU  89           H        GLU  89   4.705  -8.495   3.554
  643    HA   GLU  89           HA       GLU  89   5.008  -6.984   1.182
  644    HB2  GLU  89           HB2      GLU  89   3.165  -8.540   0.332
  645    HB3  GLU  89           HB3      GLU  89   4.670  -9.279   0.861
  646    HG2  GLU  89           HG2      GLU  89   3.582  -9.732   3.058
  647    HG3  GLU  89           HG3      GLU  89   2.069  -9.159   2.359
  648    H    MET  90           H        MET  90   2.688  -6.870   3.759
  649    HA   MET  90           HA       MET  90   0.660  -5.473   2.309
  650    HB2  MET  90           HB2      MET  90   0.211  -6.785   4.378
  651    HB3  MET  90           HB3      MET  90   1.114  -5.594   5.303
  652    HG2  MET  90           HG2      MET  90  -1.245  -4.783   3.649
  653    HG3  MET  90           HG3      MET  90  -1.457  -5.476   5.254
  654    HE1  MET  90           HE1      MET  90   0.905  -4.392   6.940
  655    HE2  MET  90           HE2      MET  90  -0.767  -4.293   7.497
  656    HE3  MET  90           HE3      MET  90   0.270  -2.868   7.564
  657    H    ILE  91           H        ILE  91   3.084  -4.429   4.713
  658    HA   ILE  91           HA       ILE  91   2.425  -1.709   4.579
  659    HB   ILE  91           HB       ILE  91   4.707  -1.335   5.584
  660   HG12  ILE  91          HG12      ILE  91   4.773  -4.350   5.696
  661   HG13  ILE  91          HG13      ILE  91   5.712  -3.401   4.555
  662   HG21  ILE  91          HG21      ILE  91   4.077  -2.342   7.730
  663   HG22  ILE  91          HG22      ILE  91   2.866  -3.320   6.900
  664   HG23  ILE  91          HG23      ILE  91   2.709  -1.564   6.934
  665   HD11  ILE  91          HD11      ILE  91   6.888  -2.337   6.402
  666   HD12  ILE  91          HD12      ILE  91   7.050  -4.093   6.455
  667   HD13  ILE  91          HD13      ILE  91   5.933  -3.276   7.549
  668    H    ILE  92           H        ILE  92   4.876  -3.585   2.779
  669    HA   ILE  92           HA       ILE  92   6.030  -1.316   1.548
  670    HB   ILE  92           HB       ILE  92   7.054  -2.849  -0.047
  671   HG12  ILE  92          HG12      ILE  92   6.612  -5.397   0.668
  672   HG13  ILE  92          HG13      ILE  92   5.014  -4.737   0.996
  673   HG21  ILE  92          HG21      ILE  92   8.068  -2.517   2.141
  674   HG22  ILE  92          HG22      ILE  92   8.361  -4.150   1.545
  675   HG23  ILE  92          HG23      ILE  92   7.137  -3.871   2.782
  676   HD11  ILE  92          HD11      ILE  92   5.115  -5.676  -1.223
  677   HD12  ILE  92          HD12      ILE  92   6.479  -4.634  -1.631
  678   HD13  ILE  92          HD13      ILE  92   4.893  -3.929  -1.311
  679    H    PHE  93           H        PHE  93   3.248  -3.261   0.810
  680    HA   PHE  93           HA       PHE  93   2.723  -2.328  -1.791
  681    HD1  PHE  93           HD2      PHE  93   1.172  -3.709  -3.289
  682    HD2  PHE  93           HD1      PHE  93  -1.335  -2.391  -0.122
  683    HE1  PHE  93           HE2      PHE  93  -0.679  -3.430  -4.882
  684    HE2  PHE  93           HE1      PHE  93  -3.198  -2.112  -1.706
  685    HZ   PHE  93           HZ       PHE  93  -2.869  -2.633  -4.092
  686    HB2  PHE  93           HB2      PHE  93   1.560  -4.248  -0.757
  687    HB3  PHE  93           HB3      PHE  93   0.769  -3.155   0.370
  688    H    GLU  94           H        GLU  94   1.610  -1.172   1.387
  689    HA   GLU  94           HA       GLU  94   0.270   1.131   0.588
  690    HB2  GLU  94           HB2      GLU  94   1.887   0.604   3.083
  691    HB3  GLU  94           HB3      GLU  94   0.860   2.015   2.862
  692    HG2  GLU  94           HG2      GLU  94  -0.164  -0.803   2.672
  693    HG3  GLU  94           HG3      GLU  94  -0.125   0.109   4.181
  694    H    LEU  95           H        LEU  95   3.706   0.635   1.248
  695    HA   LEU  95           HA       LEU  95   4.539   3.298   0.929
  696    HG   LEU  95           HG       LEU  95   5.364   0.510   2.507
  697    HB2  LEU  95           HB2      LEU  95   6.102   0.811   0.235
  698    HB3  LEU  95           HB3      LEU  95   6.764   2.391   0.610
  699   HD11  LEU  95          HD11      LEU  95   8.183   1.571   2.441
  700   HD12  LEU  95          HD12      LEU  95   7.681  -0.058   1.991
  701   HD13  LEU  95          HD13      LEU  95   7.506   0.487   3.659
  702   HD21  LEU  95          HD21      LEU  95   5.766   2.175   4.236
  703   HD22  LEU  95          HD22      LEU  95   4.710   2.818   2.978
  704   HD23  LEU  95          HD23      LEU  95   6.409   3.289   3.031
  705    H    SER  96           H        SER  96   4.600   0.614  -1.398
  706    HA   SER  96           HA       SER  96   5.278   1.972  -3.695
  707    HG   SER  96           HG       SER  96   5.171  -0.947  -2.492
  708    HB2  SER  96           HB2      SER  96   3.288  -0.299  -3.467
  709    HB3  SER  96           HB3      SER  96   4.192   0.151  -4.913
  710    H    LEU  97           H        LEU  97   2.047   1.617  -2.244
  711    HA   LEU  97           HA       LEU  97   0.561   2.888  -4.246
  712    HG   LEU  97           HG       LEU  97  -0.036   0.604  -2.257
  713    HB2  LEU  97           HB2      LEU  97   0.116   2.849  -1.258
  714    HB3  LEU  97           HB3      LEU  97  -1.056   3.442  -2.417
  715   HD11  LEU  97          HD11      LEU  97  -2.701   1.789  -1.489
  716   HD12  LEU  97          HD12      LEU  97  -1.466   1.210  -0.372
  717   HD13  LEU  97          HD13      LEU  97  -2.277   0.078  -1.454
  718   HD21  LEU  97          HD21      LEU  97  -2.186   1.842  -3.972
  719   HD22  LEU  97          HD22      LEU  97  -1.793   0.124  -3.886
  720   HD23  LEU  97          HD23      LEU  97  -0.616   1.267  -4.530
  721    H    ARG  98           H        ARG  98   2.154   4.221  -1.385
  722    HA   ARG  98           HA       ARG  98   1.407   6.904  -1.783
  723    HE   ARG  98           HE       ARG  98   3.735   7.874   1.582
  724    HB2  ARG  98           HB2      ARG  98   3.676   5.630  -0.276
  725    HB3  ARG  98           HB3      ARG  98   3.411   7.371  -0.292
  726    HG2  ARG  98           HG2      ARG  98   1.272   7.125   0.731
  727    HG3  ARG  98           HG3      ARG  98   1.345   5.370   0.569
  728    HD2  ARG  98           HD2      ARG  98   1.843   6.152   2.842
  729    HD3  ARG  98           HD3      ARG  98   3.167   5.247   2.120
  730   HH11  ARG  98          HH11      ARG  98   3.136   6.026   4.496
  731   HH12  ARG  98          HH12      ARG  98   4.172   7.001   5.487
  732   HH21  ARG  98          HH21      ARG  98   5.105   9.149   2.864
  733   HH22  ARG  98          HH22      ARG  98   5.317   8.773   4.556
  734    H    SER  99           H        SER  99   3.963   4.965  -3.112
  735    HA   SER  99           HA       SER  99   5.467   7.203  -4.109
  736    HG   SER  99           HG       SER  99   7.251   6.522  -5.360
  737    HB2  SER  99           HB2      SER  99   6.544   5.070  -3.457
  738    HB3  SER  99           HB3      SER  99   5.697   4.259  -4.770
  739    H    LEU 100           H        LEU 100   3.208   4.822  -5.477
  740    HA   LEU 100           HA       LEU 100   3.630   5.901  -8.150
  741    HG   LEU 100           HG       LEU 100   1.649   4.521  -9.756
  742    HB2  LEU 100           HB2      LEU 100   3.398   3.419  -7.549
  743    HB3  LEU 100           HB3      LEU 100   1.685   3.740  -7.406
  744   HD11  LEU 100          HD11      LEU 100   3.963   5.231  -9.946
  745   HD12  LEU 100          HD12      LEU 100   3.570   4.049 -11.194
  746   HD13  LEU 100          HD13      LEU 100   4.506   3.562  -9.781
  747   HD21  LEU 100          HD21      LEU 100   1.892   2.312 -10.782
  748   HD22  LEU 100          HD22      LEU 100   1.046   2.229  -9.237
  749   HD23  LEU 100          HD23      LEU 100   2.738   1.741  -9.344
  750    H    ALA 101           H        ALA 101   0.825   5.286  -6.033
  751    HA   ALA 101           HA       ALA 101  -0.902   6.846  -7.734
  752    HB1  ALA 101           HB1      ALA 101  -1.413   5.645  -5.008
  753    HB2  ALA 101           HB2      ALA 101  -1.784   4.893  -6.560
  754    HB3  ALA 101           HB3      ALA 101  -2.634   6.356  -6.064
  755    H    LEU 102           H        LEU 102   0.714   7.156  -4.662
  756    HA   LEU 102           HA       LEU 102   1.358   8.894  -3.396
  757    HG   LEU 102           HG       LEU 102   3.265  10.135  -4.120
  758    HB2  LEU 102           HB2      LEU 102   1.626   9.780  -5.960
  759    HB3  LEU 102           HB3      LEU 102   0.619  11.031  -5.256
  760   HD11  LEU 102          HD11      LEU 102   3.557  11.219  -6.285
  761   HD12  LEU 102          HD12      LEU 102   4.148  12.236  -4.971
  762   HD13  LEU 102          HD13      LEU 102   2.597  12.592  -5.732
  763   HD21  LEU 102          HD21      LEU 102   1.487  12.472  -3.443
  764   HD22  LEU 102          HD22      LEU 102   3.089  12.171  -2.768
  765   HD23  LEU 102          HD23      LEU 102   1.767  11.048  -2.441
  766    H    GLU 103           H        GLU 103  -1.575   9.991  -5.148
  767    HA   GLU 103           HA       GLU 103  -2.268  11.702  -2.959
  768    HB2  GLU 103           HB2      GLU 103  -2.742  12.252  -5.345
  769    HB3  GLU 103           HB3      GLU 103  -3.970  10.993  -5.351
  770    HG2  GLU 103           HG2      GLU 103  -5.289  12.155  -3.750
  771    HG3  GLU 103           HG3      GLU 103  -4.000  13.319  -3.446
  772    H    HIS 104           H        HIS 104  -2.272   9.932  -1.376
  773    HA   HIS 104           HA       HIS 104  -5.086   9.101  -1.031
  774    HD1  HIS 104           HD1      HIS 104  -3.561   5.271   1.070
  775    HD2  HIS 104           HD2      HIS 104  -6.502   8.163   0.481
  776    HE1  HIS 104           HE1      HIS 104  -5.675   4.299   2.020
  777    HE2  HIS 104           HE2      HIS 104  -7.470   5.983   1.467
  778    HB2  HIS 104           HB2      HIS 104  -3.191   7.300  -0.925
  779    HB3  HIS 104           HB3      HIS 104  -2.804   8.020   0.635
  780    H    HIS 105           H        HIS 105  -4.876  11.561  -0.778
  781    HA   HIS 105           HA       HIS 105  -4.801  13.481   0.378
  782    HD1  HIS 105           HD1      HIS 105  -4.657  13.267   4.946
  783    HD2  HIS 105           HD2      HIS 105  -5.881  15.364   1.573
  784    HE1  HIS 105           HE1      HIS 105  -4.905  15.662   5.685
  785    HE2  HIS 105           HE2      HIS 105  -5.419  16.936   3.568
  786    HB2  HIS 105           HB2      HIS 105  -6.173  12.228   2.071
  787    HB3  HIS 105           HB3      HIS 105  -4.675  11.838   2.915
  788    H    HIS 106           H        HIS 106  -2.848  11.643   2.709
  789    HA   HIS 106           HA       HIS 106  -0.342  12.199   1.606
  790    HD1  HIS 106           HD1      HIS 106   0.778  14.618   5.246
  791    HD2  HIS 106           HD2      HIS 106   1.971  13.878   1.329
  792    HE1  HIS 106           HE1      HIS 106   3.277  14.924   5.226
  793    HE2  HIS 106           HE2      HIS 106   3.958  14.605   2.819
  794    HB2  HIS 106           HB2      HIS 106  -0.870  14.555   2.079
  795    HB3  HIS 106           HB3      HIS 106  -1.151  14.158   3.769
  796    H    HIS 107           H        HIS 107  -1.143  12.778   5.002
  797    HA   HIS 107           HA       HIS 107   0.353  10.338   5.667
  798    HD1  HIS 107           HD1      HIS 107   2.936  11.050   7.606
  799    HD2  HIS 107           HD2      HIS 107  -0.685  10.778   9.630
  800    HE1  HIS 107           HE1      HIS 107   3.428   9.757   9.705
  801    HE2  HIS 107           HE2      HIS 107   1.164   9.345  10.726
  802    HB2  HIS 107           HB2      HIS 107   1.123  12.529   6.626
  803    HB3  HIS 107           HB3      HIS 107  -0.407  12.638   7.488
  804    H    HIS 108           H        HIS 108  -1.346   8.871   5.306
  805    HA   HIS 108           HA       HIS 108  -3.844   9.220   6.716
  806    HD1  HIS 108           HD1      HIS 108  -4.487   4.892   5.169
  807    HD2  HIS 108           HD2      HIS 108  -6.222   8.439   6.496
  808    HE1  HIS 108           HE1      HIS 108  -6.833   4.291   5.868
  809    HE2  HIS 108           HE2      HIS 108  -7.881   6.458   6.631
  810    HB2  HIS 108           HB2      HIS 108  -3.727   8.125   4.475
  811    HB3  HIS 108           HB3      HIS 108  -2.854   6.785   5.212
  812    H    HIS 109           H        HIS 109  -1.076   7.005   6.890
  813    HA   HIS 109           HA       HIS 109  -1.792   6.504   9.693
  814    HD1  HIS 109           HD1      HIS 109  -2.061   2.328   9.767
  815    HD2  HIS 109           HD2      HIS 109  -4.013   5.570   8.026
  816    HE1  HIS 109           HE1      HIS 109  -4.521   1.800   9.891
  817    HE2  HIS 109           HE2      HIS 109  -5.682   3.853   9.003
  818    HB2  HIS 109           HB2      HIS 109  -0.907   4.553   7.589
  819    HB3  HIS 109           HB3      HIS 109  -0.513   4.256   9.278
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1  15.038 -35.668  24.358
    2    H1   MET   1           H1       MET   1  15.262 -32.816  25.121
    3    H2   MET   1           H2       MET   1  16.540 -33.928  25.024
    4    H3   MET   1           H3       MET   1  15.324 -34.137  26.184
    5    HB2  MET   1           HB2      MET   1  13.087 -34.699  25.609
    6    HB3  MET   1           HB3      MET   1  12.930 -33.496  24.338
    7    HG2  MET   1           HG2      MET   1  12.491 -35.262  22.712
    8    HG3  MET   1           HG3      MET   1  12.665 -36.474  23.979
    9    HE1  MET   1           HE1      MET   1   8.809 -36.492  23.169
   10    HE2  MET   1           HE2      MET   1  10.277 -37.466  23.261
   11    HE3  MET   1           HE3      MET   1  10.124 -36.212  22.027
   12    H    ALA   2           H        ALA   2  16.456 -32.938  23.474
   13    HA   ALA   2           HA       ALA   2  15.487 -32.569  20.804
   14    HB1  ALA   2           HB1      ALA   2  18.047 -31.620  22.095
   15    HB2  ALA   2           HB2      ALA   2  16.521 -30.736  22.058
   16    HB3  ALA   2           HB3      ALA   2  17.392 -31.058  20.558
   17    H    MET   3           H        MET   3  15.705 -34.208  19.412
   18    HA   MET   3           HA       MET   3  18.272 -35.659  19.391
   19    HB2  MET   3           HB2      MET   3  17.094 -37.592  18.524
   20    HB3  MET   3           HB3      MET   3  16.333 -37.055  20.014
   21    HG2  MET   3           HG2      MET   3  14.598 -35.916  18.672
   22    HG3  MET   3           HG3      MET   3  15.338 -36.571  17.213
   23    HE1  MET   3           HE1      MET   3  14.773 -38.201  20.765
   24    HE2  MET   3           HE2      MET   3  13.258 -39.060  20.488
   25    HE3  MET   3           HE3      MET   3  13.294 -37.297  20.442
   26    H    LYS   4           H        LYS   4  16.022 -33.810  17.516
   27    HA   LYS   4           HA       LYS   4  17.842 -34.001  15.228
   28    HB2  LYS   4           HB2      LYS   4  14.846 -34.337  15.101
   29    HB3  LYS   4           HB3      LYS   4  15.853 -34.025  13.696
   30    HG2  LYS   4           HG2      LYS   4  17.042 -36.116  14.067
   31    HG3  LYS   4           HG3      LYS   4  16.064 -36.425  15.503
   32    HD2  LYS   4           HD2      LYS   4  15.207 -37.677  13.598
   33    HD3  LYS   4           HD3      LYS   4  14.043 -36.456  14.116
   34    HE2  LYS   4           HE2      LYS   4  14.962 -34.958  12.321
   35    HE3  LYS   4           HE3      LYS   4  15.899 -36.336  11.745
   36    HZ1  LYS   4           HZ1      LYS   4  13.823 -36.066  10.523
   37    HZ2  LYS   4           HZ2      LYS   4  12.937 -36.248  11.958
   38    HZ3  LYS   4           HZ3      LYS   4  13.853 -37.544  11.359
   39    H    ASP   5           H        ASP   5  18.482 -32.049  14.694
   40    HA   ASP   5           HA       ASP   5  16.575 -29.859  14.505
   41    HB2  ASP   5           HB2      ASP   5  17.478 -29.722  16.826
   42    HB3  ASP   5           HB3      ASP   5  19.101 -29.598  16.159
   43    H    VAL   6           H        VAL   6  16.930 -28.898  12.609
   44    HA   VAL   6           HA       VAL   6  19.669 -28.531  11.658
   45    HB   VAL   6           HB       VAL   6  19.033 -29.256   9.347
   46   HG11  VAL   6          HG11      VAL   6  20.420 -30.688  10.703
   47   HG12  VAL   6          HG12      VAL   6  19.295 -31.668   9.760
   48   HG13  VAL   6          HG13      VAL   6  18.996 -31.385  11.476
   49   HG21  VAL   6          HG21      VAL   6  16.660 -30.469  10.751
   50   HG22  VAL   6          HG22      VAL   6  17.144 -30.809   9.089
   51   HG23  VAL   6          HG23      VAL   6  16.625 -29.186   9.542
   52    H    VAL   7           H        VAL   7  19.923 -26.782  10.269
   53    HA   VAL   7           HA       VAL   7  17.484 -25.330   9.517
   54    HB   VAL   7           HB       VAL   7  18.419 -24.095  11.362
   55   HG11  VAL   7          HG11      VAL   7  20.702 -24.896  11.321
   56   HG12  VAL   7          HG12      VAL   7  20.663 -23.132  11.320
   57   HG13  VAL   7          HG13      VAL   7  21.008 -24.007   9.828
   58   HG21  VAL   7          HG21      VAL   7  18.807 -21.921  10.297
   59   HG22  VAL   7          HG22      VAL   7  17.456 -22.787   9.567
   60   HG23  VAL   7          HG23      VAL   7  19.014 -22.729   8.743
   61    H    ASP   8           H        ASP   8  17.503 -26.153   7.479
   62    HA   ASP   8           HA       ASP   8  19.894 -25.624   5.863
   63    HB2  ASP   8           HB2      ASP   8  19.251 -27.554   4.456
   64    HB3  ASP   8           HB3      ASP   8  19.559 -28.021   6.124
   65    H    LYS   9           H        LYS   9  17.202 -24.235   6.437
   66    HA   LYS   9           HA       LYS   9  16.471 -23.795   3.625
   67    HB2  LYS   9           HB2      LYS   9  14.748 -24.593   5.313
   68    HB3  LYS   9           HB3      LYS   9  14.915 -23.030   6.083
   69    HG2  LYS   9           HG2      LYS   9  14.066 -23.420   3.217
   70    HG3  LYS   9           HG3      LYS   9  12.943 -23.266   4.564
   71    HD2  LYS   9           HD2      LYS   9  13.841 -21.031   5.042
   72    HD3  LYS   9           HD3      LYS   9  14.946 -21.194   3.673
   73    HE2  LYS   9           HE2      LYS   9  13.017 -19.886   3.020
   74    HE3  LYS   9           HE3      LYS   9  13.003 -21.431   2.171
   75    HZ1  LYS   9           HZ1      LYS   9  10.813 -20.793   3.042
   76    HZ2  LYS   9           HZ2      LYS   9  11.433 -20.835   4.622
   77    HZ3  LYS   9           HZ3      LYS   9  11.362 -22.256   3.700
   78    H    CYS  10           H        CYS  10  17.665 -22.147   2.869
   79    HA   CYS  10           HA       CYS  10  17.406 -19.582   4.225
   80    HG   CYS  10           HG       CYS  10  21.479 -20.665   2.569
   81    HB2  CYS  10           HB2      CYS  10  19.866 -19.118   3.803
   82    HB3  CYS  10           HB3      CYS  10  19.503 -20.236   5.111
   83    H    SER  11           H        SER  11  16.136 -18.787   2.645
   84    HA   SER  11           HA       SER  11  17.212 -18.805  -0.097
   85    HG   SER  11           HG       SER  11  14.709 -19.268  -1.772
   86    HB2  SER  11           HB2      SER  11  15.091 -20.042   0.130
   87    HB3  SER  11           HB3      SER  11  14.324 -18.610   0.812
   88    H    THR  12           H        THR  12  18.272 -16.921  -0.277
   89    HA   THR  12           HA       THR  12  17.056 -14.458   0.710
   90    HB   THR  12           HB       THR  12  19.720 -14.746  -0.689
   91    HG1  THR  12           HG1      THR  12  19.757 -16.074   1.154
   92   HG21  THR  12          HG21      THR  12  18.863 -12.467  -0.524
   93   HG22  THR  12          HG22      THR  12  20.250 -12.680   0.544
   94   HG23  THR  12          HG23      THR  12  18.616 -12.669   1.211
   95    H    LYS  13           H        LYS  13  15.770 -13.350  -0.597
   96    HA   LYS  13           HA       LYS  13  16.485 -12.825  -3.336
   97    HB2  LYS  13           HB2      LYS  13  14.508 -13.747  -4.370
   98    HB3  LYS  13           HB3      LYS  13  15.314 -15.033  -3.482
   99    HG2  LYS  13           HG2      LYS  13  13.711 -14.819  -1.669
  100    HG3  LYS  13           HG3      LYS  13  12.923 -13.479  -2.505
  101    HD2  LYS  13           HD2      LYS  13  11.609 -15.402  -2.931
  102    HD3  LYS  13           HD3      LYS  13  12.505 -15.075  -4.416
  103    HE2  LYS  13           HE2      LYS  13  14.158 -16.785  -3.767
  104    HE3  LYS  13           HE3      LYS  13  13.213 -17.130  -2.320
  105    HZ1  LYS  13           HZ1      LYS  13  11.323 -17.621  -3.904
  106    HZ2  LYS  13           HZ2      LYS  13  12.592 -18.742  -3.876
  107    HZ3  LYS  13           HZ3      LYS  13  12.482 -17.619  -5.145
  108    H    GLY  14           H        GLY  14  14.805 -11.345  -4.353
  109    HA2  GLY  14           HA2      GLY  14  12.921  -9.925  -4.139
  110    HA3  GLY  14           HA3      GLY  14  13.031 -10.079  -2.392
  111    H    CYS  15           H        CYS  15  14.113  -8.366  -5.197
  112    HA   CYS  15           HA       CYS  15  15.405  -6.391  -3.436
  113    HG   CYS  15           HG       CYS  15  17.388  -8.179  -3.996
  114    HB2  CYS  15           HB2      CYS  15  15.661  -6.688  -6.440
  115    HB3  CYS  15           HB3      CYS  15  16.547  -5.551  -5.426
  116    H    ALA  16           H        ALA  16  13.975  -4.846  -2.879
  117    HA   ALA  16           HA       ALA  16  12.093  -3.906  -4.941
  118    HB1  ALA  16           HB1      ALA  16  11.421  -4.424  -2.047
  119    HB2  ALA  16           HB2      ALA  16  10.902  -5.401  -3.421
  120    HB3  ALA  16           HB3      ALA  16  10.333  -3.741  -3.255
  121    H    ILE  17           H        ILE  17  10.939  -1.839  -3.988
  122    HA   ILE  17           HA       ILE  17  13.043   0.039  -3.411
  123    HB   ILE  17           HB       ILE  17  11.439   0.803  -4.970
  124   HG12  ILE  17          HG12      ILE  17  10.838   2.163  -2.337
  125   HG13  ILE  17          HG13      ILE  17  12.247   2.483  -3.342
  126   HG21  ILE  17          HG21      ILE  17   9.041   0.988  -4.503
  127   HG22  ILE  17          HG22      ILE  17   9.292   0.213  -2.939
  128   HG23  ILE  17          HG23      ILE  17   9.601  -0.683  -4.426
  129   HD11  ILE  17          HD11      ILE  17  10.756   3.256  -5.138
  130   HD12  ILE  17          HD12      ILE  17  10.585   4.200  -3.658
  131   HD13  ILE  17          HD13      ILE  17   9.371   2.989  -4.077
  132    H    ASP  18           H        ASP  18  13.753   0.280  -1.450
  133    HA   ASP  18           HA       ASP  18  11.922  -0.128   0.810
  134    HB2  ASP  18           HB2      ASP  18  13.881  -1.537   0.899
  135    HB3  ASP  18           HB3      ASP  18  14.941  -0.147   0.677
  136    H    ILE  19           H        ILE  19  10.974   1.695   1.348
  137    HA   ILE  19           HA       ILE  19  11.968   4.281   0.923
  138    HB   ILE  19           HB       ILE  19   9.939   3.433   3.003
  139   HG12  ILE  19          HG12      ILE  19   9.319   2.567   0.804
  140   HG13  ILE  19          HG13      ILE  19   8.246   3.887   1.255
  141   HG21  ILE  19          HG21      ILE  19  10.357   6.078   1.613
  142   HG22  ILE  19          HG22      ILE  19  10.740   5.717   3.297
  143   HG23  ILE  19          HG23      ILE  19   9.063   5.702   2.750
  144   HD11  ILE  19          HD11      ILE  19  10.582   4.079  -0.628
  145   HD12  ILE  19          HD12      ILE  19   9.502   5.398  -0.181
  146   HD13  ILE  19          HD13      ILE  19   8.880   4.014  -1.081
  147    H    GLY  20           H        GLY  20  12.205   2.092   3.656
  148    HA2  GLY  20           HA2      GLY  20  13.858   1.976   5.248
  149    HA3  GLY  20           HA3      GLY  20  14.600   3.392   4.532
  150    H    THR  21           H        THR  21  13.279   5.471   4.941
  151    HA   THR  21           HA       THR  21  13.351   5.720   7.793
  152    HB   THR  21           HB       THR  21  12.698   7.897   5.816
  153    HG1  THR  21           HG1      THR  21  15.156   6.626   6.461
  154   HG21  THR  21          HG21      THR  21  13.832   9.325   7.482
  155   HG22  THR  21          HG22      THR  21  14.039   7.916   8.525
  156   HG23  THR  21          HG23      THR  21  12.419   8.510   8.154
  157    H    VAL  22           H        VAL  22  10.917   5.088   5.610
  158    HA   VAL  22           HA       VAL  22   8.884   5.883   7.576
  159    HB   VAL  22           HB       VAL  22   8.504   6.135   4.585
  160   HG11  VAL  22          HG11      VAL  22   6.451   5.586   5.781
  161   HG12  VAL  22          HG12      VAL  22   6.400   7.240   5.173
  162   HG13  VAL  22          HG13      VAL  22   6.717   6.940   6.880
  163   HG21  VAL  22          HG21      VAL  22   8.474   8.555   4.943
  164   HG22  VAL  22          HG22      VAL  22  10.028   7.857   5.402
  165   HG23  VAL  22          HG23      VAL  22   8.863   8.311   6.646
  166    H    ILE  23           H        ILE  23   8.953   3.712   8.289
  167    HA   ILE  23           HA       ILE  23   7.431   1.895   6.548
  168    HB   ILE  23           HB       ILE  23   9.966   1.342   8.006
  169   HG12  ILE  23          HG12      ILE  23  10.152  -0.385   6.167
  170   HG13  ILE  23          HG13      ILE  23   8.632   0.231   5.536
  171   HG21  ILE  23          HG21      ILE  23   9.469  -1.020   8.344
  172   HG22  ILE  23          HG22      ILE  23   7.804  -0.751   7.828
  173   HG23  ILE  23          HG23      ILE  23   8.399  -0.001   9.308
  174   HD11  ILE  23          HD11      ILE  23  10.517   1.149   4.335
  175   HD12  ILE  23          HD12      ILE  23  11.183   1.790   5.837
  176   HD13  ILE  23          HD13      ILE  23   9.660   2.418   5.208
  177    H    ASP  24           H        ASP  24   5.578   1.254   7.423
  178    HA   ASP  24           HA       ASP  24   5.252   1.522  10.341
  179    HB2  ASP  24           HB2      ASP  24   3.794   2.859   8.579
  180    HB3  ASP  24           HB3      ASP  24   2.908   1.342   8.480
  181    H    ASN  25           H        ASN  25   2.876  -0.011  10.532
  182    HA   ASN  25           HA       ASN  25   3.175  -2.569   9.313
  183    HB2  ASN  25           HB2      ASN  25   3.683  -3.823  11.443
  184    HB3  ASN  25           HB3      ASN  25   5.026  -2.922  10.755
  185   HD21  ASN  25          HD21      ASN  25   2.643  -2.986  13.328
  186   HD22  ASN  25          HD22      ASN  25   3.499  -1.919  14.396
  187    H    ASP  26           H        ASP  26   1.091  -0.784   9.582
  188    HA   ASP  26           HA       ASP  26  -0.629  -1.689  11.717
  189    HB2  ASP  26           HB2      ASP  26  -0.717   0.655  11.070
  190    HB3  ASP  26           HB3      ASP  26  -1.176   0.207   9.430
  191    H    ASN  27           H        ASN  27  -1.082  -3.793  11.396
  192    HA   ASN  27           HA       ASN  27  -2.447  -5.509  10.808
  193    HB2  ASN  27           HB2      ASN  27  -4.064  -3.514  10.349
  194    HB3  ASN  27           HB3      ASN  27  -3.733  -3.841   8.653
  195   HD21  ASN  27          HD21      ASN  27  -6.205  -4.034  10.198
  196   HD22  ASN  27          HD22      ASN  27  -6.761  -5.661   9.999
  197    H    CYS  28           H        CYS  28  -2.777  -7.089   9.097
  198    HA   CYS  28           HA       CYS  28  -0.681  -6.998   7.057
  199    HG   CYS  28           HG       CYS  28  -3.991  -8.775   8.239
  200    HB2  CYS  28           HB2      CYS  28  -1.316  -9.427   6.760
  201    HB3  CYS  28           HB3      CYS  28  -0.671  -9.011   8.343
  202    H    THR  29           H        THR  29  -3.883  -6.267   7.403
  203    HA   THR  29           HA       THR  29  -4.474  -6.747   4.563
  204    HB   THR  29           HB       THR  29  -6.360  -6.211   6.870
  205    HG1  THR  29           HG1      THR  29  -6.602  -8.317   6.911
  206   HG21  THR  29          HG21      THR  29  -8.177  -6.542   5.282
  207   HG22  THR  29          HG22      THR  29  -7.016  -6.738   3.968
  208   HG23  THR  29          HG23      THR  29  -7.171  -5.180   4.783
  209    H    SER  30           H        SER  30  -4.597  -5.049   3.237
  210    HA   SER  30           HA       SER  30  -4.255  -2.386   4.405
  211    HG   SER  30           HG       SER  30  -2.562  -1.108   2.611
  212    HB2  SER  30           HB2      SER  30  -2.639  -3.229   2.677
  213    HB3  SER  30           HB3      SER  30  -3.961  -3.241   1.514
  214    H    LYS  31           H        LYS  31  -5.980  -1.168   4.630
  215    HA   LYS  31           HA       LYS  31  -8.308  -1.599   2.892
  216    HB2  LYS  31           HB2      LYS  31  -7.972  -0.263   5.576
  217    HB3  LYS  31           HB3      LYS  31  -9.429  -0.070   4.613
  218    HG2  LYS  31           HG2      LYS  31  -8.358  -2.743   5.480
  219    HG3  LYS  31           HG3      LYS  31  -9.547  -1.817   6.397
  220    HD2  LYS  31           HD2      LYS  31  -9.883  -2.762   3.549
  221    HD3  LYS  31           HD3      LYS  31 -10.606  -3.521   4.969
  222    HE2  LYS  31           HE2      LYS  31 -11.828  -1.455   5.447
  223    HE3  LYS  31           HE3      LYS  31 -11.104  -0.700   4.030
  224    HZ1  LYS  31           HZ1      LYS  31 -12.832  -3.116   3.941
  225    HZ2  LYS  31           HZ2      LYS  31 -12.247  -2.235   2.616
  226    HZ3  LYS  31           HZ3      LYS  31 -13.375  -1.535   3.657
  227    H    PHE  32           H        PHE  32  -8.426  -0.334   1.205
  228    HA   PHE  32           HA       PHE  32  -7.327   2.397   1.370
  229    HD1  PHE  32           HD2      PHE  32  -5.162   3.276  -0.146
  230    HD2  PHE  32           HD1      PHE  32  -8.275   2.000  -2.747
  231    HE1  PHE  32           HE2      PHE  32  -4.736   5.215  -1.598
  232    HE2  PHE  32           HE1      PHE  32  -7.857   3.936  -4.204
  233    HZ   PHE  32           HZ       PHE  32  -6.088   5.547  -3.628
  234    HB2  PHE  32           HB2      PHE  32  -6.049   0.934  -0.147
  235    HB3  PHE  32           HB3      PHE  32  -7.521   0.578  -1.044
  236    H    SER  33           H        SER  33  -8.822   3.944   1.251
  237    HA   SER  33           HA       SER  33 -11.269   3.398  -0.279
  238    HG   SER  33           HG       SER  33 -10.745   4.231   3.440
  239    HB2  SER  33           HB2      SER  33 -12.452   4.844   1.447
  240    HB3  SER  33           HB3      SER  33 -11.924   3.260   2.014
  241    H    ARG  34           H        ARG  34 -11.576   4.750  -1.877
  242    HA   ARG  34           HA       ARG  34 -10.808   7.555  -1.570
  243    HE   ARG  34           HE       ARG  34  -9.450   8.894  -0.834
  244    HB2  ARG  34           HB2      ARG  34  -9.726   5.643  -3.568
  245    HB3  ARG  34           HB3      ARG  34 -10.097   7.266  -4.121
  246    HG2  ARG  34           HG2      ARG  34  -8.390   6.775  -1.708
  247    HG3  ARG  34           HG3      ARG  34  -7.717   6.782  -3.336
  248    HD2  ARG  34           HD2      ARG  34  -7.433   8.961  -2.355
  249    HD3  ARG  34           HD3      ARG  34  -8.611   9.063  -3.660
  250   HH11  ARG  34          HH11      ARG  34  -9.537  10.452  -3.979
  251   HH12  ARG  34          HH12      ARG  34 -10.757  11.602  -3.511
  252   HH21  ARG  34          HH21      ARG  34 -11.068  10.382  -0.236
  253   HH22  ARG  34          HH22      ARG  34 -11.638  11.552  -1.392
  254    H    PHE  35           H        PHE  35 -12.072   8.980  -2.759
  255    HA   PHE  35           HA       PHE  35 -14.520   7.778  -3.833
  256    HD1  PHE  35           HD2      PHE  35 -16.630   8.107  -1.924
  257    HD2  PHE  35           HD1      PHE  35 -13.197  10.294  -0.688
  258    HE1  PHE  35           HE2      PHE  35 -17.008   7.379   0.398
  259    HE2  PHE  35           HE1      PHE  35 -13.564   9.572   1.634
  260    HZ   PHE  35           HZ       PHE  35 -15.470   8.112   2.179
  261    HB2  PHE  35           HB2      PHE  35 -14.088  10.607  -2.852
  262    HB3  PHE  35           HB3      PHE  35 -15.623   9.888  -3.326
  263    H    PHE  36           H        PHE  36 -15.062   8.054  -5.884
  264    HA   PHE  36           HA       PHE  36 -13.514   9.959  -7.515
  265    HD1  PHE  36           HD2      PHE  36 -11.224   9.156  -8.690
  266    HD2  PHE  36           HD1      PHE  36 -13.041   5.763  -6.878
  267    HE1  PHE  36           HE2      PHE  36  -9.021   8.409  -7.893
  268    HE2  PHE  36           HE1      PHE  36 -10.843   5.010  -6.074
  269    HZ   PHE  36           HZ       PHE  36  -8.829   6.333  -6.582
  270    HB2  PHE  36           HB2      PHE  36 -14.297   7.131  -8.273
  271    HB3  PHE  36           HB3      PHE  36 -13.517   8.290  -9.344
  272    H    ALA  37           H        ALA  37 -14.733   9.808  -9.883
  273    HA   ALA  37           HA       ALA  37 -17.297  10.985  -9.370
  274    HB1  ALA  37           HB1      ALA  37 -17.392  11.348 -11.785
  275    HB2  ALA  37           HB2      ALA  37 -15.972  10.324 -11.999
  276    HB3  ALA  37           HB3      ALA  37 -15.835  11.849 -11.124
  277    H    THR  38           H        THR  38 -16.478   8.344 -11.634
  278    HA   THR  38           HA       THR  38 -19.191   7.290 -11.179
  279    HB   THR  38           HB       THR  38 -19.000   6.278 -13.434
  280    HG1  THR  38           HG1      THR  38 -17.161   7.328 -14.703
  281   HG21  THR  38          HG21      THR  38 -19.177   8.366 -14.726
  282   HG22  THR  38          HG22      THR  38 -18.501   9.258 -13.363
  283   HG23  THR  38          HG23      THR  38 -20.067   8.463 -13.208
  284    H    ARG  39           H        ARG  39 -19.421   4.917 -11.506
  285    HA   ARG  39           HA       ARG  39 -17.718   3.370  -9.937
  286    HE   ARG  39           HE       ARG  39 -21.971   2.258 -11.524
  287    HB2  ARG  39           HB2      ARG  39 -18.888   1.444 -10.823
  288    HB3  ARG  39           HB3      ARG  39 -20.039   2.753 -10.597
  289    HG2  ARG  39           HG2      ARG  39 -20.031   3.240 -12.955
  290    HG3  ARG  39           HG3      ARG  39 -18.758   2.051 -13.230
  291    HD2  ARG  39           HD2      ARG  39 -20.795   1.041 -13.877
  292    HD3  ARG  39           HD3      ARG  39 -20.325   0.314 -12.343
  293   HH11  ARG  39          HH11      ARG  39 -22.272  -0.134 -14.055
  294   HH12  ARG  39          HH12      ARG  39 -24.003  -0.237 -13.943
  295   HH21  ARG  39          HH21      ARG  39 -24.266   2.128 -11.356
  296   HH22  ARG  39          HH22      ARG  39 -25.133   1.064 -12.417
  297    H    GLU  40           H        GLU  40 -17.516   4.263 -13.278
  298    HA   GLU  40           HA       GLU  40 -15.670   2.303 -14.158
  299    HB2  GLU  40           HB2      GLU  40 -16.160   5.094 -15.200
  300    HB3  GLU  40           HB3      GLU  40 -15.338   3.798 -16.051
  301    HG2  GLU  40           HG2      GLU  40 -17.379   2.492 -16.077
  302    HG3  GLU  40           HG3      GLU  40 -18.212   3.750 -15.171
  303    H    GLU  41           H        GLU  41 -15.352   5.597 -12.957
  304    HA   GLU  41           HA       GLU  41 -12.599   5.932 -13.098
  305    HB2  GLU  41           HB2      GLU  41 -14.483   6.870 -10.926
  306    HB3  GLU  41           HB3      GLU  41 -12.870   7.504 -11.208
  307    HG2  GLU  41           HG2      GLU  41 -15.079   7.616 -13.243
  308    HG3  GLU  41           HG3      GLU  41 -14.746   8.901 -12.083
  309    H    ALA  42           H        ALA  42 -14.547   4.108 -10.866
  310    HA   ALA  42           HA       ALA  42 -12.477   3.674  -8.924
  311    HB1  ALA  42           HB1      ALA  42 -15.100   2.241  -9.323
  312    HB2  ALA  42           HB2      ALA  42 -14.835   3.646  -8.292
  313    HB3  ALA  42           HB3      ALA  42 -14.057   2.110  -7.907
  314    H    GLU  43           H        GLU  43 -14.037   1.670 -11.407
  315    HA   GLU  43           HA       GLU  43 -12.474  -0.622 -11.168
  316    HB2  GLU  43           HB2      GLU  43 -13.873   0.641 -13.518
  317    HB3  GLU  43           HB3      GLU  43 -13.005  -0.879 -13.671
  318    HG2  GLU  43           HG2      GLU  43 -15.167  -0.478 -11.632
  319    HG3  GLU  43           HG3      GLU  43 -15.509  -0.994 -13.284
  320    H    SER  44           H        SER  44 -11.932   2.325 -13.027
  321    HA   SER  44           HA       SER  44  -9.629   1.457 -14.406
  322    HG   SER  44           HG       SER  44 -11.992   2.995 -14.937
  323    HB2  SER  44           HB2      SER  44 -10.465   4.273 -13.680
  324    HB3  SER  44           HB3      SER  44  -9.277   3.837 -14.908
  325    H    PHE  45           H        PHE  45 -10.070   2.808 -11.188
  326    HA   PHE  45           HA       PHE  45  -7.277   3.474 -10.933
  327    HD1  PHE  45           HD1      PHE  45  -7.125   6.023  -9.829
  328    HD2  PHE  45           HD2      PHE  45  -7.712   2.978  -6.915
  329    HE1  PHE  45           HE1      PHE  45  -5.329   6.998  -8.459
  330    HE2  PHE  45           HE2      PHE  45  -5.918   3.947  -5.539
  331    HZ   PHE  45           HZ       PHE  45  -4.725   5.958  -6.307
  332    HB2  PHE  45           HB2      PHE  45  -9.201   4.656  -9.737
  333    HB3  PHE  45           HB3      PHE  45  -9.267   3.252  -8.677
  334    H    MET  46           H        MET  46  -9.416   0.850 -10.075
  335    HA   MET  46           HA       MET  46  -7.635  -0.523  -8.356
  336    HB2  MET  46           HB2      MET  46 -10.055  -0.936  -8.375
  337    HB3  MET  46           HB3      MET  46  -9.938  -1.577 -10.007
  338    HG2  MET  46           HG2      MET  46 -10.124  -3.343  -8.334
  339    HG3  MET  46           HG3      MET  46  -8.604  -3.432  -9.222
  340    HE1  MET  46           HE1      MET  46  -8.920  -1.760  -4.930
  341    HE2  MET  46           HE2      MET  46 -10.312  -2.230  -5.905
  342    HE3  MET  46           HE3      MET  46  -9.358  -0.815  -6.353
  343    H    THR  47           H        THR  47  -7.879  -0.272 -11.791
  344    HA   THR  47           HA       THR  47  -6.740  -2.663 -12.623
  345    HB   THR  47           HB       THR  47  -6.407   0.052 -13.909
  346    HG1  THR  47           HG1      THR  47  -8.302  -1.562 -14.995
  347   HG21  THR  47          HG21      THR  47  -4.914  -1.632 -14.859
  348   HG22  THR  47          HG22      THR  47  -6.203  -1.237 -15.995
  349   HG23  THR  47          HG23      THR  47  -6.274  -2.735 -15.067
  350    H    LYS  48           H        LYS  48  -5.102   0.398 -11.775
  351    HA   LYS  48           HA       LYS  48  -2.515  -0.658 -12.311
  352    HB2  LYS  48           HB2      LYS  48  -1.674   1.348 -11.073
  353    HB3  LYS  48           HB3      LYS  48  -2.706   1.683 -12.453
  354    HG2  LYS  48           HG2      LYS  48  -4.587   2.076 -10.945
  355    HG3  LYS  48           HG3      LYS  48  -3.535   1.751  -9.565
  356    HD2  LYS  48           HD2      LYS  48  -2.953   3.886 -11.603
  357    HD3  LYS  48           HD3      LYS  48  -3.885   4.179 -10.141
  358    HE2  LYS  48           HE2      LYS  48  -2.051   3.709  -8.744
  359    HE3  LYS  48           HE3      LYS  48  -1.147   2.956 -10.055
  360    HZ1  LYS  48           HZ1      LYS  48  -0.761   5.042 -11.055
  361    HZ2  LYS  48           HZ2      LYS  48  -0.410   5.242  -9.411
  362    HZ3  LYS  48           HZ3      LYS  48  -1.863   5.839 -10.040
  363    H    LEU  49           H        LEU  49  -4.594  -0.671  -9.540
  364    HA   LEU  49           HA       LEU  49  -2.660  -1.373  -7.592
  365    HG   LEU  49           HG       LEU  49  -5.644  -0.371  -5.666
  366    HB2  LEU  49           HB2      LEU  49  -5.634  -1.612  -7.777
  367    HB3  LEU  49           HB3      LEU  49  -4.792  -2.482  -6.512
  368   HD11  LEU  49          HD11      LEU  49  -3.555  -1.220  -4.741
  369   HD12  LEU  49          HD12      LEU  49  -3.597   0.544  -4.739
  370   HD13  LEU  49          HD13      LEU  49  -2.650  -0.314  -5.954
  371   HD21  LEU  49          HD21      LEU  49  -3.944   0.914  -7.797
  372   HD22  LEU  49          HD22      LEU  49  -4.752   1.768  -6.481
  373   HD23  LEU  49          HD23      LEU  49  -5.704   0.927  -7.703
  374    H    LYS  50           H        LYS  50  -4.420  -3.199  -9.993
  375    HA   LYS  50           HA       LYS  50  -3.943  -5.796  -9.075
  376    HB2  LYS  50           HB2      LYS  50  -4.541  -4.554 -11.691
  377    HB3  LYS  50           HB3      LYS  50  -3.765  -6.128 -11.759
  378    HG2  LYS  50           HG2      LYS  50  -6.178  -6.335 -11.883
  379    HG3  LYS  50           HG3      LYS  50  -5.559  -7.081 -10.409
  380    HD2  LYS  50           HD2      LYS  50  -6.259  -5.199  -9.097
  381    HD3  LYS  50           HD3      LYS  50  -6.708  -4.301 -10.548
  382    HE2  LYS  50           HE2      LYS  50  -7.984  -6.872  -9.624
  383    HE3  LYS  50           HE3      LYS  50  -8.656  -5.260  -9.386
  384    HZ1  LYS  50           HZ1      LYS  50  -8.686  -4.999 -11.820
  385    HZ2  LYS  50           HZ2      LYS  50  -9.670  -6.275 -11.289
  386    HZ3  LYS  50           HZ3      LYS  50  -8.161  -6.606 -11.988
  387    H    GLU  51           H        GLU  51  -1.996  -3.760 -11.236
  388    HA   GLU  51           HA       GLU  51   0.097  -5.576 -11.663
  389    HB2  GLU  51           HB2      GLU  51   0.265  -2.560 -11.584
  390    HB3  GLU  51           HB3      GLU  51   1.404  -3.646 -12.367
  391    HG2  GLU  51           HG2      GLU  51  -0.335  -4.357 -13.919
  392    HG3  GLU  51           HG3      GLU  51  -1.479  -3.265 -13.138
  393    H    LEU  52           H        LEU  52  -0.344  -3.047  -9.256
  394    HA   LEU  52           HA       LEU  52   2.182  -3.297  -8.030
  395    HG   LEU  52           HG       LEU  52   0.380  -0.947  -8.863
  396    HB2  LEU  52           HB2      LEU  52  -0.424  -2.252  -6.922
  397    HB3  LEU  52           HB3      LEU  52   1.140  -2.049  -6.156
  398   HD11  LEU  52          HD11      LEU  52   0.696   0.440  -6.208
  399   HD12  LEU  52          HD12      LEU  52  -0.821   0.165  -7.067
  400   HD13  LEU  52          HD13      LEU  52   0.406   1.225  -7.760
  401   HD21  LEU  52          HD21      LEU  52   2.756  -1.451  -8.685
  402   HD22  LEU  52          HD22      LEU  52   2.847  -0.535  -7.183
  403   HD23  LEU  52          HD23      LEU  52   2.480   0.290  -8.698
  404    H    ALA  53           H        ALA  53  -0.989  -4.691  -7.194
  405    HA   ALA  53           HA       ALA  53  -0.110  -5.960  -4.824
  406    HB1  ALA  53           HB1      ALA  53  -2.470  -5.482  -5.314
  407    HB2  ALA  53           HB2      ALA  53  -2.209  -7.176  -4.900
  408    HB3  ALA  53           HB3      ALA  53  -2.442  -6.706  -6.583
  409    H    ALA  54           H        ALA  54  -0.169  -6.975  -8.183
  410    HA   ALA  54           HA       ALA  54   0.365  -9.720  -7.706
  411    HB1  ALA  54           HB1      ALA  54  -0.571  -8.917  -9.812
  412    HB2  ALA  54           HB2      ALA  54   0.915  -9.828 -10.081
  413    HB3  ALA  54           HB3      ALA  54   0.933  -8.066 -10.162
  414    H    ALA  55           H        ALA  55   2.396  -6.887  -8.064
  415    HA   ALA  55           HA       ALA  55   4.834  -8.447  -8.175
  416    HB1  ALA  55           HB1      ALA  55   4.643  -6.357  -9.437
  417    HB2  ALA  55           HB2      ALA  55   5.970  -6.298  -8.277
  418    HB3  ALA  55           HB3      ALA  55   4.454  -5.465  -7.927
  419    H    ALA  56           H        ALA  56   2.940  -6.742  -5.797
  420    HA   ALA  56           HA       ALA  56   5.073  -6.628  -3.859
  421    HB1  ALA  56           HB1      ALA  56   2.140  -6.015  -3.536
  422    HB2  ALA  56           HB2      ALA  56   3.398  -4.856  -3.964
  423    HB3  ALA  56           HB3      ALA  56   3.414  -5.632  -2.378
  424    H    SER  57           H        SER  57   3.160  -9.128  -4.873
  425    HA   SER  57           HA       SER  57   3.212 -10.357  -2.209
  426    HG   SER  57           HG       SER  57   1.051  -9.992  -5.137
  427    HB2  SER  57           HB2      SER  57   1.494 -11.960  -3.164
  428    HB3  SER  57           HB3      SER  57   0.957 -10.290  -2.983
  429    H    SER  58           H        SER  58   5.065 -11.392  -2.009
  430    HA   SER  58           HA       SER  58   6.094 -12.941  -4.290
  431    HG   SER  58           HG       SER  58   6.846 -10.507  -3.600
  432    HB2  SER  58           HB2      SER  58   7.507 -12.067  -1.758
  433    HB3  SER  58           HB3      SER  58   8.248 -12.887  -3.134
  434    H    ALA  59           H        ALA  59   4.401 -13.285  -1.430
  435    HA   ALA  59           HA       ALA  59   5.294 -15.733  -0.418
  436    HB1  ALA  59           HB1      ALA  59   3.614 -14.323   0.690
  437    HB2  ALA  59           HB2      ALA  59   3.055 -15.985   0.506
  438    HB3  ALA  59           HB3      ALA  59   2.451 -14.727  -0.572
  439    H    ASP  60           H        ASP  60   2.874 -15.055  -2.918
  440    HA   ASP  60           HA       ASP  60   3.704 -17.096  -4.634
  441    HB2  ASP  60           HB2      ASP  60   2.757 -18.663  -3.042
  442    HB3  ASP  60           HB3      ASP  60   1.245 -17.763  -2.998
  443    H    GLU  61           H        GLU  61   0.335 -16.586  -4.021
  444    HA   GLU  61           HA       GLU  61   0.039 -14.253  -5.670
  445    HB2  GLU  61           HB2      GLU  61  -0.728 -16.980  -6.673
  446    HB3  GLU  61           HB3      GLU  61  -1.702 -15.586  -7.116
  447    HG2  GLU  61           HG2      GLU  61   0.217 -14.534  -8.144
  448    HG3  GLU  61           HG3      GLU  61   1.248 -15.873  -7.639
  449    H    GLY  62           H        GLY  62  -0.613 -15.871  -3.072
  450    HA2  GLY  62           HA2      GLY  62  -3.501 -15.954  -3.068
  451    HA3  GLY  62           HA3      GLY  62  -2.434 -16.365  -1.734
  452    H    ALA  63           H        ALA  63  -3.161 -13.462  -3.646
  453    HA   ALA  63           HA       ALA  63  -3.325 -11.930  -1.149
  454    HB1  ALA  63           HB1      ALA  63  -3.267  -9.947  -2.592
  455    HB2  ALA  63           HB2      ALA  63  -3.269 -10.983  -4.022
  456    HB3  ALA  63           HB3      ALA  63  -1.896 -11.006  -2.915
  457    H    SER  64           H        SER  64  -5.265 -11.505  -0.314
  458    HA   SER  64           HA       SER  64  -7.610 -12.063  -1.970
  459    HG   SER  64           HG       SER  64  -7.341 -13.894  -0.782
  460    HB2  SER  64           HB2      SER  64  -7.302 -11.778   1.026
  461    HB3  SER  64           HB3      SER  64  -8.833 -12.080   0.205
  462    H    VAL  65           H        VAL  65  -8.042 -10.262  -3.122
  463    HA   VAL  65           HA       VAL  65  -8.248  -7.741  -1.656
  464    HB   VAL  65           HB       VAL  65  -6.951  -7.473  -3.641
  465   HG11  VAL  65          HG11      VAL  65  -7.797  -8.003  -5.882
  466   HG12  VAL  65          HG12      VAL  65  -9.241  -8.718  -5.160
  467   HG13  VAL  65          HG13      VAL  65  -7.659  -9.440  -4.869
  468   HG21  VAL  65          HG21      VAL  65  -9.736  -6.395  -4.085
  469   HG22  VAL  65          HG22      VAL  65  -8.285  -5.832  -4.914
  470   HG23  VAL  65          HG23      VAL  65  -8.441  -5.625  -3.169
  471    H    ALA  66           H        ALA  66 -10.108  -7.298  -0.828
  472    HA   ALA  66           HA       ALA  66 -12.550  -8.039  -2.300
  473    HB1  ALA  66           HB1      ALA  66 -12.398  -9.114  -0.103
  474    HB2  ALA  66           HB2      ALA  66 -13.733  -7.962  -0.164
  475    HB3  ALA  66           HB3      ALA  66 -12.233  -7.532   0.660
  476    H    TYR  67           H        TYR  67 -12.835  -6.247  -3.555
  477    HA   TYR  67           HA       TYR  67 -12.936  -3.686  -2.121
  478    HD1  TYR  67           HD1      TYR  67 -11.356  -5.786  -5.540
  479    HD2  TYR  67           HD2      TYR  67 -13.469  -2.105  -5.838
  480    HE1  TYR  67           HE1      TYR  67 -11.866  -6.269  -7.896
  481    HE2  TYR  67           HE2      TYR  67 -13.985  -2.582  -8.187
  482    HH   TYR  67           HH       TYR  67 -13.325  -3.889  -9.985
  483    HB2  TYR  67           HB2      TYR  67 -12.063  -2.534  -3.967
  484    HB3  TYR  67           HB3      TYR  67 -11.076  -3.985  -3.864
  485    H    LYS  68           H        LYS  68 -14.674  -2.410  -2.378
  486    HA   LYS  68           HA       LYS  68 -16.816  -3.416  -4.140
  487    HB2  LYS  68           HB2      LYS  68 -18.449  -2.622  -2.608
  488    HB3  LYS  68           HB3      LYS  68 -17.257  -3.459  -1.622
  489    HG2  LYS  68           HG2      LYS  68 -16.255  -1.331  -1.000
  490    HG3  LYS  68           HG3      LYS  68 -17.402  -0.475  -2.025
  491    HD2  LYS  68           HD2      LYS  68 -18.393  -0.246   0.037
  492    HD3  LYS  68           HD3      LYS  68 -19.187  -1.704  -0.559
  493    HE2  LYS  68           HE2      LYS  68 -16.790  -1.650   1.271
  494    HE3  LYS  68           HE3      LYS  68 -18.454  -1.891   1.794
  495    HZ1  LYS  68           HZ1      LYS  68 -17.443  -4.003   1.634
  496    HZ2  LYS  68           HZ2      LYS  68 -16.814  -3.681   0.097
  497    HZ3  LYS  68           HZ3      LYS  68 -18.489  -3.878   0.303
  498    H    ILE  69           H        ILE  69 -18.041  -1.860  -5.256
  499    HA   ILE  69           HA       ILE  69 -16.868   0.841  -5.336
  500    HB   ILE  69           HB       ILE  69 -18.524  -0.521  -7.474
  501   HG12  ILE  69          HG12      ILE  69 -15.563   0.117  -7.434
  502   HG13  ILE  69          HG13      ILE  69 -16.254  -1.490  -7.242
  503   HG21  ILE  69          HG21      ILE  69 -17.948   1.403  -8.856
  504   HG22  ILE  69          HG22      ILE  69 -17.072   2.124  -7.506
  505   HG23  ILE  69          HG23      ILE  69 -18.820   1.904  -7.408
  506   HD11  ILE  69          HD11      ILE  69 -15.421  -1.150  -9.495
  507   HD12  ILE  69          HD12      ILE  69 -16.477   0.248  -9.689
  508   HD13  ILE  69          HD13      ILE  69 -17.172  -1.362  -9.500
  509    H    LYS  70           H        LYS  70 -18.024   2.012  -3.945
  510    HA   LYS  70           HA       LYS  70 -20.839   1.524  -3.550
  511    HB2  LYS  70           HB2      LYS  70 -19.315   2.167  -1.719
  512    HB3  LYS  70           HB3      LYS  70 -19.116   3.739  -2.468
  513    HG2  LYS  70           HG2      LYS  70 -20.686   3.858  -0.638
  514    HG3  LYS  70           HG3      LYS  70 -21.504   4.171  -2.170
  515    HD2  LYS  70           HD2      LYS  70 -22.454   1.985  -2.197
  516    HD3  LYS  70           HD3      LYS  70 -21.452   1.469  -0.838
  517    HE2  LYS  70           HE2      LYS  70 -23.508   3.666  -0.674
  518    HE3  LYS  70           HE3      LYS  70 -23.837   1.985  -0.260
  519    HZ1  LYS  70           HZ1      LYS  70 -22.147   2.093   1.448
  520    HZ2  LYS  70           HZ2      LYS  70 -23.300   3.310   1.696
  521    HZ3  LYS  70           HZ3      LYS  70 -21.782   3.700   1.045
  522    H    ASP  71           H        ASP  71 -22.082   2.083  -5.099
  523    HA   ASP  71           HA       ASP  71 -21.526   4.284  -6.871
  524    HB2  ASP  71           HB2      ASP  71 -22.519   2.196  -7.723
  525    HB3  ASP  71           HB3      ASP  71 -23.943   2.463  -6.723
  526    H    LEU  72           H        LEU  72 -21.858   6.267  -6.128
  527    HA   LEU  72           HA       LEU  72 -24.412   6.822  -4.776
  528    HG   LEU  72           HG       LEU  72 -21.639   6.177  -3.408
  529    HB2  LEU  72           HB2      LEU  72 -21.869   8.426  -4.496
  530    HB3  LEU  72           HB3      LEU  72 -23.358   8.639  -3.595
  531   HD11  LEU  72          HD11      LEU  72 -20.347   8.052  -2.617
  532   HD12  LEU  72          HD12      LEU  72 -20.895   7.101  -1.237
  533   HD13  LEU  72          HD13      LEU  72 -21.703   8.616  -1.641
  534   HD21  LEU  72          HD21      LEU  72 -23.974   5.858  -2.790
  535   HD22  LEU  72          HD22      LEU  72 -23.858   7.205  -1.656
  536   HD23  LEU  72          HD23      LEU  72 -22.912   5.741  -1.387
  537    H    GLU  73           H        GLU  73 -24.966   9.211  -5.036
  538    HA   GLU  73           HA       GLU  73 -25.090   9.658  -7.894
  539    HB2  GLU  73           HB2      GLU  73 -26.487  10.904  -5.542
  540    HB3  GLU  73           HB3      GLU  73 -26.571  11.636  -7.136
  541    HG2  GLU  73           HG2      GLU  73 -28.513  10.278  -6.748
  542    HG3  GLU  73           HG3      GLU  73 -27.534   9.568  -8.027
  543    H    GLY  74           H        GLY  74 -23.369  10.574  -8.764
  544    HA2  GLY  74           HA2      GLY  74 -22.303  12.622  -9.356
  545    HA3  GLY  74           HA3      GLY  74 -22.577  13.212  -7.723
  546    H    GLN  75           H        GLN  75 -21.573  10.273  -7.066
  547    HA   GLN  75           HA       GLN  75 -18.810  10.312  -7.701
  548    HB2  GLN  75           HB2      GLN  75 -17.986  10.650  -5.355
  549    HB3  GLN  75           HB3      GLN  75 -18.614  12.097  -6.126
  550    HG2  GLN  75           HG2      GLN  75 -20.765  11.712  -4.912
  551    HG3  GLN  75           HG3      GLN  75 -19.968  10.402  -4.040
  552   HE21  GLN  75          HE21      GLN  75 -20.233  11.447  -2.055
  553   HE22  GLN  75          HE22      GLN  75 -19.282  12.825  -1.614
  554    H    VAL  76           H        VAL  76 -17.630   8.580  -6.483
  555    HA   VAL  76           HA       VAL  76 -19.427   6.546  -5.357
  556    HB   VAL  76           HB       VAL  76 -18.238   4.761  -6.576
  557   HG11  VAL  76          HG11      VAL  76 -19.548   6.807  -8.357
  558   HG12  VAL  76          HG12      VAL  76 -20.360   5.535  -7.441
  559   HG13  VAL  76          HG13      VAL  76 -19.279   5.113  -8.770
  560   HG21  VAL  76          HG21      VAL  76 -16.865   5.334  -8.541
  561   HG22  VAL  76          HG22      VAL  76 -16.144   5.883  -7.028
  562   HG23  VAL  76          HG23      VAL  76 -16.959   7.037  -8.084
  563    H    GLU  77           H        GLU  77 -18.395   5.040  -3.985
  564    HA   GLU  77           HA       GLU  77 -15.773   5.935  -3.006
  565    HB2  GLU  77           HB2      GLU  77 -17.493   5.937  -1.291
  566    HB3  GLU  77           HB3      GLU  77 -17.914   4.273  -1.664
  567    HG2  GLU  77           HG2      GLU  77 -15.619   3.602  -0.957
  568    HG3  GLU  77           HG3      GLU  77 -15.351   5.264  -0.437
  569    H    LEU  78           H        LEU  78 -14.131   4.809  -3.806
  570    HA   LEU  78           HA       LEU  78 -14.484   1.994  -4.477
  571    HG   LEU  78           HG       LEU  78 -11.560   2.126  -6.708
  572    HB2  LEU  78           HB2      LEU  78 -13.220   3.583  -5.974
  573    HB3  LEU  78           HB3      LEU  78 -12.001   3.709  -4.723
  574   HD11  LEU  78          HD11      LEU  78 -10.394   0.511  -5.285
  575   HD12  LEU  78          HD12      LEU  78 -11.290   1.097  -3.884
  576   HD13  LEU  78          HD13      LEU  78 -10.159   2.164  -4.718
  577   HD21  LEU  78          HD21      LEU  78 -13.495   0.445  -5.119
  578   HD22  LEU  78          HD22      LEU  78 -12.429  -0.163  -6.384
  579   HD23  LEU  78          HD23      LEU  78 -13.690   1.004  -6.781
  580    H    ASP  79           H        ASP  79 -14.328   0.610  -2.889
  581    HA   ASP  79           HA       ASP  79 -12.622   1.277  -0.567
  582    HB2  ASP  79           HB2      ASP  79 -15.057   1.323  -0.092
  583    HB3  ASP  79           HB3      ASP  79 -15.173  -0.352  -0.616
  584    H    ALA  80           H        ALA  80 -10.839   0.058  -0.638
  585    HA   ALA  80           HA       ALA  80 -11.100  -2.699  -1.658
  586    HB1  ALA  80           HB1      ALA  80  -9.771  -1.232  -3.101
  587    HB2  ALA  80           HB2      ALA  80  -8.804  -2.538  -2.419
  588    HB3  ALA  80           HB3      ALA  80  -8.677  -0.910  -1.757
  589    H    ALA  81           H        ALA  81 -10.285  -4.353  -0.524
  590    HA   ALA  81           HA       ALA  81  -8.671  -3.805   1.864
  591    HB1  ALA  81           HB1      ALA  81  -9.831  -5.585   3.055
  592    HB2  ALA  81           HB2      ALA  81 -10.870  -5.865   1.658
  593    HB3  ALA  81           HB3      ALA  81 -10.976  -4.343   2.543
  594    H    PHE  82           H        PHE  82  -6.713  -4.587   1.377
  595    HA   PHE  82           HA       PHE  82  -6.522  -7.049  -0.230
  596    HD1  PHE  82           HD2      PHE  82  -5.960  -3.201  -0.564
  597    HD2  PHE  82           HD1      PHE  82  -4.650  -6.582  -2.787
  598    HE1  PHE  82           HE2      PHE  82  -6.575  -2.058  -2.653
  599    HE2  PHE  82           HE1      PHE  82  -5.256  -5.443  -4.883
  600    HZ   PHE  82           HZ       PHE  82  -6.222  -3.177  -4.817
  601    HB2  PHE  82           HB2      PHE  82  -4.463  -4.920   0.404
  602    HB3  PHE  82           HB3      PHE  82  -4.115  -6.388  -0.495
  603    H    THR  83           H        THR  83  -6.428  -8.812   1.003
  604    HA   THR  83           HA       THR  83  -4.823  -8.735   3.459
  605    HB   THR  83           HB       THR  83  -6.761 -10.859   2.491
  606    HG1  THR  83           HG1      THR  83  -6.979  -8.827   4.490
  607   HG21  THR  83          HG21      THR  83  -5.308 -10.553   5.127
  608   HG22  THR  83          HG22      THR  83  -5.023 -11.808   3.923
  609   HG23  THR  83          HG23      THR  83  -6.560 -11.752   4.786
  610    H    PHE  84           H        PHE  84  -2.781  -9.357   3.257
  611    HA   PHE  84           HA       PHE  84  -2.043 -11.162   1.062
  612    HD1  PHE  84           HD2      PHE  84  -0.256  -9.995  -0.838
  613    HD2  PHE  84           HD1      PHE  84  -1.380  -7.266   2.233
  614    HE1  PHE  84           HE2      PHE  84  -0.602  -8.239  -2.527
  615    HE2  PHE  84           HE1      PHE  84  -1.727  -5.509   0.545
  616    HZ   PHE  84           HZ       PHE  84  -1.338  -5.993  -1.835
  617    HB2  PHE  84           HB2      PHE  84  -0.361  -9.339   2.789
  618    HB3  PHE  84           HB3      PHE  84   0.282 -10.407   1.545
  619    H    SER  85           H        SER  85  -0.441 -12.825   1.476
  620    HA   SER  85           HA       SER  85  -1.057 -14.450   3.699
  621    HG   SER  85           HG       SER  85  -1.199 -15.655   1.408
  622    HB2  SER  85           HB2      SER  85   1.412 -14.673   1.971
  623    HB3  SER  85           HB3      SER  85   0.555 -15.967   2.812
  624    H    CYS  86           H        CYS  86   1.551 -12.205   3.004
  625    HA   CYS  86           HA       CYS  86   2.526 -12.536   5.765
  626    HG   CYS  86           HG       CYS  86   5.536 -13.804   3.018
  627    HB2  CYS  86           HB2      CYS  86   4.128 -11.532   3.401
  628    HB3  CYS  86           HB3      CYS  86   4.731 -11.902   5.013
  629    H    GLN  87           H        GLN  87   2.981 -10.629   6.921
  630    HA   GLN  87           HA       GLN  87   1.481  -8.328   6.196
  631    HB2  GLN  87           HB2      GLN  87   1.870  -8.876   8.530
  632    HB3  GLN  87           HB3      GLN  87   3.606  -8.702   8.309
  633    HG2  GLN  87           HG2      GLN  87   3.436  -6.369   8.019
  634    HG3  GLN  87           HG3      GLN  87   1.686  -6.437   7.850
  635   HE21  GLN  87          HE21      GLN  87   1.214  -5.086   9.526
  636   HE22  GLN  87          HE22      GLN  87   1.528  -5.471  11.186
  637    H    ALA  88           H        ALA  88   4.774  -9.341   5.781
  638    HA   ALA  88           HA       ALA  88   6.035  -6.959   5.132
  639    HB1  ALA  88           HB1      ALA  88   7.192  -9.106   5.372
  640    HB2  ALA  88           HB2      ALA  88   7.606  -8.309   3.853
  641    HB3  ALA  88           HB3      ALA  88   6.470  -9.659   3.860
  642    H    GLU  89           H        GLU  89   4.036  -9.059   3.116
  643    HA   GLU  89           HA       GLU  89   4.475  -7.746   0.660
  644    HB2  GLU  89           HB2      GLU  89   1.829  -9.007   1.257
  645    HB3  GLU  89           HB3      GLU  89   2.793  -9.087  -0.207
  646    HG2  GLU  89           HG2      GLU  89   3.393 -10.521   2.368
  647    HG3  GLU  89           HG3      GLU  89   2.645 -11.237   0.945
  648    H    MET  90           H        MET  90   2.334  -7.120   3.343
  649    HA   MET  90           HA       MET  90   0.573  -5.360   1.953
  650    HB2  MET  90           HB2      MET  90   0.176  -6.639   4.168
  651    HB3  MET  90           HB3      MET  90   1.041  -5.311   4.927
  652    HG2  MET  90           HG2      MET  90  -1.435  -4.982   3.248
  653    HG3  MET  90           HG3      MET  90  -1.431  -5.122   5.003
  654    HE1  MET  90           HE1      MET  90  -0.423  -3.260   6.641
  655    HE2  MET  90           HE2      MET  90   0.476  -1.857   6.060
  656    HE3  MET  90           HE3      MET  90   1.129  -3.479   5.834
  657    H    ILE  91           H        ILE  91   3.279  -4.840   4.210
  658    HA   ILE  91           HA       ILE  91   3.078  -2.027   4.124
  659    HB   ILE  91           HB       ILE  91   5.564  -2.209   4.956
  660   HG12  ILE  91          HG12      ILE  91   4.538  -4.971   5.613
  661   HG13  ILE  91          HG13      ILE  91   5.672  -4.656   4.308
  662   HG21  ILE  91          HG21      ILE  91   4.703  -2.555   7.230
  663   HG22  ILE  91          HG22      ILE  91   3.180  -3.135   6.553
  664   HG23  ILE  91          HG23      ILE  91   3.683  -1.466   6.290
  665   HD11  ILE  91          HD11      ILE  91   6.821  -5.426   6.290
  666   HD12  ILE  91          HD12      ILE  91   6.122  -4.107   7.230
  667   HD13  ILE  91          HD13      ILE  91   7.268  -3.756   5.935
  668    H    ILE  92           H        ILE  92   5.071  -4.285   2.216
  669    HA   ILE  92           HA       ILE  92   6.515  -2.227   0.898
  670    HB   ILE  92           HB       ILE  92   7.048  -3.908  -0.821
  671   HG12  ILE  92          HG12      ILE  92   5.252  -5.732   0.776
  672   HG13  ILE  92          HG13      ILE  92   4.924  -5.128  -0.845
  673   HG21  ILE  92          HG21      ILE  92   8.397  -3.744   1.186
  674   HG22  ILE  92          HG22      ILE  92   8.303  -5.416   0.633
  675   HG23  ILE  92          HG23      ILE  92   7.332  -4.888   2.007
  676   HD11  ILE  92          HD11      ILE  92   5.719  -7.403  -0.934
  677   HD12  ILE  92          HD12      ILE  92   7.175  -6.954  -0.043
  678   HD13  ILE  92          HD13      ILE  92   6.904  -6.320  -1.668
  679    H    PHE  93           H        PHE  93   3.390  -3.653   0.450
  680    HA   PHE  93           HA       PHE  93   2.846  -2.645  -2.144
  681    HD1  PHE  93           HD1      PHE  93   0.944  -3.820  -3.594
  682    HD2  PHE  93           HD2      PHE  93  -1.029  -2.428  -0.091
  683    HE1  PHE  93           HE1      PHE  93  -1.050  -3.281  -4.933
  684    HE2  PHE  93           HE2      PHE  93  -3.021  -1.884  -1.423
  685    HZ   PHE  93           HZ       PHE  93  -3.032  -2.313  -3.845
  686    HB2  PHE  93           HB2      PHE  93   1.597  -4.508  -1.195
  687    HB3  PHE  93           HB3      PHE  93   1.008  -3.488   0.109
  688    H    GLU  94           H        GLU  94   1.957  -1.480   1.122
  689    HA   GLU  94           HA       GLU  94   0.573   0.793   0.150
  690    HB2  GLU  94           HB2      GLU  94   0.715   1.593   2.542
  691    HB3  GLU  94           HB3      GLU  94  -0.052   0.032   2.297
  692    HG2  GLU  94           HG2      GLU  94   1.334  -0.882   3.750
  693    HG3  GLU  94           HG3      GLU  94   2.707  -0.422   2.746
  694    H    LEU  95           H        LEU  95   3.924   0.294   1.131
  695    HA   LEU  95           HA       LEU  95   4.752   2.978   1.084
  696    HG   LEU  95           HG       LEU  95   5.620   0.508   2.710
  697    HB2  LEU  95           HB2      LEU  95   6.266   0.470   0.342
  698    HB3  LEU  95           HB3      LEU  95   7.007   2.052   0.515
  699   HD11  LEU  95          HD11      LEU  95   7.744  -0.488   2.099
  700   HD12  LEU  95          HD12      LEU  95   7.872   0.318   3.662
  701   HD13  LEU  95          HD13      LEU  95   8.538   1.082   2.219
  702   HD21  LEU  95          HD21      LEU  95   5.360   2.923   2.977
  703   HD22  LEU  95          HD22      LEU  95   7.099   3.139   2.789
  704   HD23  LEU  95          HD23      LEU  95   6.466   2.268   4.184
  705    H    SER  96           H        SER  96   4.729   0.548  -1.482
  706    HA   SER  96           HA       SER  96   5.706   2.115  -3.558
  707    HG   SER  96           HG       SER  96   5.543  -0.993  -2.823
  708    HB2  SER  96           HB2      SER  96   3.725  -0.171  -3.694
  709    HB3  SER  96           HB3      SER  96   4.642   0.470  -5.058
  710    H    LEU  97           H        LEU  97   2.456   1.891  -2.243
  711    HA   LEU  97           HA       LEU  97   1.073   3.230  -4.295
  712    HG   LEU  97           HG       LEU  97   0.456   0.933  -2.182
  713    HB2  LEU  97           HB2      LEU  97   0.509   3.225  -1.327
  714    HB3  LEU  97           HB3      LEU  97  -0.618   3.731  -2.572
  715   HD11  LEU  97          HD11      LEU  97  -1.153   1.615  -0.478
  716   HD12  LEU  97          HD12      LEU  97  -1.834   0.395  -1.553
  717   HD13  LEU  97          HD13      LEU  97  -2.295   2.089  -1.737
  718   HD21  LEU  97          HD21      LEU  97   0.079   1.401  -4.537
  719   HD22  LEU  97          HD22      LEU  97  -1.531   2.019  -4.177
  720   HD23  LEU  97          HD23      LEU  97  -1.166   0.312  -3.923
  721    H    ARG  98           H        ARG  98   2.647   4.439  -1.361
  722    HA   ARG  98           HA       ARG  98   1.845   7.142  -1.743
  723    HE   ARG  98           HE       ARG  98   0.889   6.090   3.413
  724    HB2  ARG  98           HB2      ARG  98   4.054   5.999  -0.033
  725    HB3  ARG  98           HB3      ARG  98   3.450   7.649   0.057
  726    HG2  ARG  98           HG2      ARG  98   1.264   6.835   0.729
  727    HG3  ARG  98           HG3      ARG  98   1.833   5.167   0.603
  728    HD2  ARG  98           HD2      ARG  98   3.599   5.774   2.291
  729    HD3  ARG  98           HD3      ARG  98   2.744   7.299   2.521
  730   HH11  ARG  98          HH11      ARG  98   3.779   4.194   2.874
  731   HH12  ARG  98          HH12      ARG  98   3.279   2.874   3.895
  732   HH21  ARG  98          HH21      ARG  98   0.224   4.348   4.778
  733   HH22  ARG  98          HH22      ARG  98   1.255   2.949   4.950
  734    H    SER  99           H        SER  99   4.746   5.312  -2.569
  735    HA   SER  99           HA       SER  99   6.168   7.656  -3.437
  736    HG   SER  99           HG       SER  99   7.674   6.541  -1.897
  737    HB2  SER  99           HB2      SER  99   6.776   4.726  -3.898
  738    HB3  SER  99           HB3      SER  99   7.894   6.069  -4.153
  739    H    LEU 100           H        LEU 100   3.538   6.461  -4.720
  740    HA   LEU 100           HA       LEU 100   4.476   6.701  -7.501
  741    HG   LEU 100           HG       LEU 100   2.057   5.720  -8.967
  742    HB2  LEU 100           HB2      LEU 100   3.673   4.432  -6.763
  743    HB3  LEU 100           HB3      LEU 100   2.086   5.136  -6.557
  744   HD11  LEU 100          HD11      LEU 100   4.619   4.130  -9.046
  745   HD12  LEU 100          HD12      LEU 100   4.460   5.862  -9.333
  746   HD13  LEU 100          HD13      LEU 100   3.725   4.711 -10.448
  747   HD21  LEU 100          HD21      LEU 100   2.540   2.801  -8.358
  748   HD22  LEU 100          HD22      LEU 100   1.721   3.436  -9.787
  749   HD23  LEU 100          HD23      LEU 100   1.008   3.660  -8.189
  750    H    ALA 101           H        ALA 101   1.475   6.879  -5.595
  751    HA   ALA 101           HA       ALA 101   0.611   9.093  -7.337
  752    HB1  ALA 101           HB1      ALA 101  -1.680   8.467  -6.738
  753    HB2  ALA 101           HB2      ALA 101  -1.060   7.172  -5.712
  754    HB3  ALA 101           HB3      ALA 101  -0.811   7.112  -7.458
  755    H    LEU 102           H        LEU 102   2.366   9.457  -5.109
  756    HA   LEU 102           HA       LEU 102   1.169  10.258  -2.750
  757    HG   LEU 102           HG       LEU 102   3.360  12.362  -4.938
  758    HB2  LEU 102           HB2      LEU 102   3.078  11.779  -2.412
  759    HB3  LEU 102           HB3      LEU 102   3.560  10.167  -2.895
  760   HD11  LEU 102          HD11      LEU 102   4.751  13.250  -3.154
  761   HD12  LEU 102          HD12      LEU 102   5.733  12.836  -4.558
  762   HD13  LEU 102          HD13      LEU 102   5.717  11.775  -3.150
  763   HD21  LEU 102          HD21      LEU 102   3.636  10.062  -5.720
  764   HD22  LEU 102          HD22      LEU 102   5.076   9.889  -4.715
  765   HD23  LEU 102          HD23      LEU 102   5.070  11.032  -6.059
  766    H    GLU 103           H        GLU 103   1.782  12.282  -5.623
  767    HA   GLU 103           HA       GLU 103   1.079  14.339  -6.245
  768    HB2  GLU 103           HB2      GLU 103  -1.317  13.629  -4.544
  769    HB3  GLU 103           HB3      GLU 103  -1.233  15.023  -5.610
  770    HG2  GLU 103           HG2      GLU 103  -0.892  13.479  -7.516
  771    HG3  GLU 103           HG3      GLU 103  -1.124  12.125  -6.410
  772    H    HIS 104           H        HIS 104  -0.348  14.345  -3.014
  773    HA   HIS 104           HA       HIS 104   0.758  16.937  -2.433
  774    HD1  HIS 104           HD1      HIS 104  -0.505  15.489   1.636
  775    HD2  HIS 104           HD2      HIS 104  -0.526  18.955  -0.664
  776    HE1  HIS 104           HE1      HIS 104  -0.346  17.394   3.271
  777    HE2  HIS 104           HE2      HIS 104  -0.607  19.471   1.865
  778    HB2  HIS 104           HB2      HIS 104  -1.508  16.355  -1.707
  779    HB3  HIS 104           HB3      HIS 104  -0.878  15.012  -0.762
  780    H    HIS 105           H        HIS 105   2.633  17.329  -1.423
  781    HA   HIS 105           HA       HIS 105   4.151  15.074  -0.412
  782    HD1  HIS 105           HD1      HIS 105   6.345  18.945  -2.293
  783    HD2  HIS 105           HD2      HIS 105   3.587  18.968   0.823
  784    HE1  HIS 105           HE1      HIS 105   5.770  21.367  -1.906
  785    HE2  HIS 105           HE2      HIS 105   4.204  21.368   0.068
  786    HB2  HIS 105           HB2      HIS 105   5.998  16.705  -0.101
  787    HB3  HIS 105           HB3      HIS 105   5.401  16.629  -1.749
  788    H    HIS 106           H        HIS 106   5.127  15.023   1.672
  789    HA   HIS 106           HA       HIS 106   4.166  16.738   3.757
  790    HD1  HIS 106           HD1      HIS 106   1.935  17.064   5.338
  791    HD2  HIS 106           HD2      HIS 106   3.248  13.270   6.426
  792    HE1  HIS 106           HE1      HIS 106   1.524  16.886   7.815
  793    HE2  HIS 106           HE2      HIS 106   2.167  14.521   8.417
  794    HB2  HIS 106           HB2      HIS 106   2.202  15.227   3.351
  795    HB3  HIS 106           HB3      HIS 106   3.224  13.860   3.772
  796    H    HIS 107           H        HIS 107   5.773  16.867   5.170
  797    HA   HIS 107           HA       HIS 107   7.406  14.534   5.760
  798    HD1  HIS 107           HD1      HIS 107   7.797  16.976   2.322
  799    HD2  HIS 107           HD2      HIS 107   9.330  18.792   5.737
  800    HE1  HIS 107           HE1      HIS 107   7.897  19.432   1.799
  801    HE2  HIS 107           HE2      HIS 107   8.739  20.527   3.903
  802    HB2  HIS 107           HB2      HIS 107   9.518  15.959   5.439
  803    HB3  HIS 107           HB3      HIS 107   8.745  15.320   3.995
  804    H    HIS 108           H        HIS 108   6.779  14.534   7.840
  805    HA   HIS 108           HA       HIS 108   7.943  16.488   9.586
  806    HD1  HIS 108           HD1      HIS 108   6.589  19.485  10.086
  807    HD2  HIS 108           HD2      HIS 108   5.256  16.393  12.527
  808    HE1  HIS 108           HE1      HIS 108   6.561  20.426  12.420
  809    HE2  HIS 108           HE2      HIS 108   5.607  18.584  13.855
  810    HB2  HIS 108           HB2      HIS 108   5.745  17.522   8.792
  811    HB3  HIS 108           HB3      HIS 108   4.936  16.232   9.675
  812    H    HIS 109           H        HIS 109   8.645  15.365  11.278
  813    HA   HIS 109           HA       HIS 109   7.173  12.920  12.010
  814    HD1  HIS 109           HD1      HIS 109   9.580  10.096  11.688
  815    HD2  HIS 109           HD2      HIS 109   9.567  13.480   9.271
  816    HE1  HIS 109           HE1      HIS 109   9.872   9.254   9.334
  817    HE2  HIS 109           HE2      HIS 109  10.092  11.338   7.930
  818    HB2  HIS 109           HB2      HIS 109  10.120  13.560  12.245
  819    HB3  HIS 109           HB3      HIS 109   9.367  12.165  13.010
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1  43.653  -0.236  21.686
    2    H1   MET   1           H1       MET   1  45.421  -1.807  22.231
    3    H2   MET   1           H2       MET   1  44.582  -1.259  23.595
    4    H3   MET   1           H3       MET   1  46.127  -0.650  23.250
    5    HB2  MET   1           HB2      MET   1  45.411   1.649  23.268
    6    HB3  MET   1           HB3      MET   1  44.119   2.173  22.195
    7    HG2  MET   1           HG2      MET   1  42.496   0.969  23.573
    8    HG3  MET   1           HG3      MET   1  43.794   0.463  24.650
    9    HE1  MET   1           HE1      MET   1  43.447   4.018  22.911
   10    HE2  MET   1           HE2      MET   1  42.445   4.847  24.102
   11    HE3  MET   1           HE3      MET   1  41.793   3.481  23.195
   12    H    ALA   2           H        ALA   2  44.398  -0.934  19.757
   13    HA   ALA   2           HA       ALA   2  45.748   0.879  18.106
   14    HB1  ALA   2           HB1      ALA   2  47.405  -1.535  18.861
   15    HB2  ALA   2           HB2      ALA   2  47.763   0.134  19.304
   16    HB3  ALA   2           HB3      ALA   2  47.801  -0.356  17.610
   17    H    MET   3           H        MET   3  43.377  -0.257  17.777
   18    HA   MET   3           HA       MET   3  43.672  -2.789  16.366
   19    HB2  MET   3           HB2      MET   3  41.884  -2.647  18.007
   20    HB3  MET   3           HB3      MET   3  41.194  -1.264  17.167
   21    HG2  MET   3           HG2      MET   3  40.681  -2.635  15.249
   22    HG3  MET   3           HG3      MET   3  41.467  -4.023  15.997
   23    HE1  MET   3           HE1      MET   3  38.510  -4.054  14.799
   24    HE2  MET   3           HE2      MET   3  37.653  -4.966  16.041
   25    HE3  MET   3           HE3      MET   3  39.266  -5.469  15.534
   26    H    LYS   4           H        LYS   4  44.321  -2.595  14.356
   27    HA   LYS   4           HA       LYS   4  42.802  -0.794  12.576
   28    HB2  LYS   4           HB2      LYS   4  45.546  -2.012  12.163
   29    HB3  LYS   4           HB3      LYS   4  44.682  -1.072  10.960
   30    HG2  LYS   4           HG2      LYS   4  46.187   0.437  11.856
   31    HG3  LYS   4           HG3      LYS   4  44.688   0.805  12.708
   32    HD2  LYS   4           HD2      LYS   4  46.629   0.766  14.219
   33    HD3  LYS   4           HD3      LYS   4  45.443  -0.474  14.632
   34    HE2  LYS   4           HE2      LYS   4  47.706  -1.366  14.763
   35    HE3  LYS   4           HE3      LYS   4  46.798  -2.155  13.476
   36    HZ1  LYS   4           HZ1      LYS   4  49.022  -1.628  12.756
   37    HZ2  LYS   4           HZ2      LYS   4  48.798   0.013  13.124
   38    HZ3  LYS   4           HZ3      LYS   4  47.905  -0.705  11.873
   39    H    ASP   5           H        ASP   5  42.495  -3.646  13.717
   40    HA   ASP   5           HA       ASP   5  42.736  -5.560  11.721
   41    HB2  ASP   5           HB2      ASP   5  42.290  -6.184  14.020
   42    HB3  ASP   5           HB3      ASP   5  40.727  -5.372  13.974
   43    H    VAL   6           H        VAL   6  41.811  -5.733   9.819
   44    HA   VAL   6           HA       VAL   6  38.980  -5.240   9.528
   45    HB   VAL   6           HB       VAL   6  39.866  -3.039   8.986
   46   HG11  VAL   6          HG11      VAL   6  41.406  -2.699   7.105
   47   HG12  VAL   6          HG12      VAL   6  41.569  -4.446   6.929
   48   HG13  VAL   6          HG13      VAL   6  42.146  -3.650   8.394
   49   HG21  VAL   6          HG21      VAL   6  37.948  -3.810   7.703
   50   HG22  VAL   6          HG22      VAL   6  39.020  -4.550   6.514
   51   HG23  VAL   6          HG23      VAL   6  38.992  -2.797   6.705
   52    H    VAL   7           H        VAL   7  38.090  -6.676   8.206
   53    HA   VAL   7           HA       VAL   7  39.806  -8.042   6.251
   54    HB   VAL   7           HB       VAL   7  39.342  -9.637   8.006
   55   HG11  VAL   7          HG11      VAL   7  37.048 -10.291   8.606
   56   HG12  VAL   7          HG12      VAL   7  36.429  -8.985   7.594
   57   HG13  VAL   7          HG13      VAL   7  37.399  -8.614   9.018
   58   HG21  VAL   7          HG21      VAL   7  37.591 -10.176   5.612
   59   HG22  VAL   7          HG22      VAL   7  38.190 -11.388   6.743
   60   HG23  VAL   7          HG23      VAL   7  39.322 -10.493   5.728
   61    H    ASP   8           H        ASP   8  39.158  -7.703   4.227
   62    HA   ASP   8           HA       ASP   8  36.523  -6.528   3.793
   63    HB2  ASP   8           HB2      ASP   8  38.539  -5.515   2.745
   64    HB3  ASP   8           HB3      ASP   8  38.769  -6.992   1.816
   65    H    LYS   9           H        LYS   9  34.985  -8.004   3.765
   66    HA   LYS   9           HA       LYS   9  34.781  -9.774   1.555
   67    HB2  LYS   9           HB2      LYS   9  36.241 -11.115   3.082
   68    HB3  LYS   9           HB3      LYS   9  34.956 -11.074   4.281
   69    HG2  LYS   9           HG2      LYS   9  33.490 -12.312   2.818
   70    HG3  LYS   9           HG3      LYS   9  34.693 -12.263   1.529
   71    HD2  LYS   9           HD2      LYS   9  35.005 -13.627   4.203
   72    HD3  LYS   9           HD3      LYS   9  34.720 -14.425   2.655
   73    HE2  LYS   9           HE2      LYS   9  36.845 -13.541   1.816
   74    HE3  LYS   9           HE3      LYS   9  37.127 -12.752   3.365
   75    HZ1  LYS   9           HZ1      LYS   9  38.346 -14.771   3.332
   76    HZ2  LYS   9           HZ2      LYS   9  36.994 -15.666   2.834
   77    HZ3  LYS   9           HZ3      LYS   9  37.040 -15.000   4.393
   78    H    CYS  10           H        CYS  10  32.933  -8.555   1.246
   79    HA   CYS  10           HA       CYS  10  30.749  -9.066   3.164
   80    HG   CYS  10           HG       CYS  10  28.490  -7.693   3.177
   81    HB2  CYS  10           HB2      CYS  10  31.421  -6.675   2.992
   82    HB3  CYS  10           HB3      CYS  10  31.058  -6.719   1.271
   83    H    SER  11           H        SER  11  28.690  -9.541   2.288
   84    HA   SER  11           HA       SER  11  28.679 -10.255  -0.569
   85    HG   SER  11           HG       SER  11  26.492 -12.291  -0.437
   86    HB2  SER  11           HB2      SER  11  28.960 -12.252   0.976
   87    HB3  SER  11           HB3      SER  11  27.352 -11.899   1.601
   88    H    THR  12           H        THR  12  26.855  -9.710  -1.667
   89    HA   THR  12           HA       THR  12  24.380  -9.158  -0.305
   90    HB   THR  12           HB       THR  12  25.550  -7.020   0.045
   91    HG1  THR  12           HG1      THR  12  23.947  -5.720  -1.326
   92   HG21  THR  12          HG21      THR  12  27.062  -7.085  -1.875
   93   HG22  THR  12          HG22      THR  12  26.134  -5.585  -1.846
   94   HG23  THR  12          HG23      THR  12  25.692  -6.874  -2.965
   95    H    LYS  13           H        LYS  13  22.614  -9.105  -1.725
   96    HA   LYS  13           HA       LYS  13  22.874  -8.998  -4.546
   97    HB2  LYS  13           HB2      LYS  13  22.341 -11.300  -5.101
   98    HB3  LYS  13           HB3      LYS  13  23.840 -11.245  -4.184
   99    HG2  LYS  13           HG2      LYS  13  22.702 -11.987  -2.191
  100    HG3  LYS  13           HG3      LYS  13  21.144 -11.908  -3.019
  101    HD2  LYS  13           HD2      LYS  13  23.440 -13.728  -3.751
  102    HD3  LYS  13           HD3      LYS  13  21.975 -14.210  -2.893
  103    HE2  LYS  13           HE2      LYS  13  20.621 -13.608  -4.816
  104    HE3  LYS  13           HE3      LYS  13  22.056 -13.045  -5.673
  105    HZ1  LYS  13           HZ1      LYS  13  21.423 -15.832  -4.875
  106    HZ2  LYS  13           HZ2      LYS  13  22.928 -15.348  -5.491
  107    HZ3  LYS  13           HZ3      LYS  13  21.538 -15.210  -6.447
  108    H    GLY  14           H        GLY  14  20.744  -9.772  -5.594
  109    HA2  GLY  14           HA2      GLY  14  18.419 -10.253  -5.365
  110    HA3  GLY  14           HA3      GLY  14  18.489  -9.656  -3.714
  111    H    CYS  15           H        CYS  15  19.498  -8.245  -6.817
  112    HA   CYS  15           HA       CYS  15  18.205  -5.757  -6.047
  113    HG   CYS  15           HG       CYS  15  20.894  -5.013  -5.555
  114    HB2  CYS  15           HB2      CYS  15  19.839  -6.374  -8.516
  115    HB3  CYS  15           HB3      CYS  15  19.374  -4.777  -7.933
  116    H    ALA  16           H        ALA  16  16.045  -6.117  -6.254
  117    HA   ALA  16           HA       ALA  16  15.032  -6.333  -8.996
  118    HB1  ALA  16           HB1      ALA  16  14.912  -8.599  -8.088
  119    HB2  ALA  16           HB2      ALA  16  13.297  -7.924  -8.302
  120    HB3  ALA  16           HB3      ALA  16  14.014  -8.001  -6.692
  121    H    ILE  17           H        ILE  17  15.407  -4.286  -6.897
  122    HA   ILE  17           HA       ILE  17  14.379  -2.423  -6.147
  123    HB   ILE  17           HB       ILE  17  11.891  -3.471  -7.484
  124   HG12  ILE  17          HG12      ILE  17  13.626  -2.996  -9.107
  125   HG13  ILE  17          HG13      ILE  17  12.406  -1.733  -9.178
  126   HG21  ILE  17          HG21      ILE  17  12.480  -0.766  -6.294
  127   HG22  ILE  17          HG22      ILE  17  11.306  -1.943  -5.702
  128   HG23  ILE  17          HG23      ILE  17  11.060  -1.159  -7.262
  129   HD11  ILE  17          HD11      ILE  17  14.653  -0.821  -9.352
  130   HD12  ILE  17          HD12      ILE  17  15.063  -1.523  -7.787
  131   HD13  ILE  17          HD13      ILE  17  13.843  -0.254  -7.891
  132    H    ASP  18           H        ASP  18  14.280  -2.362  -4.120
  133    HA   ASP  18           HA       ASP  18  12.308  -3.950  -2.630
  134    HB2  ASP  18           HB2      ASP  18  14.384  -5.201  -2.450
  135    HB3  ASP  18           HB3      ASP  18  15.264  -3.743  -2.004
  136    H    ILE  19           H        ILE  19  11.214  -2.746  -1.234
  137    HA   ILE  19           HA       ILE  19  12.396  -0.198  -0.392
  138    HB   ILE  19           HB       ILE  19   9.973   0.606  -0.285
  139   HG12  ILE  19          HG12      ILE  19   9.631  -1.725  -2.180
  140   HG13  ILE  19          HG13      ILE  19   8.877  -1.558  -0.598
  141   HG21  ILE  19          HG21      ILE  19  10.010   1.292  -2.648
  142   HG22  ILE  19          HG22      ILE  19  11.297   0.122  -2.946
  143   HG23  ILE  19          HG23      ILE  19  11.577   1.484  -1.861
  144   HD11  ILE  19          HD11      ILE  19   7.645   0.394  -1.409
  145   HD12  ILE  19          HD12      ILE  19   7.307  -1.051  -2.361
  146   HD13  ILE  19          HD13      ILE  19   8.387   0.191  -2.996
  147    H    GLY  20           H        GLY  20  13.041  -0.704   1.609
  148    HA2  GLY  20           HA2      GLY  20  10.962  -1.686   3.462
  149    HA3  GLY  20           HA3      GLY  20  12.647  -2.164   3.590
  150    H    THR  21           H        THR  21  10.394   0.499   3.925
  151    HA   THR  21           HA       THR  21  11.940   1.546   6.120
  152    HB   THR  21           HB       THR  21  13.011   2.678   4.197
  153    HG1  THR  21           HG1      THR  21  13.189   4.237   5.607
  154   HG21  THR  21          HG21      THR  21  11.102   2.675   2.656
  155   HG22  THR  21          HG22      THR  21  11.762   4.298   2.860
  156   HG23  THR  21          HG23      THR  21  10.272   3.842   3.686
  157    H    VAL  22           H        VAL  22  10.744   3.063   7.387
  158    HA   VAL  22           HA       VAL  22   8.882   3.817   8.439
  159    HB   VAL  22           HB       VAL  22   7.583   3.842   5.708
  160   HG11  VAL  22          HG11      VAL  22   5.998   4.046   7.551
  161   HG12  VAL  22          HG12      VAL  22   6.135   5.566   6.667
  162   HG13  VAL  22          HG13      VAL  22   6.939   5.375   8.225
  163   HG21  VAL  22          HG21      VAL  22   8.268   6.184   5.581
  164   HG22  VAL  22          HG22      VAL  22   9.665   5.113   5.686
  165   HG23  VAL  22          HG23      VAL  22   9.138   6.016   7.106
  166    H    ILE  23           H        ILE  23   8.602   1.878   9.577
  167    HA   ILE  23           HA       ILE  23   6.928  -0.190   8.483
  168    HB   ILE  23           HB       ILE  23   7.994   0.142  11.294
  169   HG12  ILE  23          HG12      ILE  23   9.308  -1.959  10.464
  170   HG13  ILE  23          HG13      ILE  23   8.937  -1.340   8.864
  171   HG21  ILE  23          HG21      ILE  23   5.927  -1.156  11.286
  172   HG22  ILE  23          HG22      ILE  23   7.316  -2.179  11.654
  173   HG23  ILE  23          HG23      ILE  23   6.590  -2.222  10.046
  174   HD11  ILE  23          HD11      ILE  23  11.149  -0.648   9.615
  175   HD12  ILE  23          HD12      ILE  23  10.428   0.151  11.013
  176   HD13  ILE  23          HD13      ILE  23  10.081   0.738   9.387
  177    H    ASP  24           H        ASP  24   4.982   0.685   8.055
  178    HA   ASP  24           HA       ASP  24   3.527   2.063  10.182
  179    HB2  ASP  24           HB2      ASP  24   3.491   2.969   7.856
  180    HB3  ASP  24           HB3      ASP  24   2.657   1.508   7.332
  181    H    ASN  25           H        ASN  25   3.137   0.414  11.605
  182    HA   ASN  25           HA       ASN  25   1.991  -2.074  10.711
  183    HB2  ASN  25           HB2      ASN  25   1.926  -2.591  13.184
  184    HB3  ASN  25           HB3      ASN  25   3.523  -2.256  12.522
  185   HD21  ASN  25          HD21      ASN  25   0.962  -1.078  14.572
  186   HD22  ASN  25          HD22      ASN  25   1.887   0.181  15.321
  187    H    ASP  26           H        ASP  26  -0.002  -2.832  11.074
  188    HA   ASP  26           HA       ASP  26  -2.033  -1.504  12.555
  189    HB2  ASP  26           HB2      ASP  26  -2.085   0.019  10.658
  190    HB3  ASP  26           HB3      ASP  26  -2.141  -1.330   9.528
  191    H    ASN  27           H        ASN  27  -2.228  -3.233   9.489
  192    HA   ASN  27           HA       ASN  27  -2.816  -5.734  10.894
  193    HB2  ASN  27           HB2      ASN  27  -4.506  -4.500   8.705
  194    HB3  ASN  27           HB3      ASN  27  -4.592  -6.203   9.139
  195   HD21  ASN  27          HD21      ASN  27  -5.363  -2.959  10.066
  196   HD22  ASN  27          HD22      ASN  27  -6.394  -3.377  11.395
  197    H    CYS  28           H        CYS  28  -2.996  -7.512   9.026
  198    HA   CYS  28           HA       CYS  28  -0.717  -7.086   7.227
  199    HG   CYS  28           HG       CYS  28  -1.041  -9.676  10.238
  200    HB2  CYS  28           HB2      CYS  28  -2.182  -9.640   7.932
  201    HB3  CYS  28           HB3      CYS  28  -0.725  -9.523   6.950
  202    H    THR  29           H        THR  29  -3.701  -6.317   7.168
  203    HA   THR  29           HA       THR  29  -4.131  -6.978   4.344
  204    HB   THR  29           HB       THR  29  -6.286  -6.663   6.453
  205    HG1  THR  29           HG1      THR  29  -6.261  -8.786   6.643
  206   HG21  THR  29          HG21      THR  29  -7.799  -7.463   4.665
  207   HG22  THR  29          HG22      THR  29  -6.449  -7.416   3.531
  208   HG23  THR  29          HG23      THR  29  -7.037  -5.924   4.262
  209    H    SER  30           H        SER  30  -4.432  -5.210   3.085
  210    HA   SER  30           HA       SER  30  -4.424  -2.623   4.448
  211    HG   SER  30           HG       SER  30  -2.829  -0.961   2.339
  212    HB2  SER  30           HB2      SER  30  -2.628  -2.991   2.825
  213    HB3  SER  30           HB3      SER  30  -3.816  -3.325   1.563
  214    H    LYS  31           H        LYS  31  -6.345  -1.776   4.789
  215    HA   LYS  31           HA       LYS  31  -8.447  -2.044   2.763
  216    HB2  LYS  31           HB2      LYS  31  -8.463  -1.019   5.611
  217    HB3  LYS  31           HB3      LYS  31  -9.832  -0.827   4.526
  218    HG2  LYS  31           HG2      LYS  31  -8.630  -3.464   5.339
  219    HG3  LYS  31           HG3      LYS  31 -10.071  -2.734   6.051
  220    HD2  LYS  31           HD2      LYS  31  -9.735  -3.529   3.160
  221    HD3  LYS  31           HD3      LYS  31 -10.658  -4.419   4.373
  222    HE2  LYS  31           HE2      LYS  31 -12.150  -2.491   4.638
  223    HE3  LYS  31           HE3      LYS  31 -11.226  -1.610   3.422
  224    HZ1  LYS  31           HZ1      LYS  31 -12.771  -4.115   2.983
  225    HZ2  LYS  31           HZ2      LYS  31 -11.818  -3.347   1.815
  226    HZ3  LYS  31           HZ3      LYS  31 -13.185  -2.564   2.424
  227    H    PHE  32           H        PHE  32  -8.449  -0.550   1.243
  228    HA   PHE  32           HA       PHE  32  -7.628   2.183   1.963
  229    HD1  PHE  32           HD2      PHE  32  -5.892   3.595   1.498
  230    HD2  PHE  32           HD1      PHE  32  -6.766   2.215  -2.431
  231    HE1  PHE  32           HE2      PHE  32  -5.237   5.788   0.590
  232    HE2  PHE  32           HE1      PHE  32  -6.113   4.402  -3.345
  233    HZ   PHE  32           HZ       PHE  32  -5.356   6.190  -1.836
  234    HB2  PHE  32           HB2      PHE  32  -5.904   0.982   0.609
  235    HB3  PHE  32           HB3      PHE  32  -7.091   0.802  -0.677
  236    H    SER  33           H        SER  33  -9.258   3.540   1.780
  237    HA   SER  33           HA       SER  33 -11.313   2.992  -0.259
  238    HG   SER  33           HG       SER  33 -12.450   1.807   1.675
  239    HB2  SER  33           HB2      SER  33 -11.692   4.468   2.358
  240    HB3  SER  33           HB3      SER  33 -12.948   4.000   1.213
  241    H    ARG  34           H        ARG  34 -11.709   4.487  -1.721
  242    HA   ARG  34           HA       ARG  34 -10.772   7.234  -1.258
  243    HE   ARG  34           HE       ARG  34  -9.027   7.276  -0.133
  244    HB2  ARG  34           HB2      ARG  34 -10.193   5.473  -3.625
  245    HB3  ARG  34           HB3      ARG  34 -10.171   7.220  -3.757
  246    HG2  ARG  34           HG2      ARG  34  -8.481   5.661  -1.825
  247    HG3  ARG  34           HG3      ARG  34  -7.943   6.184  -3.419
  248    HD2  ARG  34           HD2      ARG  34  -7.133   7.782  -1.860
  249    HD3  ARG  34           HD3      ARG  34  -8.473   8.538  -2.720
  250   HH11  ARG  34          HH11      ARG  34  -8.597  10.197  -2.021
  251   HH12  ARG  34          HH12      ARG  34  -9.345  11.231  -0.840
  252   HH21  ARG  34          HH21      ARG  34 -10.021   8.629   1.430
  253   HH22  ARG  34          HH22      ARG  34 -10.173  10.336   1.117
  254    H    PHE  35           H        PHE  35 -11.955   8.841  -2.352
  255    HA   PHE  35           HA       PHE  35 -14.525   7.910  -3.430
  256    HD1  PHE  35           HD1      PHE  35 -16.513   8.129  -1.796
  257    HD2  PHE  35           HD2      PHE  35 -13.367  10.396  -0.038
  258    HE1  PHE  35           HE1      PHE  35 -17.191   7.337   0.432
  259    HE2  PHE  35           HE2      PHE  35 -14.038   9.606   2.193
  260    HZ   PHE  35           HZ       PHE  35 -15.951   8.073   2.428
  261    HB2  PHE  35           HB2      PHE  35 -13.793  10.616  -2.292
  262    HB3  PHE  35           HB3      PHE  35 -15.373  10.174  -2.924
  263    H    PHE  36           H        PHE  36 -15.051   8.360  -5.479
  264    HA   PHE  36           HA       PHE  36 -13.308  10.194  -6.980
  265    HD1  PHE  36           HD1      PHE  36 -11.163   9.490  -8.069
  266    HD2  PHE  36           HD2      PHE  36 -13.018   5.854  -6.860
  267    HE1  PHE  36           HE1      PHE  36  -8.971   8.599  -7.402
  268    HE2  PHE  36           HE2      PHE  36 -10.826   4.958  -6.192
  269    HZ   PHE  36           HZ       PHE  36  -8.800   6.329  -6.459
  270    HB2  PHE  36           HB2      PHE  36 -14.292   7.479  -7.882
  271    HB3  PHE  36           HB3      PHE  36 -13.494   8.646  -8.930
  272    H    ALA  37           H        ALA  37 -14.367  10.683  -9.201
  273    HA   ALA  37           HA       ALA  37 -16.854  11.929  -8.638
  274    HB1  ALA  37           HB1      ALA  37 -16.773  12.707 -10.936
  275    HB2  ALA  37           HB2      ALA  37 -15.479  11.565 -11.297
  276    HB3  ALA  37           HB3      ALA  37 -15.196  12.892 -10.170
  277    H    THR  38           H        THR  38 -15.993   9.317 -10.930
  278    HA   THR  38           HA       THR  38 -18.773   8.385 -10.688
  279    HB   THR  38           HB       THR  38 -18.707   7.668 -13.060
  280    HG1  THR  38           HG1      THR  38 -17.022   8.467 -14.387
  281   HG21  THR  38          HG21      THR  38 -18.957   9.899 -14.064
  282   HG22  THR  38          HG22      THR  38 -18.201  10.620 -12.643
  283   HG23  THR  38          HG23      THR  38 -19.756   9.801 -12.494
  284    H    ARG  39           H        ARG  39 -18.999   6.071 -11.402
  285    HA   ARG  39           HA       ARG  39 -17.267   4.402  -9.974
  286    HE   ARG  39           HE       ARG  39 -21.419   3.455 -11.046
  287    HB2  ARG  39           HB2      ARG  39 -18.507   2.569 -10.919
  288    HB3  ARG  39           HB3      ARG  39 -19.623   3.881 -10.588
  289    HG2  ARG  39           HG2      ARG  39 -19.506   4.534 -12.972
  290    HG3  ARG  39           HG3      ARG  39 -18.509   3.112 -13.275
  291    HD2  ARG  39           HD2      ARG  39 -20.845   2.699 -13.839
  292    HD3  ARG  39           HD3      ARG  39 -20.319   1.670 -12.508
  293   HH11  ARG  39          HH11      ARG  39 -22.536   2.615 -14.270
  294   HH12  ARG  39          HH12      ARG  39 -24.185   3.069 -13.954
  295   HH21  ARG  39          HH21      ARG  39 -23.534   4.049 -10.628
  296   HH22  ARG  39          HH22      ARG  39 -24.759   3.898 -11.854
  297    H    GLU  40           H        GLU  40 -17.173   5.599 -13.200
  298    HA   GLU  40           HA       GLU  40 -15.370   3.840 -14.427
  299    HB2  GLU  40           HB2      GLU  40 -15.578   6.827 -14.835
  300    HB3  GLU  40           HB3      GLU  40 -14.975   5.642 -15.981
  301    HG2  GLU  40           HG2      GLU  40 -17.128   4.759 -16.352
  302    HG3  GLU  40           HG3      GLU  40 -17.791   5.601 -14.954
  303    H    GLU  41           H        GLU  41 -14.835   6.903 -12.748
  304    HA   GLU  41           HA       GLU  41 -12.065   7.028 -12.807
  305    HB2  GLU  41           HB2      GLU  41 -14.008   7.982 -10.694
  306    HB3  GLU  41           HB3      GLU  41 -12.319   8.449 -10.753
  307    HG2  GLU  41           HG2      GLU  41 -14.213   8.952 -13.026
  308    HG3  GLU  41           HG3      GLU  41 -13.992  10.087 -11.696
  309    H    ALA  42           H        ALA  42 -14.194   5.140 -10.831
  310    HA   ALA  42           HA       ALA  42 -12.252   4.484  -8.814
  311    HB1  ALA  42           HB1      ALA  42 -13.951   3.025  -7.905
  312    HB2  ALA  42           HB2      ALA  42 -14.913   3.180  -9.375
  313    HB3  ALA  42           HB3      ALA  42 -14.666   4.580  -8.331
  314    H    GLU  43           H        GLU  43 -13.828   2.659 -11.452
  315    HA   GLU  43           HA       GLU  43 -12.444   0.251 -10.995
  316    HB2  GLU  43           HB2      GLU  43 -13.657   1.271 -13.571
  317    HB3  GLU  43           HB3      GLU  43 -13.193  -0.394 -13.249
  318    HG2  GLU  43           HG2      GLU  43 -14.822  -0.418 -11.371
  319    HG3  GLU  43           HG3      GLU  43 -15.355   1.181 -11.881
  320    H    SER  44           H        SER  44 -11.646   3.080 -12.903
  321    HA   SER  44           HA       SER  44  -9.497   2.007 -14.375
  322    HG   SER  44           HG       SER  44 -11.666   4.291 -14.591
  323    HB2  SER  44           HB2      SER  44  -9.861   4.856 -13.408
  324    HB3  SER  44           HB3      SER  44  -8.829   4.331 -14.738
  325    H    PHE  45           H        PHE  45  -9.753   3.062 -11.063
  326    HA   PHE  45           HA       PHE  45  -6.905   3.343 -10.696
  327    HD1  PHE  45           HD2      PHE  45  -6.028   5.215  -9.121
  328    HD2  PHE  45           HD1      PHE  45  -8.200   2.530  -6.636
  329    HE1  PHE  45           HE2      PHE  45  -4.331   5.477  -7.361
  330    HE2  PHE  45           HE1      PHE  45  -6.509   2.786  -4.869
  331    HZ   PHE  45           HZ       PHE  45  -4.569   4.262  -5.231
  332    HB2  PHE  45           HB2      PHE  45  -8.548   4.685  -9.406
  333    HB3  PHE  45           HB3      PHE  45  -9.124   3.210  -8.640
  334    H    MET  46           H        MET  46  -9.356   0.900 -10.150
  335    HA   MET  46           HA       MET  46  -7.789  -0.718  -8.413
  336    HB2  MET  46           HB2      MET  46 -10.231  -0.787  -8.392
  337    HB3  MET  46           HB3      MET  46 -10.240  -1.401 -10.040
  338    HG2  MET  46           HG2      MET  46 -10.640  -3.162  -8.392
  339    HG3  MET  46           HG3      MET  46  -9.172  -3.443  -9.326
  340    HE1  MET  46           HE1      MET  46 -10.617  -2.160  -5.905
  341    HE2  MET  46           HE2      MET  46  -9.554  -0.840  -6.393
  342    HE3  MET  46           HE3      MET  46  -9.140  -1.837  -4.997
  343    H    THR  47           H        THR  47  -8.120  -0.532 -11.880
  344    HA   THR  47           HA       THR  47  -7.359  -3.076 -12.669
  345    HB   THR  47           HB       THR  47  -6.566  -0.494 -14.032
  346    HG1  THR  47           HG1      THR  47  -8.585  -0.547 -14.959
  347   HG21  THR  47          HG21      THR  47  -5.474  -2.502 -14.944
  348   HG22  THR  47          HG22      THR  47  -6.640  -1.826 -16.081
  349   HG23  THR  47          HG23      THR  47  -7.054  -3.263 -15.147
  350    H    LYS  48           H        LYS  48  -5.216  -0.278 -12.096
  351    HA   LYS  48           HA       LYS  48  -2.862  -1.818 -12.559
  352    HB2  LYS  48           HB2      LYS  48  -1.672   0.202 -11.709
  353    HB3  LYS  48           HB3      LYS  48  -2.757   0.491 -13.060
  354    HG2  LYS  48           HG2      LYS  48  -4.465   1.100 -11.192
  355    HG3  LYS  48           HG3      LYS  48  -3.009   1.327 -10.218
  356    HD2  LYS  48           HD2      LYS  48  -3.659   2.670 -12.837
  357    HD3  LYS  48           HD3      LYS  48  -3.633   3.415 -11.243
  358    HE2  LYS  48           HE2      LYS  48  -1.295   3.244 -11.075
  359    HE3  LYS  48           HE3      LYS  48  -1.205   2.089 -12.404
  360    HZ1  LYS  48           HZ1      LYS  48  -1.870   4.977 -12.612
  361    HZ2  LYS  48           HZ2      LYS  48  -1.937   3.878 -13.903
  362    HZ3  LYS  48           HZ3      LYS  48  -0.454   4.218 -13.155
  363    H    LEU  49           H        LEU  49  -4.760  -1.034  -9.755
  364    HA   LEU  49           HA       LEU  49  -2.910  -1.749  -7.753
  365    HG   LEU  49           HG       LEU  49  -5.680  -0.064  -6.015
  366    HB2  LEU  49           HB2      LEU  49  -5.856  -1.471  -7.932
  367    HB3  LEU  49           HB3      LEU  49  -5.244  -2.452  -6.616
  368   HD11  LEU  49          HD11      LEU  49  -3.617   0.234  -4.758
  369   HD12  LEU  49          HD12      LEU  49  -2.814  -0.968  -5.767
  370   HD13  LEU  49          HD13      LEU  49  -4.143  -1.450  -4.714
  371   HD21  LEU  49          HD21      LEU  49  -3.309   0.462  -7.809
  372   HD22  LEU  49          HD22      LEU  49  -4.071   1.632  -6.734
  373   HD23  LEU  49          HD23      LEU  49  -4.970   0.983  -8.104
  374    H    LYS  50           H        LYS  50  -5.153  -3.649  -9.689
  375    HA   LYS  50           HA       LYS  50  -4.887  -6.142  -8.478
  376    HB2  LYS  50           HB2      LYS  50  -5.268  -5.348 -11.362
  377    HB3  LYS  50           HB3      LYS  50  -5.396  -7.003 -10.798
  378    HG2  LYS  50           HG2      LYS  50  -7.387  -6.640  -9.753
  379    HG3  LYS  50           HG3      LYS  50  -7.048  -4.928  -9.469
  380    HD2  LYS  50           HD2      LYS  50  -7.684  -4.308 -11.573
  381    HD3  LYS  50           HD3      LYS  50  -7.286  -5.874 -12.269
  382    HE2  LYS  50           HE2      LYS  50  -9.263  -6.838 -11.148
  383    HE3  LYS  50           HE3      LYS  50  -9.662  -5.237 -10.526
  384    HZ1  LYS  50           HZ1      LYS  50 -10.870  -5.932 -12.595
  385    HZ2  LYS  50           HZ2      LYS  50  -9.392  -5.809 -13.424
  386    HZ3  LYS  50           HZ3      LYS  50 -10.070  -4.440 -12.693
  387    H    GLU  51           H        GLU  51  -2.891  -4.566 -10.934
  388    HA   GLU  51           HA       GLU  51  -1.160  -6.766 -11.398
  389    HB2  GLU  51           HB2      GLU  51  -0.583  -3.827 -11.823
  390    HB3  GLU  51           HB3      GLU  51   0.210  -5.182 -12.613
  391    HG2  GLU  51           HG2      GLU  51  -1.863  -5.758 -13.744
  392    HG3  GLU  51           HG3      GLU  51  -2.688  -4.431 -12.931
  393    H    LEU  52           H        LEU  52  -0.932  -3.859  -9.400
  394    HA   LEU  52           HA       LEU  52   1.646  -4.298  -8.382
  395    HG   LEU  52           HG       LEU  52   0.050  -1.818  -9.288
  396    HB2  LEU  52           HB2      LEU  52  -0.701  -2.833  -7.172
  397    HB3  LEU  52           HB3      LEU  52   0.937  -2.753  -6.558
  398   HD11  LEU  52          HD11      LEU  52  -0.795  -0.398  -7.497
  399   HD12  LEU  52          HD12      LEU  52   0.468   0.423  -8.413
  400   HD13  LEU  52          HD13      LEU  52   0.832  -0.259  -6.828
  401   HD21  LEU  52          HD21      LEU  52   2.721  -1.582  -7.904
  402   HD22  LEU  52          HD22      LEU  52   2.296  -0.879  -9.465
  403   HD23  LEU  52          HD23      LEU  52   2.356  -2.632  -9.272
  404    H    ALA  53           H        ALA  53  -1.522  -5.384  -7.282
  405    HA   ALA  53           HA       ALA  53  -0.776  -6.393  -4.774
  406    HB1  ALA  53           HB1      ALA  53  -3.102  -6.041  -5.463
  407    HB2  ALA  53           HB2      ALA  53  -2.837  -7.681  -4.869
  408    HB3  ALA  53           HB3      ALA  53  -2.960  -7.380  -6.602
  409    H    ALA  54           H        ALA  54  -0.539  -7.780  -7.989
  410    HA   ALA  54           HA       ALA  54   0.001 -10.444  -7.136
  411    HB1  ALA  54           HB1      ALA  54   0.674 -10.842  -9.436
  412    HB2  ALA  54           HB2      ALA  54   0.714  -9.105  -9.744
  413    HB3  ALA  54           HB3      ALA  54  -0.818  -9.902  -9.388
  414    H    ALA  55           H        ALA  55   2.023  -7.710  -8.090
  415    HA   ALA  55           HA       ALA  55   4.491  -9.067  -7.991
  416    HB1  ALA  55           HB1      ALA  55   4.150  -6.952  -9.183
  417    HB2  ALA  55           HB2      ALA  55   5.502  -6.862  -8.054
  418    HB3  ALA  55           HB3      ALA  55   3.956  -6.120  -7.639
  419    H    ALA  56           H        ALA  56   2.623  -7.375  -5.541
  420    HA   ALA  56           HA       ALA  56   4.813  -7.426  -3.649
  421    HB1  ALA  56           HB1      ALA  56   1.958  -6.556  -3.243
  422    HB2  ALA  56           HB2      ALA  56   3.278  -5.511  -3.768
  423    HB3  ALA  56           HB3      ALA  56   3.320  -6.246  -2.164
  424    H    SER  57           H        SER  57   2.369  -9.597  -4.560
  425    HA   SER  57           HA       SER  57   1.813 -10.665  -1.974
  426    HG   SER  57           HG       SER  57   1.927 -11.494  -5.449
  427    HB2  SER  57           HB2      SER  57   0.572 -12.383  -3.112
  428    HB3  SER  57           HB3      SER  57   0.245 -10.850  -3.915
  429    H    SER  58           H        SER  58   2.674 -12.368  -0.955
  430    HA   SER  58           HA       SER  58   5.329 -13.107  -1.465
  431    HG   SER  58           HG       SER  58   4.371 -12.593   1.472
  432    HB2  SER  58           HB2      SER  58   3.559 -14.874   0.169
  433    HB3  SER  58           HB3      SER  58   5.186 -14.287   0.514
  434    H    ALA  59           H        ALA  59   2.323 -14.403  -2.581
  435    HA   ALA  59           HA       ALA  59   3.465 -17.003  -3.216
  436    HB1  ALA  59           HB1      ALA  59   1.201 -17.668  -3.761
  437    HB2  ALA  59           HB2      ALA  59   0.650 -16.003  -3.580
  438    HB3  ALA  59           HB3      ALA  59   1.253 -16.890  -2.180
  439    H    ASP  60           H        ASP  60   3.366 -14.075  -4.736
  440    HA   ASP  60           HA       ASP  60   3.941 -13.415  -6.830
  441    HB2  ASP  60           HB2      ASP  60   4.598 -16.286  -6.925
  442    HB3  ASP  60           HB3      ASP  60   4.338 -15.523  -8.489
  443    H    GLU  61           H        GLU  61   1.414 -15.780  -6.520
  444    HA   GLU  61           HA       GLU  61   0.223 -15.455  -9.061
  445    HB2  GLU  61           HB2      GLU  61  -1.040 -16.186  -6.410
  446    HB3  GLU  61           HB3      GLU  61  -1.811 -16.367  -7.979
  447    HG2  GLU  61           HG2      GLU  61   0.741 -17.749  -7.194
  448    HG3  GLU  61           HG3      GLU  61  -0.863 -18.462  -7.031
  449    H    GLY  62           H        GLY  62  -0.614 -14.058  -5.922
  450    HA2  GLY  62           HA2      GLY  62  -1.020 -11.453  -6.583
  451    HA3  GLY  62           HA3      GLY  62  -2.526 -12.242  -7.044
  452    H    ALA  63           H        ALA  63  -2.316 -10.278  -5.020
  453    HA   ALA  63           HA       ALA  63  -2.438 -11.697  -2.495
  454    HB1  ALA  63           HB1      ALA  63  -2.954  -8.788  -3.104
  455    HB2  ALA  63           HB2      ALA  63  -1.407  -9.473  -2.609
  456    HB3  ALA  63           HB3      ALA  63  -2.780  -9.507  -1.503
  457    H    SER  64           H        SER  64  -4.300 -11.735  -1.158
  458    HA   SER  64           HA       SER  64  -6.737 -12.236  -2.483
  459    HG   SER  64           HG       SER  64  -5.867 -13.784   0.688
  460    HB2  SER  64           HB2      SER  64  -6.291 -11.643   0.452
  461    HB3  SER  64           HB3      SER  64  -7.678 -12.475  -0.255
  462    H    VAL  65           H        VAL  65  -7.533 -10.556  -3.629
  463    HA   VAL  65           HA       VAL  65  -7.798  -7.971  -2.283
  464    HB   VAL  65           HB       VAL  65  -6.615  -7.777  -4.359
  465   HG11  VAL  65          HG11      VAL  65  -7.621  -8.397  -6.522
  466   HG12  VAL  65          HG12      VAL  65  -8.963  -9.146  -5.659
  467   HG13  VAL  65          HG13      VAL  65  -7.333  -9.794  -5.484
  468   HG21  VAL  65          HG21      VAL  65  -8.142  -5.957  -3.825
  469   HG22  VAL  65          HG22      VAL  65  -9.441  -6.775  -4.695
  470   HG23  VAL  65          HG23      VAL  65  -8.028  -6.188  -5.570
  471    H    ALA  66           H        ALA  66  -9.652  -7.598  -1.371
  472    HA   ALA  66           HA       ALA  66 -12.120  -8.479  -2.725
  473    HB1  ALA  66           HB1      ALA  66 -13.233  -8.242  -0.552
  474    HB2  ALA  66           HB2      ALA  66 -11.711  -7.729   0.175
  475    HB3  ALA  66           HB3      ALA  66 -11.879  -9.368  -0.451
  476    H    TYR  67           H        TYR  67 -12.642  -6.830  -4.056
  477    HA   TYR  67           HA       TYR  67 -12.453  -4.112  -2.941
  478    HD1  TYR  67           HD1      TYR  67 -14.001  -4.126  -6.843
  479    HD2  TYR  67           HD2      TYR  67 -10.545  -6.433  -5.929
  480    HE1  TYR  67           HE1      TYR  67 -14.412  -5.513  -8.829
  481    HE2  TYR  67           HE2      TYR  67 -10.948  -7.833  -7.912
  482    HH   TYR  67           HH       TYR  67 -13.291  -6.981 -10.322
  483    HB2  TYR  67           HB2      TYR  67 -12.259  -3.305  -5.275
  484    HB3  TYR  67           HB3      TYR  67 -10.934  -4.359  -4.801
  485    H    LYS  68           H        LYS  68 -14.145  -2.728  -3.106
  486    HA   LYS  68           HA       LYS  68 -16.538  -3.648  -4.527
  487    HB2  LYS  68           HB2      LYS  68 -16.410  -2.665  -1.685
  488    HB3  LYS  68           HB3      LYS  68 -17.895  -2.623  -2.626
  489    HG2  LYS  68           HG2      LYS  68 -17.709  -5.062  -2.953
  490    HG3  LYS  68           HG3      LYS  68 -16.296  -5.057  -1.906
  491    HD2  LYS  68           HD2      LYS  68 -18.257  -5.719  -0.643
  492    HD3  LYS  68           HD3      LYS  68 -17.687  -4.145  -0.081
  493    HE2  LYS  68           HE2      LYS  68 -19.394  -3.029  -1.391
  494    HE3  LYS  68           HE3      LYS  68 -19.927  -4.573  -2.056
  495    HZ1  LYS  68           HZ1      LYS  68 -20.048  -3.797   0.813
  496    HZ2  LYS  68           HZ2      LYS  68 -20.578  -5.269   0.163
  497    HZ3  LYS  68           HZ3      LYS  68 -21.360  -3.828  -0.260
  498    H    ILE  69           H        ILE  69 -17.952  -2.016  -5.147
  499    HA   ILE  69           HA       ILE  69 -16.863   0.718  -5.070
  500    HB   ILE  69           HB       ILE  69 -17.998  -0.615  -7.538
  501   HG12  ILE  69          HG12      ILE  69 -15.186   0.337  -6.936
  502   HG13  ILE  69          HG13      ILE  69 -15.701  -1.345  -7.000
  503   HG21  ILE  69          HG21      ILE  69 -16.917   2.178  -7.150
  504   HG22  ILE  69          HG22      ILE  69 -18.612   1.746  -7.382
  505   HG23  ILE  69          HG23      ILE  69 -17.448   1.480  -8.680
  506   HD11  ILE  69          HD11      ILE  69 -14.547  -0.693  -9.029
  507   HD12  ILE  69          HD12      ILE  69 -15.722   0.595  -9.297
  508   HD13  ILE  69          HD13      ILE  69 -16.232  -1.092  -9.363
  509    H    LYS  70           H        LYS  70 -18.312   1.940  -4.080
  510    HA   LYS  70           HA       LYS  70 -21.150   1.224  -4.335
  511    HB2  LYS  70           HB2      LYS  70 -20.351   1.301  -2.042
  512    HB3  LYS  70           HB3      LYS  70 -19.751   2.933  -2.283
  513    HG2  LYS  70           HG2      LYS  70 -21.802   3.027  -1.058
  514    HG3  LYS  70           HG3      LYS  70 -22.071   3.689  -2.671
  515    HD2  LYS  70           HD2      LYS  70 -22.910   1.386  -3.322
  516    HD3  LYS  70           HD3      LYS  70 -22.896   1.000  -1.599
  517    HE2  LYS  70           HE2      LYS  70 -24.402   2.900  -1.186
  518    HE3  LYS  70           HE3      LYS  70 -24.450   3.223  -2.919
  519    HZ1  LYS  70           HZ1      LYS  70 -26.330   1.968  -2.613
  520    HZ2  LYS  70           HZ2      LYS  70 -25.641   1.000  -1.403
  521    HZ3  LYS  70           HZ3      LYS  70 -25.216   0.755  -3.028
  522    H    ASP  71           H        ASP  71 -22.303   2.370  -5.657
  523    HA   ASP  71           HA       ASP  71 -21.375   4.877  -6.717
  524    HB2  ASP  71           HB2      ASP  71 -23.827   3.189  -7.190
  525    HB3  ASP  71           HB3      ASP  71 -23.658   4.791  -7.890
  526    H    LEU  72           H        LEU  72 -21.720   6.761  -5.748
  527    HA   LEU  72           HA       LEU  72 -23.998   7.000  -3.900
  528    HG   LEU  72           HG       LEU  72 -21.167   6.218  -2.986
  529    HB2  LEU  72           HB2      LEU  72 -21.377   8.505  -3.938
  530    HB3  LEU  72           HB3      LEU  72 -22.692   8.817  -2.821
  531   HD11  LEU  72          HD11      LEU  72 -20.156   6.920  -0.860
  532   HD12  LEU  72          HD12      LEU  72 -20.939   8.492  -1.024
  533   HD13  LEU  72          HD13      LEU  72 -19.719   7.988  -2.195
  534   HD21  LEU  72          HD21      LEU  72 -23.456   5.962  -2.171
  535   HD22  LEU  72          HD22      LEU  72 -23.174   7.222  -0.970
  536   HD23  LEU  72          HD23      LEU  72 -22.286   5.701  -0.877
  537    H    GLU  73           H        GLU  73 -24.317   9.625  -3.628
  538    HA   GLU  73           HA       GLU  73 -25.233  10.398  -6.283
  539    HB2  GLU  73           HB2      GLU  73 -26.657  10.497  -4.147
  540    HB3  GLU  73           HB3      GLU  73 -25.708  11.918  -3.727
  541    HG2  GLU  73           HG2      GLU  73 -27.821  12.526  -4.770
  542    HG3  GLU  73           HG3      GLU  73 -26.446  13.037  -5.752
  543    H    GLY  74           H        GLY  74 -23.562  11.214  -7.440
  544    HA2  GLY  74           HA2      GLY  74 -22.529  13.261  -8.115
  545    HA3  GLY  74           HA3      GLY  74 -22.408  13.729  -6.425
  546    H    GLN  75           H        GLN  75 -21.527  10.775  -6.043
  547    HA   GLN  75           HA       GLN  75 -18.852  10.801  -7.134
  548    HB2  GLN  75           HB2      GLN  75 -17.739  10.768  -4.943
  549    HB3  GLN  75           HB3      GLN  75 -18.594  12.283  -5.197
  550    HG2  GLN  75           HG2      GLN  75 -20.441  11.464  -3.816
  551    HG3  GLN  75           HG3      GLN  75 -19.561   9.960  -3.544
  552   HE21  GLN  75          HE21      GLN  75 -17.725   9.989  -2.215
  553   HE22  GLN  75          HE22      GLN  75 -17.408  11.294  -1.130
  554    H    VAL  76           H        VAL  76 -17.606   8.860  -6.056
  555    HA   VAL  76           HA       VAL  76 -19.462   6.720  -5.260
  556    HB   VAL  76           HB       VAL  76 -18.266   5.087  -6.643
  557   HG11  VAL  76          HG11      VAL  76 -19.141   5.760  -8.838
  558   HG12  VAL  76          HG12      VAL  76 -19.393   7.394  -8.219
  559   HG13  VAL  76          HG13      VAL  76 -20.297   6.042  -7.537
  560   HG21  VAL  76          HG21      VAL  76 -16.842   7.469  -7.819
  561   HG22  VAL  76          HG22      VAL  76 -16.725   5.806  -8.394
  562   HG23  VAL  76          HG23      VAL  76 -16.120   6.229  -6.793
  563    H    GLU  77           H        GLU  77 -18.387   4.926  -4.175
  564    HA   GLU  77           HA       GLU  77 -15.883   5.785  -2.886
  565    HB2  GLU  77           HB2      GLU  77 -17.774   5.608  -1.322
  566    HB3  GLU  77           HB3      GLU  77 -18.025   3.937  -1.811
  567    HG2  GLU  77           HG2      GLU  77 -15.809   3.356  -0.955
  568    HG3  GLU  77           HG3      GLU  77 -15.571   5.028  -0.454
  569    H    LEU  78           H        LEU  78 -14.187   4.756  -3.648
  570    HA   LEU  78           HA       LEU  78 -14.424   2.006  -4.620
  571    HG   LEU  78           HG       LEU  78 -11.362   2.497  -6.682
  572    HB2  LEU  78           HB2      LEU  78 -13.187   3.752  -5.936
  573    HB3  LEU  78           HB3      LEU  78 -12.030   3.864  -4.628
  574   HD11  LEU  78          HD11      LEU  78 -10.101   2.386  -4.611
  575   HD12  LEU  78          HD12      LEU  78 -10.216   0.788  -5.348
  576   HD13  LEU  78          HD13      LEU  78 -11.230   1.195  -3.965
  577   HD21  LEU  78          HD21      LEU  78 -13.414   1.280  -7.029
  578   HD22  LEU  78          HD22      LEU  78 -13.295   0.554  -5.426
  579   HD23  LEU  78          HD23      LEU  78 -12.112   0.147  -6.670
  580    H    ASP  79           H        ASP  79 -14.126   0.419  -3.235
  581    HA   ASP  79           HA       ASP  79 -12.537   0.953  -0.809
  582    HB2  ASP  79           HB2      ASP  79 -14.996   0.671  -0.435
  583    HB3  ASP  79           HB3      ASP  79 -14.864  -0.960  -1.081
  584    H    ALA  80           H        ALA  80 -10.707  -0.147  -0.739
  585    HA   ALA  80           HA       ALA  80 -10.552  -2.702  -2.197
  586    HB1  ALA  80           HB1      ALA  80  -9.166  -0.984  -3.200
  587    HB2  ALA  80           HB2      ALA  80  -8.159  -2.239  -2.479
  588    HB3  ALA  80           HB3      ALA  80  -8.373  -0.694  -1.654
  589    H    ALA  81           H        ALA  81  -9.542  -4.426  -1.260
  590    HA   ALA  81           HA       ALA  81  -8.430  -4.173   1.423
  591    HB1  ALA  81           HB1      ALA  81 -10.764  -4.783   1.789
  592    HB2  ALA  81           HB2      ALA  81  -9.700  -6.125   2.210
  593    HB3  ALA  81           HB3      ALA  81 -10.591  -6.151   0.689
  594    H    PHE  82           H        PHE  82  -6.409  -4.825   1.019
  595    HA   PHE  82           HA       PHE  82  -6.037  -7.219  -0.659
  596    HD1  PHE  82           HD1      PHE  82  -4.529  -6.671  -3.213
  597    HD2  PHE  82           HD2      PHE  82  -5.433  -3.221  -0.891
  598    HE1  PHE  82           HE1      PHE  82  -5.249  -5.493  -5.247
  599    HE2  PHE  82           HE2      PHE  82  -6.156  -2.039  -2.923
  600    HZ   PHE  82           HZ       PHE  82  -6.063  -3.175  -5.105
  601    HB2  PHE  82           HB2      PHE  82  -4.083  -5.007   0.006
  602    HB3  PHE  82           HB3      PHE  82  -3.700  -6.431  -0.953
  603    H    THR  83           H        THR  83  -5.802  -8.993   0.514
  604    HA   THR  83           HA       THR  83  -4.541  -8.856   3.148
  605    HB   THR  83           HB       THR  83  -5.779 -11.267   1.808
  606    HG1  THR  83           HG1      THR  83  -6.984  -9.065   2.645
  607   HG21  THR  83          HG21      THR  83  -5.195 -10.644   4.709
  608   HG22  THR  83          HG22      THR  83  -4.305 -11.780   3.695
  609   HG23  THR  83          HG23      THR  83  -5.990 -12.099   4.109
  610    H    PHE  84           H        PHE  84  -2.379  -8.925   3.099
  611    HA   PHE  84           HA       PHE  84  -1.051 -10.636   1.127
  612    HD1  PHE  84           HD2      PHE  84   0.843  -9.236  -0.560
  613    HD2  PHE  84           HD1      PHE  84  -1.311  -6.691   2.082
  614    HE1  PHE  84           HE2      PHE  84   0.426  -7.670  -2.413
  615    HE2  PHE  84           HE1      PHE  84  -1.731  -5.123   0.238
  616    HZ   PHE  84           HZ       PHE  84  -0.860  -5.616  -2.013
  617    HB2  PHE  84           HB2      PHE  84   0.030  -8.469   2.928
  618    HB3  PHE  84           HB3      PHE  84   1.030  -9.451   1.864
  619    H    SER  85           H        SER  85  -1.972 -10.543   4.298
  620    HA   SER  85           HA       SER  85  -1.906 -12.074   5.973
  621    HG   SER  85           HG       SER  85  -2.102 -13.410   3.258
  622    HB2  SER  85           HB2      SER  85  -0.046 -13.686   4.210
  623    HB3  SER  85           HB3      SER  85  -0.855 -14.255   5.668
  624    H    CYS  86           H        CYS  86   1.142 -11.132   4.514
  625    HA   CYS  86           HA       CYS  86   2.388 -11.088   7.170
  626    HG   CYS  86           HG       CYS  86   4.507 -13.461   6.207
  627    HB2  CYS  86           HB2      CYS  86   3.660 -10.754   4.443
  628    HB3  CYS  86           HB3      CYS  86   4.511 -10.876   5.979
  629    H    GLN  87           H        GLN  87   3.389  -9.151   7.901
  630    HA   GLN  87           HA       GLN  87   1.924  -6.816   7.108
  631    HB2  GLN  87           HB2      GLN  87   2.412  -7.178   9.455
  632    HB3  GLN  87           HB3      GLN  87   4.140  -7.150   9.129
  633    HG2  GLN  87           HG2      GLN  87   4.188  -4.881   8.826
  634    HG3  GLN  87           HG3      GLN  87   2.486  -4.788   8.379
  635   HE21  GLN  87          HE21      GLN  87   0.922  -4.860  10.017
  636   HE22  GLN  87          HE22      GLN  87   1.313  -4.518  11.672
  637    H    ALA  88           H        ALA  88   5.152  -8.058   6.571
  638    HA   ALA  88           HA       ALA  88   6.325  -5.656   5.631
  639    HB1  ALA  88           HB1      ALA  88   7.682  -7.603   6.223
  640    HB2  ALA  88           HB2      ALA  88   8.006  -7.085   4.569
  641    HB3  ALA  88           HB3      ALA  88   6.997  -8.501   4.869
  642    H    GLU  89           H        GLU  89   4.867  -8.389   3.879
  643    HA   GLU  89           HA       GLU  89   4.785  -7.349   1.346
  644    HB2  GLU  89           HB2      GLU  89   3.136  -9.271   2.910
  645    HB3  GLU  89           HB3      GLU  89   2.525  -8.766   1.344
  646    HG2  GLU  89           HG2      GLU  89   3.715 -10.753   1.017
  647    HG3  GLU  89           HG3      GLU  89   4.729  -9.473   0.375
  648    H    MET  90           H        MET  90   2.789  -6.524   4.093
  649    HA   MET  90           HA       MET  90   0.806  -5.135   2.567
  650    HB2  MET  90           HB2      MET  90   0.420  -6.137   4.834
  651    HB3  MET  90           HB3      MET  90   1.421  -4.864   5.515
  652    HG2  MET  90           HG2      MET  90  -0.980  -4.203   3.861
  653    HG3  MET  90           HG3      MET  90  -1.143  -4.626   5.563
  654    HE1  MET  90           HE1      MET  90   1.481  -3.383   6.847
  655    HE2  MET  90           HE2      MET  90  -0.129  -3.215   7.546
  656    HE3  MET  90           HE3      MET  90   0.890  -1.791   7.323
  657    H    ILE  91           H        ILE  91   3.582  -4.098   4.571
  658    HA   ILE  91           HA       ILE  91   3.093  -1.338   4.108
  659    HB   ILE  91           HB       ILE  91   5.457  -1.041   5.002
  660   HG12  ILE  91          HG12      ILE  91   5.129  -3.956   5.712
  661   HG13  ILE  91          HG13      ILE  91   6.197  -3.371   4.447
  662   HG21  ILE  91          HG21      ILE  91   3.350  -2.426   6.640
  663   HG22  ILE  91          HG22      ILE  91   3.514  -0.692   6.368
  664   HG23  ILE  91          HG23      ILE  91   4.731  -1.557   7.310
  665   HD11  ILE  91          HD11      ILE  91   7.392  -3.845   6.519
  666   HD12  ILE  91          HD12      ILE  91   6.392  -2.661   7.364
  667   HD13  ILE  91          HD13      ILE  91   7.494  -2.138   6.090
  668    H    ILE  92           H        ILE  92   5.169  -3.715   2.476
  669    HA   ILE  92           HA       ILE  92   6.565  -1.810   0.910
  670    HB   ILE  92           HB       ILE  92   7.123  -3.636  -0.608
  671   HG12  ILE  92          HG12      ILE  92   5.287  -5.347   1.074
  672   HG13  ILE  92          HG13      ILE  92   4.937  -4.799  -0.561
  673   HG21  ILE  92          HG21      ILE  92   8.423  -3.354   1.415
  674   HG22  ILE  92          HG22      ILE  92   8.303  -5.063   0.994
  675   HG23  ILE  92          HG23      ILE  92   7.312  -4.403   2.295
  676   HD11  ILE  92          HD11      ILE  92   7.217  -6.595   0.237
  677   HD12  ILE  92          HD12      ILE  92   6.838  -6.066  -1.402
  678   HD13  ILE  92          HD13      ILE  92   5.711  -7.105  -0.530
  679    H    PHE  93           H        PHE  93   3.452  -3.351   0.607
  680    HA   PHE  93           HA       PHE  93   2.869  -2.469  -2.025
  681    HD1  PHE  93           HD2      PHE  93   1.495  -3.834  -3.395
  682    HD2  PHE  93           HD1      PHE  93  -1.225  -2.443  -0.429
  683    HE1  PHE  93           HE2      PHE  93  -0.278  -3.680  -5.094
  684    HE2  PHE  93           HE1      PHE  93  -2.998  -2.291  -2.125
  685    HZ   PHE  93           HZ       PHE  93  -2.526  -2.912  -4.457
  686    HB2  PHE  93           HB2      PHE  93   1.670  -4.290  -0.743
  687    HB3  PHE  93           HB3      PHE  93   0.898  -3.021   0.201
  688    H    GLU  94           H        GLU  94   2.169  -1.202   1.202
  689    HA   GLU  94           HA       GLU  94   0.812   1.125   0.547
  690    HB2  GLU  94           HB2      GLU  94   2.754   0.584   2.796
  691    HB3  GLU  94           HB3      GLU  94   1.760   2.029   2.694
  692    HG2  GLU  94           HG2      GLU  94   0.640  -0.755   2.751
  693    HG3  GLU  94           HG3      GLU  94   0.898   0.229   4.192
  694    H    LEU  95           H        LEU  95   4.317   0.712   1.050
  695    HA   LEU  95           HA       LEU  95   5.087   3.328   0.527
  696    HG   LEU  95           HG       LEU  95   6.062   1.004   2.323
  697    HB2  LEU  95           HB2      LEU  95   6.584   0.778  -0.074
  698    HB3  LEU  95           HB3      LEU  95   7.302   2.377  -0.063
  699   HD11  LEU  95          HD11      LEU  95   8.123  -0.070   1.656
  700   HD12  LEU  95          HD12      LEU  95   8.370   0.852   3.139
  701   HD13  LEU  95          HD13      LEU  95   8.946   1.488   1.597
  702   HD21  LEU  95          HD21      LEU  95   7.033   2.845   3.605
  703   HD22  LEU  95          HD22      LEU  95   5.845   3.424   2.437
  704   HD23  LEU  95          HD23      LEU  95   7.568   3.607   2.107
  705    H    SER  96           H        SER  96   4.641   0.645  -1.743
  706    HA   SER  96           HA       SER  96   5.436   2.025  -4.052
  707    HG   SER  96           HG       SER  96   5.300  -0.993  -2.998
  708    HB2  SER  96           HB2      SER  96   3.419  -0.220  -3.812
  709    HB3  SER  96           HB3      SER  96   4.245   0.274  -5.290
  710    H    LEU  97           H        LEU  97   2.220   1.598  -2.603
  711    HA   LEU  97           HA       LEU  97   0.766   2.948  -4.599
  712    HG   LEU  97           HG       LEU  97   0.331   0.506  -2.433
  713    HB2  LEU  97           HB2      LEU  97   0.121   2.775  -1.656
  714    HB3  LEU  97           HB3      LEU  97  -1.007   3.161  -2.938
  715   HD11  LEU  97          HD11      LEU  97  -1.996  -0.248  -2.134
  716   HD12  LEU  97          HD12      LEU  97  -2.539   1.421  -2.310
  717   HD13  LEU  97          HD13      LEU  97  -1.513   0.964  -0.949
  718   HD21  LEU  97          HD21      LEU  97  -0.913  -0.331  -4.349
  719   HD22  LEU  97          HD22      LEU  97   0.192   0.953  -4.843
  720   HD23  LEU  97          HD23      LEU  97  -1.532   1.289  -4.677
  721    H    ARG  98           H        ARG  98   2.192   4.096  -1.577
  722    HA   ARG  98           HA       ARG  98   0.941   6.639  -1.681
  723    HE   ARG  98           HE       ARG  98   0.637   3.777   2.522
  724    HB2  ARG  98           HB2      ARG  98   3.349   5.742  -0.097
  725    HB3  ARG  98           HB3      ARG  98   2.443   7.224   0.180
  726    HG2  ARG  98           HG2      ARG  98   0.460   5.944   0.742
  727    HG3  ARG  98           HG3      ARG  98   1.310   4.438   0.395
  728    HD2  ARG  98           HD2      ARG  98   2.966   5.127   2.182
  729    HD3  ARG  98           HD3      ARG  98   1.823   6.396   2.624
  730   HH11  ARG  98          HH11      ARG  98   2.346   6.074   4.565
  731   HH12  ARG  98          HH12      ARG  98   1.827   5.316   6.043
  732   HH21  ARG  98          HH21      ARG  98  -0.010   2.788   4.440
  733   HH22  ARG  98          HH22      ARG  98   0.522   3.425   5.981
  734    H    SER  99           H        SER  99   4.083   5.458  -2.728
  735    HA   SER  99           HA       SER  99   5.125   8.061  -3.306
  736    HG   SER  99           HG       SER  99   6.340   5.066  -2.253
  737    HB2  SER  99           HB2      SER  99   6.098   5.391  -4.345
  738    HB3  SER  99           HB3      SER  99   7.019   6.891  -4.241
  739    H    LEU 100           H        LEU 100   3.333   5.648  -5.080
  740    HA   LEU 100           HA       LEU 100   3.853   6.831  -7.659
  741    HG   LEU 100           HG       LEU 100   1.656   5.717  -9.280
  742    HB2  LEU 100           HB2      LEU 100   3.392   4.384  -7.203
  743    HB3  LEU 100           HB3      LEU 100   1.716   4.826  -6.953
  744   HD11  LEU 100          HD11      LEU 100   4.365   4.412  -9.479
  745   HD12  LEU 100          HD12      LEU 100   4.043   6.145  -9.544
  746   HD13  LEU 100          HD13      LEU 100   3.437   5.087 -10.818
  747   HD21  LEU 100          HD21      LEU 100   0.822   3.485  -8.755
  748   HD22  LEU 100          HD22      LEU 100   2.437   2.818  -8.993
  749   HD23  LEU 100          HD23      LEU 100   1.562   3.522 -10.354
  750    H    ALA 101           H        ALA 101   1.403   7.017  -5.193
  751    HA   ALA 101           HA       ALA 101  -0.480   8.411  -6.881
  752    HB1  ALA 101           HB1      ALA 101  -1.283   6.899  -5.149
  753    HB2  ALA 101           HB2      ALA 101  -1.862   8.542  -4.873
  754    HB3  ALA 101           HB3      ALA 101  -0.528   7.904  -3.912
  755    H    LEU 102           H        LEU 102   2.329   9.345  -5.446
  756    HA   LEU 102           HA       LEU 102   1.710  11.754  -4.159
  757    HG   LEU 102           HG       LEU 102   3.863   9.732  -3.557
  758    HB2  LEU 102           HB2      LEU 102   4.162  10.912  -5.691
  759    HB3  LEU 102           HB3      LEU 102   4.049  12.449  -4.858
  760   HD11  LEU 102          HD11      LEU 102   6.023  10.300  -2.578
  761   HD12  LEU 102          HD12      LEU 102   6.050  11.805  -3.499
  762   HD13  LEU 102          HD13      LEU 102   6.111  10.256  -4.339
  763   HD21  LEU 102          HD21      LEU 102   3.872  12.499  -2.361
  764   HD22  LEU 102          HD22      LEU 102   3.951  10.989  -1.453
  765   HD23  LEU 102          HD23      LEU 102   2.509  11.380  -2.391
  766    H    GLU 103           H        GLU 103   2.768  11.271  -7.534
  767    HA   GLU 103           HA       GLU 103   1.932  13.987  -8.151
  768    HB2  GLU 103           HB2      GLU 103   3.718  12.013  -9.364
  769    HB3  GLU 103           HB3      GLU 103   2.744  12.897 -10.533
  770    HG2  GLU 103           HG2      GLU 103   4.571  14.078  -8.457
  771    HG3  GLU 103           HG3      GLU 103   4.841  14.018 -10.201
  772    H    HIS 104           H        HIS 104   1.258  10.745  -9.514
  773    HA   HIS 104           HA       HIS 104  -1.079  11.999 -10.765
  774    HD1  HIS 104           HD1      HIS 104  -0.378   7.653 -12.023
  775    HD2  HIS 104           HD2      HIS 104   2.825  10.262 -11.517
  776    HE1  HIS 104           HE1      HIS 104   1.669   6.197 -11.841
  777    HE2  HIS 104           HE2      HIS 104   3.585   7.794 -11.449
  778    HB2  HIS 104           HB2      HIS 104  -0.996  10.078 -12.404
  779    HB3  HIS 104           HB3      HIS 104   0.312  11.243 -12.502
  780    H    HIS 105           H        HIS 105  -2.187  11.689  -8.711
  781    HA   HIS 105           HA       HIS 105  -3.543   9.075  -8.826
  782    HD1  HIS 105           HD1      HIS 105  -1.787  11.767  -5.533
  783    HD2  HIS 105           HD2      HIS 105  -5.846  11.938  -6.433
  784    HE1  HIS 105           HE1      HIS 105  -2.611  13.938  -4.563
  785    HE2  HIS 105           HE2      HIS 105  -5.098  13.939  -4.973
  786    HB2  HIS 105           HB2      HIS 105  -4.353   9.416  -6.576
  787    HB3  HIS 105           HB3      HIS 105  -2.614   9.654  -6.571
  788    H    HIS 106           H        HIS 106  -3.622  11.907 -10.149
  789    HA   HIS 106           HA       HIS 106  -6.432  12.578  -9.765
  790    HD1  HIS 106           HD1      HIS 106  -5.736  15.009 -13.211
  791    HD2  HIS 106           HD2      HIS 106  -7.281  15.562  -9.390
  792    HE1  HIS 106           HE1      HIS 106  -7.667  16.607 -13.475
  793    HE2  HIS 106           HE2      HIS 106  -8.718  16.721 -11.186
  794    HB2  HIS 106           HB2      HIS 106  -4.707  14.376  -9.726
  795    HB3  HIS 106           HB3      HIS 106  -4.301  13.985 -11.393
  796    H    HIS 107           H        HIS 107  -7.884  11.656 -11.047
  797    HA   HIS 107           HA       HIS 107  -7.030  10.430 -13.544
  798    HD1  HIS 107           HD1      HIS 107  -8.567   9.642  -9.922
  799    HD2  HIS 107           HD2      HIS 107  -7.975   7.141 -13.191
  800    HE1  HIS 107           HE1      HIS 107  -7.706   7.478  -8.972
  801    HE2  HIS 107           HE2      HIS 107  -7.206   6.044 -10.982
  802    HB2  HIS 107           HB2      HIS 107  -9.714  10.423 -12.155
  803    HB3  HIS 107           HB3      HIS 107  -9.323   9.512 -13.608
  804    H    HIS 108           H        HIS 108 -10.235  11.813 -13.191
  805    HA   HIS 108           HA       HIS 108  -9.492  13.861 -15.177
  806    HD1  HIS 108           HD1      HIS 108 -13.650  14.684 -15.482
  807    HD2  HIS 108           HD2      HIS 108 -10.426  14.002 -18.023
  808    HE1  HIS 108           HE1      HIS 108 -13.979  16.236 -17.432
  809    HE2  HIS 108           HE2      HIS 108 -11.936  15.921 -18.880
  810    HB2  HIS 108           HB2      HIS 108 -11.121  12.081 -15.951
  811    HB3  HIS 108           HB3      HIS 108 -12.263  12.717 -14.771
  812    H    HIS 109           H        HIS 109 -11.526  13.129 -12.366
  813    HA   HIS 109           HA       HIS 109 -11.996  15.972 -11.923
  814    HD1  HIS 109           HD1      HIS 109 -14.634  16.827 -11.118
  815    HD2  HIS 109           HD2      HIS 109 -13.018  14.923  -7.790
  816    HE1  HIS 109           HE1      HIS 109 -15.350  18.202  -9.135
  817    HE2  HIS 109           HE2      HIS 109 -14.290  17.088  -7.138
  818    HB2  HIS 109           HB2      HIS 109 -13.823  14.333 -11.509
  819    HB3  HIS 109           HB3      HIS 109 -12.857  13.622 -10.219
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1  16.724   1.201  32.884
    2    H1   MET   1           H1       MET   1  16.762   3.542  32.289
    3    H2   MET   1           H2       MET   1  15.554   3.281  31.133
    4    H3   MET   1           H3       MET   1  17.073   2.550  30.950
    5    HB2  MET   1           HB2      MET   1  14.058   2.631  33.018
    6    HB3  MET   1           HB3      MET   1  14.461   1.202  33.957
    7    HG2  MET   1           HG2      MET   1  14.692   3.149  35.331
    8    HG3  MET   1           HG3      MET   1  16.285   2.460  35.035
    9    HE1  MET   1           HE1      MET   1  17.338   4.733  35.947
   10    HE2  MET   1           HE2      MET   1  15.738   5.441  36.169
   11    HE3  MET   1           HE3      MET   1  16.975   6.321  35.271
   12    H    ALA   2           H        ALA   2  13.903   2.014  30.848
   13    HA   ALA   2           HA       ALA   2  13.648  -0.835  30.188
   14    HB1  ALA   2           HB1      ALA   2  11.708   1.432  29.734
   15    HB2  ALA   2           HB2      ALA   2  11.655   0.282  31.071
   16    HB3  ALA   2           HB3      ALA   2  11.405  -0.276  29.416
   17    H    MET   3           H        MET   3  14.005  -1.601  28.207
   18    HA   MET   3           HA       MET   3  14.749  -1.756  26.082
   19    HB2  MET   3           HB2      MET   3  13.303   0.874  25.779
   20    HB3  MET   3           HB3      MET   3  14.017  -0.008  24.437
   21    HG2  MET   3           HG2      MET   3  12.561  -1.930  24.992
   22    HG3  MET   3           HG3      MET   3  11.784  -0.937  26.225
   23    HE1  MET   3           HE1      MET   3  13.051   0.003  22.587
   24    HE2  MET   3           HE2      MET   3  11.554  -0.192  21.675
   25    HE3  MET   3           HE3      MET   3  12.317  -1.594  22.428
   26    H    LYS   4           H        LYS   4  16.894  -1.748  26.329
   27    HA   LYS   4           HA       LYS   4  18.261   0.847  26.422
   28    HB2  LYS   4           HB2      LYS   4  19.272  -1.901  27.172
   29    HB3  LYS   4           HB3      LYS   4  20.199  -0.410  27.288
   30    HG2  LYS   4           HG2      LYS   4  18.496   0.455  28.881
   31    HG3  LYS   4           HG3      LYS   4  17.722  -1.131  28.838
   32    HD2  LYS   4           HD2      LYS   4  19.730  -2.170  29.711
   33    HD3  LYS   4           HD3      LYS   4  20.577  -0.622  29.674
   34    HE2  LYS   4           HE2      LYS   4  18.835   0.262  31.243
   35    HE3  LYS   4           HE3      LYS   4  18.221  -1.385  31.387
   36    HZ1  LYS   4           HZ1      LYS   4  20.281  -2.096  32.323
   37    HZ2  LYS   4           HZ2      LYS   4  19.781  -0.721  33.173
   38    HZ3  LYS   4           HZ3      LYS   4  21.012  -0.597  32.015
   39    H    ASP   5           H        ASP   5  18.647  -2.397  24.982
   40    HA   ASP   5           HA       ASP   5  19.796  -1.127  22.615
   41    HB2  ASP   5           HB2      ASP   5  21.257  -2.796  24.546
   42    HB3  ASP   5           HB3      ASP   5  21.442  -3.296  22.869
   43    H    VAL   6           H        VAL   6  19.030  -1.971  20.821
   44    HA   VAL   6           HA       VAL   6  18.132  -4.765  20.812
   45    HB   VAL   6           HB       VAL   6  16.277  -4.134  19.273
   46   HG11  VAL   6          HG11      VAL   6  16.179  -2.833  21.991
   47   HG12  VAL   6          HG12      VAL   6  15.820  -4.521  21.628
   48   HG13  VAL   6          HG13      VAL   6  14.781  -3.243  20.998
   49   HG21  VAL   6          HG21      VAL   6  15.549  -1.790  19.183
   50   HG22  VAL   6          HG22      VAL   6  17.144  -2.011  18.463
   51   HG23  VAL   6          HG23      VAL   6  16.992  -1.315  20.076
   52    H    VAL   7           H        VAL   7  18.305  -5.825  18.784
   53    HA   VAL   7           HA       VAL   7  19.898  -4.378  16.780
   54    HB   VAL   7           HB       VAL   7  21.452  -5.795  17.911
   55   HG11  VAL   7          HG11      VAL   7  21.169  -8.234  18.073
   56   HG12  VAL   7          HG12      VAL   7  19.529  -8.066  17.446
   57   HG13  VAL   7          HG13      VAL   7  19.958  -7.342  18.996
   58   HG21  VAL   7          HG21      VAL   7  20.636  -7.027  15.283
   59   HG22  VAL   7          HG22      VAL   7  22.177  -7.302  16.095
   60   HG23  VAL   7          HG23      VAL   7  21.758  -5.688  15.524
   61    H    ASP   8           H        ASP   8  18.505  -4.076  15.176
   62    HA   ASP   8           HA       ASP   8  16.570  -6.146  14.512
   63    HB2  ASP   8           HB2      ASP   8  15.718  -3.878  14.553
   64    HB3  ASP   8           HB3      ASP   8  16.955  -3.349  13.420
   65    H    LYS   9           H        LYS   9  17.009  -7.660  13.204
   66    HA   LYS   9           HA       LYS   9  19.310  -7.448  11.438
   67    HB2  LYS   9           HB2      LYS   9  17.568  -9.819  12.128
   68    HB3  LYS   9           HB3      LYS   9  19.077  -9.866  11.239
   69    HG2  LYS   9           HG2      LYS   9  20.316  -9.176  13.166
   70    HG3  LYS   9           HG3      LYS   9  18.829  -8.909  14.075
   71    HD2  LYS   9           HD2      LYS   9  19.657 -11.589  12.971
   72    HD3  LYS   9           HD3      LYS   9  20.044 -11.044  14.601
   73    HE2  LYS   9           HE2      LYS   9  18.125 -12.309  14.915
   74    HE3  LYS   9           HE3      LYS   9  17.506 -10.661  14.843
   75    HZ1  LYS   9           HZ1      LYS   9  17.561 -12.510  12.520
   76    HZ2  LYS   9           HZ2      LYS   9  16.777 -11.008  12.615
   77    HZ3  LYS   9           HZ3      LYS   9  16.217 -12.314  13.536
   78    H    CYS  10           H        CYS  10  18.883  -6.595   9.513
   79    HA   CYS  10           HA       CYS  10  16.281  -7.104   8.272
   80    HG   CYS  10           HG       CYS  10  17.583  -4.924   5.242
   81    HB2  CYS  10           HB2      CYS  10  16.823  -4.760   8.501
   82    HB3  CYS  10           HB3      CYS  10  18.384  -4.999   7.726
   83    H    SER  11           H        SER  11  16.260  -8.795   6.947
   84    HA   SER  11           HA       SER  11  18.545  -9.390   5.266
   85    HG   SER  11           HG       SER  11  15.177  -9.762   5.723
   86    HB2  SER  11           HB2      SER  11  16.927 -11.131   4.294
   87    HB3  SER  11           HB3      SER  11  17.380 -11.339   5.984
   88    H    THR  12           H        THR  12  18.835  -7.692   3.907
   89    HA   THR  12           HA       THR  12  16.704  -6.160   2.857
   90    HB   THR  12           HB       THR  12  19.560  -6.186   1.878
   91    HG1  THR  12           HG1      THR  12  19.795  -4.474   3.471
   92   HG21  THR  12          HG21      THR  12  17.997  -4.939   0.460
   93   HG22  THR  12          HG22      THR  12  19.087  -3.842   1.308
   94   HG23  THR  12          HG23      THR  12  17.427  -4.041   1.868
   95    H    LYS  13           H        LYS  13  15.367  -7.610   1.790
   96    HA   LYS  13           HA       LYS  13  16.330  -8.453  -0.864
   97    HB2  LYS  13           HB2      LYS  13  14.002  -9.462   0.783
   98    HB3  LYS  13           HB3      LYS  13  14.342  -9.965  -0.863
   99    HG2  LYS  13           HG2      LYS  13  16.415 -10.980  -0.177
  100    HG3  LYS  13           HG3      LYS  13  16.205 -10.368   1.466
  101    HD2  LYS  13           HD2      LYS  13  15.568 -12.747   1.256
  102    HD3  LYS  13           HD3      LYS  13  14.216 -11.726   1.756
  103    HE2  LYS  13           HE2      LYS  13  13.517 -11.637  -0.648
  104    HE3  LYS  13           HE3      LYS  13  14.755 -12.848  -0.989
  105    HZ1  LYS  13           HZ1      LYS  13  13.646 -14.410   0.398
  106    HZ2  LYS  13           HZ2      LYS  13  12.485 -13.750  -0.651
  107    HZ3  LYS  13           HZ3      LYS  13  12.554 -13.241   0.967
  108    H    GLY  14           H        GLY  14  14.619  -6.104   0.717
  109    HA2  GLY  14           HA2      GLY  14  12.450  -5.853  -1.197
  110    HA3  GLY  14           HA3      GLY  14  12.713  -4.846   0.219
  111    H    CYS  15           H        CYS  15  14.292  -5.589  -2.887
  112    HA   CYS  15           HA       CYS  15  15.089  -2.771  -3.075
  113    HG   CYS  15           HG       CYS  15  18.530  -4.106  -3.095
  114    HB2  CYS  15           HB2      CYS  15  15.999  -5.129  -4.745
  115    HB3  CYS  15           HB3      CYS  15  16.683  -3.507  -4.761
  116    H    ALA  16           H        ALA  16  12.392  -4.032  -3.619
  117    HA   ALA  16           HA       ALA  16  12.049  -3.813  -6.473
  118    HB1  ALA  16           HB1      ALA  16   9.723  -4.365  -6.048
  119    HB2  ALA  16           HB2      ALA  16   9.973  -4.165  -4.312
  120    HB3  ALA  16           HB3      ALA  16  10.788  -5.469  -5.178
  121    H    ILE  17           H        ILE  17  11.302  -1.855  -3.636
  122    HA   ILE  17           HA       ILE  17  10.502   0.309  -5.443
  123    HB   ILE  17           HB       ILE  17   8.942   1.059  -3.529
  124   HG12  ILE  17          HG12      ILE  17   7.872  -1.046  -2.454
  125   HG13  ILE  17          HG13      ILE  17   9.399  -1.835  -2.825
  126   HG21  ILE  17          HG21      ILE  17   8.249  -1.293  -5.274
  127   HG22  ILE  17          HG22      ILE  17   8.177   0.411  -5.724
  128   HG23  ILE  17          HG23      ILE  17   7.089  -0.221  -4.489
  129   HD11  ILE  17          HD11      ILE  17   9.350  -1.059  -0.534
  130   HD12  ILE  17          HD12      ILE  17   9.038   0.589  -1.080
  131   HD13  ILE  17          HD13      ILE  17  10.576  -0.189  -1.457
  132    H    ASP  18           H        ASP  18  10.962   2.416  -4.771
  133    HA   ASP  18           HA       ASP  18  12.972   2.592  -2.634
  134    HB2  ASP  18           HB2      ASP  18  13.818   3.347  -4.782
  135    HB3  ASP  18           HB3      ASP  18  12.442   4.429  -4.982
  136    H    ILE  19           H        ILE  19  11.559   2.747  -0.912
  137    HA   ILE  19           HA       ILE  19  10.134   5.309  -0.714
  138    HB   ILE  19           HB       ILE  19   9.042   2.717   0.400
  139   HG12  ILE  19          HG12      ILE  19   8.164   4.249  -2.057
  140   HG13  ILE  19          HG13      ILE  19   8.964   2.686  -2.058
  141   HG21  ILE  19          HG21      ILE  19   7.005   4.058   0.760
  142   HG22  ILE  19          HG22      ILE  19   7.860   5.486   0.176
  143   HG23  ILE  19          HG23      ILE  19   8.389   4.686   1.656
  144   HD11  ILE  19          HD11      ILE  19   6.589   2.460  -2.441
  145   HD12  ILE  19          HD12      ILE  19   6.253   3.266  -0.909
  146   HD13  ILE  19          HD13      ILE  19   7.061   1.696  -0.924
  147    H    GLY  20           H        GLY  20  11.016   2.448   1.207
  148    HA2  GLY  20           HA2      GLY  20  12.868   3.141   2.906
  149    HA3  GLY  20           HA3      GLY  20  11.582   4.186   3.497
  150    H    THR  21           H        THR  21   9.398   2.634   3.262
  151    HA   THR  21           HA       THR  21   8.176   0.919   4.082
  152    HB   THR  21           HB       THR  21  10.778  -0.561   4.406
  153    HG1  THR  21           HG1      THR  21  10.752  -0.511   2.284
  154   HG21  THR  21          HG21      THR  21   9.367  -2.573   4.282
  155   HG22  THR  21          HG22      THR  21   7.931  -1.553   4.198
  156   HG23  THR  21          HG23      THR  21   8.926  -1.558   5.654
  157    H    VAL  22           H        VAL  22   7.276   1.384   5.930
  158    HA   VAL  22           HA       VAL  22   8.862   1.785   8.332
  159    HB   VAL  22           HB       VAL  22   6.672   2.374   9.391
  160   HG11  VAL  22          HG11      VAL  22   6.430   4.514   8.235
  161   HG12  VAL  22          HG12      VAL  22   7.367   3.891   6.877
  162   HG13  VAL  22          HG13      VAL  22   8.128   4.091   8.456
  163   HG21  VAL  22          HG21      VAL  22   4.739   2.766   7.904
  164   HG22  VAL  22          HG22      VAL  22   5.179   1.063   8.009
  165   HG23  VAL  22          HG23      VAL  22   5.626   2.000   6.584
  166    H    ILE  23           H        ILE  23   8.797   0.490  10.125
  167    HA   ILE  23           HA       ILE  23   7.789  -2.192   9.690
  168    HB   ILE  23           HB       ILE  23   9.473  -1.044  11.922
  169   HG12  ILE  23          HG12      ILE  23  11.102  -2.795  10.991
  170   HG13  ILE  23          HG13      ILE  23  10.041  -2.877   9.592
  171   HG21  ILE  23          HG21      ILE  23   8.037  -2.752  12.861
  172   HG22  ILE  23          HG22      ILE  23   9.693  -3.349  12.753
  173   HG23  ILE  23          HG23      ILE  23   8.489  -3.873  11.576
  174   HD11  ILE  23          HD11      ILE  23  11.524  -0.453  10.572
  175   HD12  ILE  23          HD12      ILE  23  10.412  -0.484   9.204
  176   HD13  ILE  23          HD13      ILE  23  11.902  -1.424   9.150
  177    H    ASP  24           H        ASP  24   5.677  -2.322   9.972
  178    HA   ASP  24           HA       ASP  24   4.598  -1.631  12.598
  179    HB2  ASP  24           HB2      ASP  24   4.006   0.263  11.174
  180    HB3  ASP  24           HB3      ASP  24   3.326  -0.828   9.970
  181    H    ASN  25           H        ASN  25   3.183  -3.090  13.363
  182    HA   ASN  25           HA       ASN  25   2.378  -5.266  11.543
  183    HB2  ASN  25           HB2      ASN  25   3.049  -5.406  14.494
  184    HB3  ASN  25           HB3      ASN  25   2.347  -6.733  13.574
  185   HD21  ASN  25          HD21      ASN  25   3.586  -7.790  12.033
  186   HD22  ASN  25          HD22      ASN  25   5.315  -7.654  12.003
  187    H    ASP  26           H        ASP  26   0.271  -5.647  11.358
  188    HA   ASP  26           HA       ASP  26  -1.589  -4.799  13.426
  189    HB2  ASP  26           HB2      ASP  26  -1.341  -2.791  12.002
  190    HB3  ASP  26           HB3      ASP  26  -1.758  -3.749  10.587
  191    H    ASN  27           H        ASN  27  -1.995  -5.476   9.992
  192    HA   ASN  27           HA       ASN  27  -2.871  -8.201  10.535
  193    HB2  ASN  27           HB2      ASN  27  -4.599  -6.070   9.263
  194    HB3  ASN  27           HB3      ASN  27  -4.849  -7.776   8.925
  195   HD21  ASN  27          HD21      ASN  27  -5.095  -5.249  11.293
  196   HD22  ASN  27          HD22      ASN  27  -6.065  -6.140  12.425
  197    H    CYS  28           H        CYS  28  -3.517  -9.120   8.161
  198    HA   CYS  28           HA       CYS  28  -1.261  -8.366   6.437
  199    HG   CYS  28           HG       CYS  28  -0.128 -10.287   7.902
  200    HB2  CYS  28           HB2      CYS  28  -3.065 -10.800   6.319
  201    HB3  CYS  28           HB3      CYS  28  -1.655 -10.513   5.305
  202    H    THR  29           H        THR  29  -4.151  -7.245   6.856
  203    HA   THR  29           HA       THR  29  -5.108  -7.372   4.093
  204    HB   THR  29           HB       THR  29  -6.491  -6.103   6.463
  205    HG1  THR  29           HG1      THR  29  -7.257  -8.025   7.010
  206   HG21  THR  29          HG21      THR  29  -7.320  -5.441   4.249
  207   HG22  THR  29          HG22      THR  29  -8.507  -6.415   5.115
  208   HG23  THR  29          HG23      THR  29  -7.545  -7.138   3.826
  209    H    SER  30           H        SER  30  -4.641  -5.816   2.752
  210    HA   SER  30           HA       SER  30  -3.639  -3.269   3.783
  211    HG   SER  30           HG       SER  30  -2.371  -5.512   2.732
  212    HB2  SER  30           HB2      SER  30  -3.591  -4.361   0.963
  213    HB3  SER  30           HB3      SER  30  -2.704  -2.969   1.572
  214    H    LYS  31           H        LYS  31  -5.063  -1.698   3.971
  215    HA   LYS  31           HA       LYS  31  -7.490  -1.712   2.323
  216    HB2  LYS  31           HB2      LYS  31  -6.789  -0.581   5.014
  217    HB3  LYS  31           HB3      LYS  31  -8.164   0.050   4.120
  218    HG2  LYS  31           HG2      LYS  31  -8.003  -2.889   4.463
  219    HG3  LYS  31           HG3      LYS  31  -8.380  -1.917   5.889
  220    HD2  LYS  31           HD2      LYS  31  -9.861  -1.828   3.256
  221    HD3  LYS  31           HD3      LYS  31 -10.412  -2.643   4.722
  222    HE2  LYS  31           HE2      LYS  31 -10.415  -0.496   5.907
  223    HE3  LYS  31           HE3      LYS  31  -9.890   0.318   4.435
  224    HZ1  LYS  31           HZ1      LYS  31 -12.460  -1.110   4.855
  225    HZ2  LYS  31           HZ2      LYS  31 -11.956  -0.456   3.370
  226    HZ3  LYS  31           HZ3      LYS  31 -12.245   0.564   4.693
  227    H    PHE  32           H        PHE  32  -7.764  -0.230   0.785
  228    HA   PHE  32           HA       PHE  32  -6.583   2.429   1.187
  229    HD1  PHE  32           HD2      PHE  32  -7.896   2.908  -2.537
  230    HD2  PHE  32           HD1      PHE  32  -4.192   3.405  -0.506
  231    HE1  PHE  32           HE2      PHE  32  -7.620   5.113  -3.589
  232    HE2  PHE  32           HE1      PHE  32  -3.911   5.613  -1.553
  233    HZ   PHE  32           HZ       PHE  32  -5.631   6.471  -3.095
  234    HB2  PHE  32           HB2      PHE  32  -5.266   1.269  -0.567
  235    HB3  PHE  32           HB3      PHE  32  -6.746   1.013  -1.489
  236    H    SER  33           H        SER  33  -8.126   3.905   1.281
  237    HA   SER  33           HA       SER  33 -10.655   3.392  -0.144
  238    HG   SER  33           HG       SER  33 -10.901   2.042   2.192
  239    HB2  SER  33           HB2      SER  33 -10.568   4.860   2.478
  240    HB3  SER  33           HB3      SER  33 -11.920   4.019   1.721
  241    H    ARG  34           H        ARG  34 -11.010   4.933  -1.638
  242    HA   ARG  34           HA       ARG  34 -10.578   7.728  -0.900
  243    HE   ARG  34           HE       ARG  34  -6.892   8.563  -2.545
  244    HB2  ARG  34           HB2      ARG  34  -8.490   7.195  -2.007
  245    HB3  ARG  34           HB3      ARG  34  -9.347   6.468  -3.359
  246    HG2  ARG  34           HG2      ARG  34 -10.272   8.647  -3.952
  247    HG3  ARG  34           HG3      ARG  34  -9.429   9.381  -2.589
  248    HD2  ARG  34           HD2      ARG  34  -8.027   7.910  -4.806
  249    HD3  ARG  34           HD3      ARG  34  -8.335   9.646  -4.842
  250   HH11  ARG  34          HH11      ARG  34  -6.873  10.417  -5.510
  251   HH12  ARG  34          HH12      ARG  34  -5.285  11.077  -5.243
  252   HH21  ARG  34          HH21      ARG  34  -4.831   9.468  -2.150
  253   HH22  ARG  34          HH22      ARG  34  -4.132  10.556  -3.322
  254    H    PHE  35           H        PHE  35 -11.973   9.156  -1.953
  255    HA   PHE  35           HA       PHE  35 -14.223   7.948  -3.335
  256    HD1  PHE  35           HD1      PHE  35 -16.629   8.672  -2.042
  257    HD2  PHE  35           HD2      PHE  35 -13.311  10.641  -0.240
  258    HE1  PHE  35           HE1      PHE  35 -17.564   8.206   0.184
  259    HE2  PHE  35           HE2      PHE  35 -14.241  10.171   1.990
  260    HZ   PHE  35           HZ       PHE  35 -16.370   8.957   2.203
  261    HB2  PHE  35           HB2      PHE  35 -13.674  10.825  -2.555
  262    HB3  PHE  35           HB3      PHE  35 -15.163  10.257  -3.300
  263    H    PHE  36           H        PHE  36 -14.765   8.282  -5.455
  264    HA   PHE  36           HA       PHE  36 -12.884   9.849  -7.091
  265    HD1  PHE  36           HD1      PHE  36 -10.873   8.792  -8.758
  266    HD2  PHE  36           HD2      PHE  36 -12.572   5.917  -6.120
  267    HE1  PHE  36           HE1      PHE  36  -8.617   8.015  -8.156
  268    HE2  PHE  36           HE2      PHE  36 -10.318   5.137  -5.515
  269    HZ   PHE  36           HZ       PHE  36  -8.341   6.186  -6.533
  270    HB2  PHE  36           HB2      PHE  36 -13.949   7.082  -7.655
  271    HB3  PHE  36           HB3      PHE  36 -13.254   8.110  -8.907
  272    H    ALA  37           H        ALA  37 -13.782  10.514  -9.178
  273    HA   ALA  37           HA       ALA  37 -16.243  11.825  -8.795
  274    HB1  ALA  37           HB1      ALA  37 -15.981  12.634 -11.059
  275    HB2  ALA  37           HB2      ALA  37 -14.755  11.409 -11.383
  276    HB3  ALA  37           HB3      ALA  37 -14.431  12.693 -10.218
  277    H    THR  38           H        THR  38 -15.374   8.949 -10.670
  278    HA   THR  38           HA       THR  38 -18.233   8.290 -10.823
  279    HB   THR  38           HB       THR  38 -17.850   7.373 -13.130
  280    HG1  THR  38           HG1      THR  38 -15.844   8.825 -13.956
  281   HG21  THR  38          HG21      THR  38 -17.935   9.552 -14.283
  282   HG22  THR  38          HG22      THR  38 -17.431  10.344 -12.789
  283   HG23  THR  38          HG23      THR  38 -18.981   9.507 -12.863
  284    H    ARG  39           H        ARG  39 -18.630   5.963 -11.128
  285    HA   ARG  39           HA       ARG  39 -16.943   4.277  -9.657
  286    HE   ARG  39           HE       ARG  39 -18.051  -0.571 -10.984
  287    HB2  ARG  39           HB2      ARG  39 -19.225   3.629  -9.957
  288    HB3  ARG  39           HB3      ARG  39 -19.066   3.633 -11.706
  289    HG2  ARG  39           HG2      ARG  39 -17.440   1.756 -11.495
  290    HG3  ARG  39           HG3      ARG  39 -17.804   1.704  -9.771
  291    HD2  ARG  39           HD2      ARG  39 -20.096   1.154 -10.218
  292    HD3  ARG  39           HD3      ARG  39 -19.857   1.380 -11.950
  293   HH11  ARG  39          HH11      ARG  39 -21.447  -0.102 -11.711
  294   HH12  ARG  39          HH12      ARG  39 -21.750  -1.783 -12.020
  295   HH21  ARG  39          HH21      ARG  39 -18.443  -2.786 -11.379
  296   HH22  ARG  39          HH22      ARG  39 -20.034  -3.307 -11.842
  297    H    GLU  40           H        GLU  40 -17.029   5.089 -13.046
  298    HA   GLU  40           HA       GLU  40 -15.324   3.195 -14.133
  299    HB2  GLU  40           HB2      GLU  40 -15.494   6.145 -14.754
  300    HB3  GLU  40           HB3      GLU  40 -14.731   4.937 -15.771
  301    HG2  GLU  40           HG2      GLU  40 -16.913   3.797 -15.972
  302    HG3  GLU  40           HG3      GLU  40 -17.646   5.117 -15.065
  303    H    GLU  41           H        GLU  41 -14.547   6.275 -12.591
  304    HA   GLU  41           HA       GLU  41 -11.770   6.179 -12.784
  305    HB2  GLU  41           HB2      GLU  41 -13.555   7.399 -10.676
  306    HB3  GLU  41           HB3      GLU  41 -11.825   7.682 -10.762
  307    HG2  GLU  41           HG2      GLU  41 -13.818   8.358 -12.906
  308    HG3  GLU  41           HG3      GLU  41 -13.097   9.496 -11.767
  309    H    ALA  42           H        ALA  42 -13.957   4.564 -10.616
  310    HA   ALA  42           HA       ALA  42 -11.934   3.727  -8.751
  311    HB1  ALA  42           HB1      ALA  42 -13.695   2.311  -7.801
  312    HB2  ALA  42           HB2      ALA  42 -14.744   2.715  -9.161
  313    HB3  ALA  42           HB3      ALA  42 -14.245   3.971  -8.028
  314    H    GLU  43           H        GLU  43 -13.723   2.218 -11.410
  315    HA   GLU  43           HA       GLU  43 -12.561  -0.329 -11.300
  316    HB2  GLU  43           HB2      GLU  43 -13.436   1.145 -13.794
  317    HB3  GLU  43           HB3      GLU  43 -13.284  -0.593 -13.602
  318    HG2  GLU  43           HG2      GLU  43 -15.239   1.127 -12.095
  319    HG3  GLU  43           HG3      GLU  43 -15.616   0.224 -13.558
  320    H    SER  44           H        SER  44 -11.612   2.589 -13.059
  321    HA   SER  44           HA       SER  44  -9.344   1.507 -14.339
  322    HG   SER  44           HG       SER  44 -10.349   2.930 -16.048
  323    HB2  SER  44           HB2      SER  44  -9.997   4.375 -13.625
  324    HB3  SER  44           HB3      SER  44  -8.732   3.873 -14.747
  325    H    PHE  45           H        PHE  45  -9.819   2.798 -11.117
  326    HA   PHE  45           HA       PHE  45  -7.031   3.200 -10.605
  327    HD1  PHE  45           HD1      PHE  45  -6.754   5.480  -9.000
  328    HD2  PHE  45           HD2      PHE  45  -7.936   2.067  -6.750
  329    HE1  PHE  45           HE1      PHE  45  -5.074   6.030  -7.290
  330    HE2  PHE  45           HE2      PHE  45  -6.255   2.609  -5.039
  331    HZ   PHE  45           HZ       PHE  45  -4.822   4.593  -5.306
  332    HB2  PHE  45           HB2      PHE  45  -8.922   4.334  -9.370
  333    HB3  PHE  45           HB3      PHE  45  -9.239   2.794  -8.579
  334    H    MET  46           H        MET  46  -9.336   0.611 -10.228
  335    HA   MET  46           HA       MET  46  -7.766  -1.060  -8.563
  336    HB2  MET  46           HB2      MET  46 -10.216  -1.268  -8.808
  337    HB3  MET  46           HB3      MET  46  -9.998  -1.803 -10.465
  338    HG2  MET  46           HG2      MET  46 -10.437  -3.652  -8.912
  339    HG3  MET  46           HG3      MET  46  -8.885  -3.802  -9.734
  340    HE1  MET  46           HE1      MET  46  -9.190  -2.219  -5.412
  341    HE2  MET  46           HE2      MET  46 -10.618  -2.639  -6.358
  342    HE3  MET  46           HE3      MET  46  -9.600  -1.286  -6.851
  343    H    THR  47           H        THR  47  -7.747  -0.429 -11.951
  344    HA   THR  47           HA       THR  47  -6.764  -2.805 -13.002
  345    HB   THR  47           HB       THR  47  -5.853  -0.105 -13.980
  346    HG1  THR  47           HG1      THR  47  -8.303  -1.149 -14.863
  347   HG21  THR  47          HG21      THR  47  -5.030  -2.110 -15.143
  348   HG22  THR  47          HG22      THR  47  -6.100  -1.159 -16.174
  349   HG23  THR  47          HG23      THR  47  -6.691  -2.635 -15.408
  350    H    LYS  48           H        LYS  48  -4.900  -0.003 -11.763
  351    HA   LYS  48           HA       LYS  48  -2.399  -1.301 -12.205
  352    HB2  LYS  48           HB2      LYS  48  -1.381   0.529 -10.984
  353    HB3  LYS  48           HB3      LYS  48  -2.570   1.152 -12.116
  354    HG2  LYS  48           HG2      LYS  48  -4.089   1.669 -10.397
  355    HG3  LYS  48           HG3      LYS  48  -3.207   0.699  -9.216
  356    HD2  LYS  48           HD2      LYS  48  -1.312   2.263  -9.376
  357    HD3  LYS  48           HD3      LYS  48  -2.234   3.243 -10.519
  358    HE2  LYS  48           HE2      LYS  48  -3.893   3.723  -8.840
  359    HE3  LYS  48           HE3      LYS  48  -3.112   2.628  -7.701
  360    HZ1  LYS  48           HZ1      LYS  48  -1.244   4.061  -7.553
  361    HZ2  LYS  48           HZ2      LYS  48  -2.613   5.038  -7.361
  362    HZ3  LYS  48           HZ3      LYS  48  -1.779   5.028  -8.834
  363    H    LEU  49           H        LEU  49  -4.661  -1.199  -9.573
  364    HA   LEU  49           HA       LEU  49  -3.012  -2.101  -7.483
  365    HG   LEU  49           HG       LEU  49  -6.199  -0.962  -5.978
  366    HB2  LEU  49           HB2      LEU  49  -5.938  -2.123  -8.041
  367    HB3  LEU  49           HB3      LEU  49  -5.349  -3.167  -6.765
  368   HD11  LEU  49          HD11      LEU  49  -4.338  -0.518  -4.466
  369   HD12  LEU  49          HD12      LEU  49  -3.280  -1.501  -5.478
  370   HD13  LEU  49          HD13      LEU  49  -4.639  -2.248  -4.635
  371   HD21  LEU  49          HD21      LEU  49  -3.767   0.109  -7.402
  372   HD22  LEU  49          HD22      LEU  49  -4.792   1.017  -6.292
  373   HD23  LEU  49          HD23      LEU  49  -5.450   0.434  -7.822
  374    H    LYS  50           H        LYS  50  -4.860  -3.820  -9.948
  375    HA   LYS  50           HA       LYS  50  -4.603  -6.429  -9.089
  376    HB2  LYS  50           HB2      LYS  50  -4.666  -5.209 -11.840
  377    HB3  LYS  50           HB3      LYS  50  -4.752  -6.940 -11.572
  378    HG2  LYS  50           HG2      LYS  50  -6.864  -6.850 -10.743
  379    HG3  LYS  50           HG3      LYS  50  -6.648  -5.225 -10.087
  380    HD2  LYS  50           HD2      LYS  50  -6.960  -4.218 -12.172
  381    HD3  LYS  50           HD3      LYS  50  -6.703  -5.729 -13.035
  382    HE2  LYS  50           HE2      LYS  50  -9.054  -5.090 -11.257
  383    HE3  LYS  50           HE3      LYS  50  -9.070  -5.059 -13.019
  384    HZ1  LYS  50           HZ1      LYS  50  -8.551  -7.429 -13.019
  385    HZ2  LYS  50           HZ2      LYS  50  -9.992  -7.120 -12.176
  386    HZ3  LYS  50           HZ3      LYS  50  -8.567  -7.448 -11.322
  387    H    GLU  51           H        GLU  51  -2.381  -4.626 -11.213
  388    HA   GLU  51           HA       GLU  51  -0.537  -6.775 -11.466
  389    HB2  GLU  51           HB2      GLU  51  -0.089  -3.821 -11.902
  390    HB3  GLU  51           HB3      GLU  51   0.967  -5.113 -12.458
  391    HG2  GLU  51           HG2      GLU  51  -0.942  -5.977 -13.808
  392    HG3  GLU  51           HG3      GLU  51  -1.835  -4.523 -13.363
  393    H    LEU  52           H        LEU  52  -0.683  -3.927  -9.399
  394    HA   LEU  52           HA       LEU  52   1.888  -4.149  -8.291
  395    HG   LEU  52           HG       LEU  52   0.284  -1.768  -9.235
  396    HB2  LEU  52           HB2      LEU  52  -0.622  -2.874  -7.223
  397    HB3  LEU  52           HB3      LEU  52   0.941  -2.725  -6.445
  398   HD11  LEU  52          HD11      LEU  52   0.495   0.471  -8.281
  399   HD12  LEU  52          HD12      LEU  52   0.722  -0.230  -6.679
  400   HD13  LEU  52          HD13      LEU  52  -0.815  -0.432  -7.519
  401   HD21  LEU  52          HD21      LEU  52   2.780  -1.451  -7.572
  402   HD22  LEU  52          HD22      LEU  52   2.480  -0.694  -9.136
  403   HD23  LEU  52          HD23      LEU  52   2.612  -2.449  -9.019
  404    H    ALA  53           H        ALA  53  -1.222  -5.474  -7.229
  405    HA   ALA  53           HA       ALA  53  -0.393  -6.458  -4.736
  406    HB1  ALA  53           HB1      ALA  53  -2.348  -7.894  -4.826
  407    HB2  ALA  53           HB2      ALA  53  -2.494  -7.620  -6.563
  408    HB3  ALA  53           HB3      ALA  53  -2.745  -6.287  -5.436
  409    H    ALA  54           H        ALA  54  -0.398  -7.992  -7.931
  410    HA   ALA  54           HA       ALA  54   0.515 -10.519  -7.104
  411    HB1  ALA  54           HB1      ALA  54   0.902  -9.175  -9.776
  412    HB2  ALA  54           HB2      ALA  54  -0.512 -10.110  -9.289
  413    HB3  ALA  54           HB3      ALA  54   1.056 -10.900  -9.446
  414    H    ALA  55           H        ALA  55   2.256  -7.653  -8.241
  415    HA   ALA  55           HA       ALA  55   4.820  -8.876  -8.245
  416    HB1  ALA  55           HB1      ALA  55   4.327  -6.926  -9.616
  417    HB2  ALA  55           HB2      ALA  55   5.679  -6.602  -8.532
  418    HB3  ALA  55           HB3      ALA  55   4.081  -5.953  -8.167
  419    H    ALA  56           H        ALA  56   3.045  -6.946  -5.882
  420    HA   ALA  56           HA       ALA  56   5.107  -6.407  -4.079
  421    HB1  ALA  56           HB1      ALA  56   3.364  -6.020  -2.441
  422    HB2  ALA  56           HB2      ALA  56   2.200  -6.887  -3.443
  423    HB3  ALA  56           HB3      ALA  56   2.883  -5.361  -4.004
  424    H    SER  57           H        SER  57   2.882  -9.173  -4.209
  425    HA   SER  57           HA       SER  57   4.179 -10.384  -1.925
  426    HG   SER  57           HG       SER  57   2.970 -12.249  -1.137
  427    HB2  SER  57           HB2      SER  57   1.735 -10.534  -2.151
  428    HB3  SER  57           HB3      SER  57   1.933 -11.435  -3.655
  429    H    SER  58           H        SER  58   3.971 -10.856  -5.376
  430    HA   SER  58           HA       SER  58   5.219 -12.036  -6.862
  431    HG   SER  58           HG       SER  58   6.448 -10.215  -5.494
  432    HB2  SER  58           HB2      SER  58   7.123 -12.495  -4.553
  433    HB3  SER  58           HB3      SER  58   7.489 -12.670  -6.270
  434    H    ALA  59           H        ALA  59   3.509 -13.361  -4.520
  435    HA   ALA  59           HA       ALA  59   4.457 -16.104  -4.710
  436    HB1  ALA  59           HB1      ALA  59   2.741 -16.603  -3.063
  437    HB2  ALA  59           HB2      ALA  59   2.089 -14.972  -3.220
  438    HB3  ALA  59           HB3      ALA  59   3.701 -15.218  -2.546
  439    H    ASP  60           H        ASP  60   3.608 -14.994  -7.138
  440    HA   ASP  60           HA       ASP  60   2.389 -15.454  -8.975
  441    HB2  ASP  60           HB2      ASP  60   1.528 -17.825  -7.327
  442    HB3  ASP  60           HB3      ASP  60   0.968 -17.564  -8.976
  443    H    GLU  61           H        GLU  61   0.035 -16.514  -6.527
  444    HA   GLU  61           HA       GLU  61  -2.116 -15.153  -7.759
  445    HB2  GLU  61           HB2      GLU  61  -1.863 -16.125  -4.905
  446    HB3  GLU  61           HB3      GLU  61  -3.365 -15.692  -5.712
  447    HG2  GLU  61           HG2      GLU  61  -1.534 -17.967  -6.434
  448    HG3  GLU  61           HG3      GLU  61  -3.100 -18.092  -5.634
  449    H    GLY  62           H        GLY  62   0.050 -14.343  -5.103
  450    HA2  GLY  62           HA2      GLY  62   0.720 -12.188  -4.493
  451    HA3  GLY  62           HA3      GLY  62  -0.582 -11.532  -5.473
  452    H    ALA  63           H        ALA  63  -2.620 -11.278  -4.593
  453    HA   ALA  63           HA       ALA  63  -2.992 -11.916  -1.776
  454    HB1  ALA  63           HB1      ALA  63  -3.553  -9.616  -1.185
  455    HB2  ALA  63           HB2      ALA  63  -3.140  -9.086  -2.816
  456    HB3  ALA  63           HB3      ALA  63  -1.888  -9.731  -1.754
  457    H    SER  64           H        SER  64  -5.127 -12.081  -1.183
  458    HA   SER  64           HA       SER  64  -7.106 -12.230  -3.236
  459    HG   SER  64           HG       SER  64  -6.825 -14.239  -2.124
  460    HB2  SER  64           HB2      SER  64  -7.432 -12.250  -0.221
  461    HB3  SER  64           HB3      SER  64  -8.651 -12.741  -1.399
  462    H    VAL  65           H        VAL  65  -8.336 -10.604  -4.001
  463    HA   VAL  65           HA       VAL  65  -8.104  -8.038  -2.604
  464    HB   VAL  65           HB       VAL  65  -7.235  -7.908  -4.831
  465   HG11  VAL  65          HG11      VAL  65  -9.895  -8.953  -5.790
  466   HG12  VAL  65          HG12      VAL  65  -8.354  -9.810  -5.838
  467   HG13  VAL  65          HG13      VAL  65  -8.589  -8.364  -6.820
  468   HG21  VAL  65          HG21      VAL  65  -8.477  -5.966  -4.028
  469   HG22  VAL  65          HG22      VAL  65  -9.956  -6.609  -4.741
  470   HG23  VAL  65          HG23      VAL  65  -8.612  -6.134  -5.778
  471    H    ALA  66           H        ALA  66  -9.737  -7.496  -1.406
  472    HA   ALA  66           HA       ALA  66 -12.459  -8.049  -2.376
  473    HB1  ALA  66           HB1      ALA  66 -11.974  -9.043  -0.182
  474    HB2  ALA  66           HB2      ALA  66 -13.213  -7.792  -0.073
  475    HB3  ALA  66           HB3      ALA  66 -11.562  -7.446   0.443
  476    H    TYR  67           H        TYR  67 -12.864  -6.295  -3.634
  477    HA   TYR  67           HA       TYR  67 -12.265  -3.663  -2.467
  478    HD1  TYR  67           HD1      TYR  67 -14.177  -3.280  -6.260
  479    HD2  TYR  67           HD2      TYR  67 -11.091  -6.138  -5.617
  480    HE1  TYR  67           HE1      TYR  67 -14.948  -4.545  -8.220
  481    HE2  TYR  67           HE2      TYR  67 -11.855  -7.414  -7.573
  482    HH   TYR  67           HH       TYR  67 -13.771  -7.717  -8.947
  483    HB2  TYR  67           HB2      TYR  67 -12.286  -2.790  -4.791
  484    HB3  TYR  67           HB3      TYR  67 -11.030  -3.985  -4.508
  485    H    LYS  68           H        LYS  68 -13.817  -2.289  -2.072
  486    HA   LYS  68           HA       LYS  68 -16.526  -2.954  -2.998
  487    HB2  LYS  68           HB2      LYS  68 -15.603  -1.346  -0.618
  488    HB3  LYS  68           HB3      LYS  68 -17.281  -1.466  -1.132
  489    HG2  LYS  68           HG2      LYS  68 -17.400  -3.738  -0.604
  490    HG3  LYS  68           HG3      LYS  68 -15.646  -3.884  -0.497
  491    HD2  LYS  68           HD2      LYS  68 -15.669  -2.411   1.478
  492    HD3  LYS  68           HD3      LYS  68 -17.427  -2.317   1.368
  493    HE2  LYS  68           HE2      LYS  68 -17.615  -4.693   1.767
  494    HE3  LYS  68           HE3      LYS  68 -15.858  -4.861   1.769
  495    HZ1  LYS  68           HZ1      LYS  68 -17.414  -3.229   3.703
  496    HZ2  LYS  68           HZ2      LYS  68 -15.736  -3.490   3.730
  497    HZ3  LYS  68           HZ3      LYS  68 -16.804  -4.780   4.014
  498    H    ILE  69           H        ILE  69 -17.604  -1.587  -4.178
  499    HA   ILE  69           HA       ILE  69 -16.595   1.151  -4.547
  500    HB   ILE  69           HB       ILE  69 -17.636  -0.599  -6.789
  501   HG12  ILE  69          HG12      ILE  69 -14.816   0.374  -6.274
  502   HG13  ILE  69          HG13      ILE  69 -15.376  -1.273  -6.009
  503   HG21  ILE  69          HG21      ILE  69 -16.975   1.248  -8.243
  504   HG22  ILE  69          HG22      ILE  69 -16.453   2.175  -6.836
  505   HG23  ILE  69          HG23      ILE  69 -18.159   1.777  -7.047
  506   HD11  ILE  69          HD11      ILE  69 -14.149  -1.086  -8.089
  507   HD12  ILE  69          HD12      ILE  69 -15.268   0.153  -8.658
  508   HD13  ILE  69          HD13      ILE  69 -15.836  -1.497  -8.395
  509    H    LYS  70           H        LYS  70 -18.161   2.300  -3.570
  510    HA   LYS  70           HA       LYS  70 -20.930   1.391  -3.891
  511    HB2  LYS  70           HB2      LYS  70 -20.035   1.820  -1.605
  512    HB3  LYS  70           HB3      LYS  70 -19.881   3.517  -2.025
  513    HG2  LYS  70           HG2      LYS  70 -21.891   3.242  -0.778
  514    HG3  LYS  70           HG3      LYS  70 -22.342   3.546  -2.457
  515    HD2  LYS  70           HD2      LYS  70 -22.791   1.214  -2.821
  516    HD3  LYS  70           HD3      LYS  70 -22.141   0.793  -1.237
  517    HE2  LYS  70           HE2      LYS  70 -24.529   0.744  -1.094
  518    HE3  LYS  70           HE3      LYS  70 -23.958   2.154  -0.205
  519    HZ1  LYS  70           HZ1      LYS  70 -24.490   3.515  -2.170
  520    HZ2  LYS  70           HZ2      LYS  70 -25.853   2.749  -1.520
  521    HZ3  LYS  70           HZ3      LYS  70 -25.140   2.144  -2.931
  522    H    ASP  71           H        ASP  71 -22.065   2.259  -5.397
  523    HA   ASP  71           HA       ASP  71 -21.352   4.658  -6.751
  524    HB2  ASP  71           HB2      ASP  71 -23.868   2.978  -6.853
  525    HB3  ASP  71           HB3      ASP  71 -23.554   4.351  -7.900
  526    H    LEU  72           H        LEU  72 -21.445   6.478  -5.585
  527    HA   LEU  72           HA       LEU  72 -23.688   6.925  -3.760
  528    HG   LEU  72           HG       LEU  72 -20.723   6.290  -3.218
  529    HB2  LEU  72           HB2      LEU  72 -21.196   8.585  -4.187
  530    HB3  LEU  72           HB3      LEU  72 -22.373   8.792  -2.905
  531   HD11  LEU  72          HD11      LEU  72 -19.306   7.185  -1.422
  532   HD12  LEU  72          HD12      LEU  72 -20.163   8.722  -1.531
  533   HD13  LEU  72          HD13      LEU  72 -19.206   8.148  -2.895
  534   HD21  LEU  72          HD21      LEU  72 -22.741   6.017  -1.907
  535   HD22  LEU  72          HD22      LEU  72 -22.325   7.426  -0.931
  536   HD23  LEU  72          HD23      LEU  72 -21.326   5.974  -0.855
  537    H    GLU  73           H        GLU  73 -23.975   9.608  -3.776
  538    HA   GLU  73           HA       GLU  73 -25.151  10.050  -6.406
  539    HB2  GLU  73           HB2      GLU  73 -26.503  10.336  -4.316
  540    HB3  GLU  73           HB3      GLU  73 -25.473  11.697  -3.896
  541    HG2  GLU  73           HG2      GLU  73 -26.158  12.804  -6.000
  542    HG3  GLU  73           HG3      GLU  73 -27.277  11.473  -6.286
  543    H    GLY  74           H        GLY  74 -23.566  10.745  -7.738
  544    HA2  GLY  74           HA2      GLY  74 -22.575  12.660  -8.725
  545    HA3  GLY  74           HA3      GLY  74 -22.468  13.392  -7.133
  546    H    GLN  75           H        GLN  75 -21.440  10.364  -6.626
  547    HA   GLN  75           HA       GLN  75 -18.831  10.358  -7.742
  548    HB2  GLN  75           HB2      GLN  75 -17.581  10.691  -5.609
  549    HB3  GLN  75           HB3      GLN  75 -18.367  12.148  -6.196
  550    HG2  GLN  75           HG2      GLN  75 -20.135  11.903  -4.574
  551    HG3  GLN  75           HG3      GLN  75 -19.466  10.362  -4.037
  552   HE21  GLN  75          HE21      GLN  75 -19.286  11.157  -1.912
  553   HE22  GLN  75          HE22      GLN  75 -18.021  12.257  -1.471
  554    H    VAL  76           H        VAL  76 -17.424   8.716  -6.337
  555    HA   VAL  76           HA       VAL  76 -19.151   6.690  -5.098
  556    HB   VAL  76           HB       VAL  76 -17.969   4.864  -6.244
  557   HG11  VAL  76          HG11      VAL  76 -19.286   6.820  -8.121
  558   HG12  VAL  76          HG12      VAL  76 -20.090   5.577  -7.162
  559   HG13  VAL  76          HG13      VAL  76 -18.997   5.117  -8.470
  560   HG21  VAL  76          HG21      VAL  76 -16.581   5.328  -8.210
  561   HG22  VAL  76          HG22      VAL  76 -15.884   5.996  -6.734
  562   HG23  VAL  76          HG23      VAL  76 -16.706   7.056  -7.879
  563    H    GLU  77           H        GLU  77 -17.908   5.111  -3.822
  564    HA   GLU  77           HA       GLU  77 -15.304   6.185  -2.972
  565    HB2  GLU  77           HB2      GLU  77 -16.951   6.268  -1.164
  566    HB3  GLU  77           HB3      GLU  77 -17.278   4.551  -1.367
  567    HG2  GLU  77           HG2      GLU  77 -14.984   4.029  -0.708
  568    HG3  GLU  77           HG3      GLU  77 -14.645   5.748  -0.514
  569    H    LEU  78           H        LEU  78 -13.610   5.018  -3.489
  570    HA   LEU  78           HA       LEU  78 -13.959   2.184  -4.171
  571    HG   LEU  78           HG       LEU  78 -11.110   2.398  -6.577
  572    HB2  LEU  78           HB2      LEU  78 -12.894   3.704  -5.840
  573    HB3  LEU  78           HB3      LEU  78 -11.621   4.039  -4.687
  574   HD11  LEU  78          HD11      LEU  78 -10.640   1.520  -3.734
  575   HD12  LEU  78          HD12      LEU  78  -9.647   2.648  -4.658
  576   HD13  LEU  78          HD13      LEU  78  -9.748   0.957  -5.147
  577   HD21  LEU  78          HD21      LEU  78 -11.764   0.075  -6.192
  578   HD22  LEU  78          HD22      LEU  78 -13.167   1.108  -6.474
  579   HD23  LEU  78          HD23      LEU  78 -12.770   0.584  -4.837
  580    H    ASP  79           H        ASP  79 -13.526   0.799  -2.622
  581    HA   ASP  79           HA       ASP  79 -11.345   1.401  -0.737
  582    HB2  ASP  79           HB2      ASP  79 -13.436   1.747   0.450
  583    HB3  ASP  79           HB3      ASP  79 -14.031   0.177  -0.077
  584    H    ALA  80           H        ALA  80  -9.795   0.011  -1.152
  585    HA   ALA  80           HA       ALA  80 -10.536  -2.708  -2.002
  586    HB1  ALA  80           HB1      ALA  80  -7.996  -1.182  -2.551
  587    HB2  ALA  80           HB2      ALA  80  -9.315  -1.446  -3.692
  588    HB3  ALA  80           HB3      ALA  80  -8.367  -2.814  -3.110
  589    H    ALA  81           H        ALA  81 -10.151  -4.285  -0.623
  590    HA   ALA  81           HA       ALA  81  -7.992  -3.949   1.353
  591    HB1  ALA  81           HB1      ALA  81 -10.193  -4.018   2.405
  592    HB2  ALA  81           HB2      ALA  81  -9.246  -5.446   2.826
  593    HB3  ALA  81           HB3      ALA  81 -10.528  -5.561   1.620
  594    H    PHE  82           H        PHE  82  -6.287  -5.057   0.661
  595    HA   PHE  82           HA       PHE  82  -6.671  -7.608  -0.751
  596    HD1  PHE  82           HD1      PHE  82  -5.782  -4.034  -1.381
  597    HD2  PHE  82           HD2      PHE  82  -4.718  -7.571  -3.489
  598    HE1  PHE  82           HE1      PHE  82  -6.389  -2.946  -3.498
  599    HE2  PHE  82           HE2      PHE  82  -5.325  -6.489  -5.614
  600    HZ   PHE  82           HZ       PHE  82  -6.159  -4.173  -5.619
  601    HB2  PHE  82           HB2      PHE  82  -4.241  -5.828  -0.433
  602    HB3  PHE  82           HB3      PHE  82  -4.211  -7.391  -1.238
  603    H    THR  83           H        THR  83  -6.221  -9.504   0.195
  604    HA   THR  83           HA       THR  83  -4.990  -9.489   2.853
  605    HB   THR  83           HB       THR  83  -6.262 -11.807   1.376
  606    HG1  THR  83           HG1      THR  83  -7.534  -9.776   2.223
  607   HG21  THR  83          HG21      THR  83  -4.679 -12.479   3.128
  608   HG22  THR  83          HG22      THR  83  -6.339 -12.870   3.577
  609   HG23  THR  83          HG23      THR  83  -5.538 -11.471   4.291
  610    H    PHE  84           H        PHE  84  -2.821  -9.463   2.711
  611    HA   PHE  84           HA       PHE  84  -1.466 -11.044   0.662
  612    HD1  PHE  84           HD2      PHE  84   0.861  -9.786  -0.655
  613    HD2  PHE  84           HD1      PHE  84  -1.767  -7.222   1.496
  614    HE1  PHE  84           HE2      PHE  84   0.762  -8.274  -2.591
  615    HE2  PHE  84           HE1      PHE  84  -1.870  -5.707  -0.437
  616    HZ   PHE  84           HZ       PHE  84  -0.603  -6.229  -2.482
  617    HB2  PHE  84           HB2      PHE  84  -0.541  -8.954   2.622
  618    HB3  PHE  84           HB3      PHE  84   0.608  -9.969   1.756
  619    H    SER  85           H        SER  85   0.804 -11.897   1.726
  620    HA   SER  85           HA       SER  85  -0.148 -13.907   3.649
  621    HG   SER  85           HG       SER  85   2.349 -12.959   1.390
  622    HB2  SER  85           HB2      SER  85   1.707 -15.301   2.839
  623    HB3  SER  85           HB3      SER  85   0.677 -14.780   1.508
  624    H    CYS  86           H        CYS  86   2.274 -11.460   3.111
  625    HA   CYS  86           HA       CYS  86   3.374 -12.004   5.796
  626    HG   CYS  86           HG       CYS  86   4.138 -13.318   2.666
  627    HB2  CYS  86           HB2      CYS  86   4.845 -10.667   3.519
  628    HB3  CYS  86           HB3      CYS  86   5.520 -11.268   5.031
  629    H    GLN  87           H        GLN  87   3.882 -10.171   7.090
  630    HA   GLN  87           HA       GLN  87   2.058  -8.035   6.890
  631    HB2  GLN  87           HB2      GLN  87   3.058  -8.667   9.035
  632    HB3  GLN  87           HB3      GLN  87   4.643  -8.162   8.458
  633    HG2  GLN  87           HG2      GLN  87   3.898  -6.364   9.754
  634    HG3  GLN  87           HG3      GLN  87   3.601  -5.872   8.094
  635   HE21  GLN  87          HE21      GLN  87   1.990  -4.446   8.588
  636   HE22  GLN  87          HE22      GLN  87   0.422  -4.949   9.105
  637    H    ALA  88           H        ALA  88   5.433  -8.359   5.989
  638    HA   ALA  88           HA       ALA  88   6.052  -5.715   5.444
  639    HB1  ALA  88           HB1      ALA  88   7.834  -6.570   4.033
  640    HB2  ALA  88           HB2      ALA  88   7.056  -8.152   3.982
  641    HB3  ALA  88           HB3      ALA  88   7.697  -7.533   5.505
  642    H    GLU  89           H        GLU  89   4.351  -8.080   3.484
  643    HA   GLU  89           HA       GLU  89   4.469  -6.686   1.030
  644    HB2  GLU  89           HB2      GLU  89   2.349  -8.647   1.928
  645    HB3  GLU  89           HB3      GLU  89   2.779  -8.243   0.272
  646    HG2  GLU  89           HG2      GLU  89   4.967  -9.245   0.571
  647    HG3  GLU  89           HG3      GLU  89   4.587  -9.607   2.254
  648    H    MET  90           H        MET  90   2.283  -6.536   3.771
  649    HA   MET  90           HA       MET  90   0.269  -4.960   2.528
  650    HB2  MET  90           HB2      MET  90  -0.264  -6.111   4.570
  651    HB3  MET  90           HB3      MET  90   1.053  -5.317   5.426
  652    HG2  MET  90           HG2      MET  90  -0.144  -3.136   4.973
  653    HG3  MET  90           HG3      MET  90  -1.518  -4.109   4.452
  654    HE1  MET  90           HE1      MET  90  -2.982  -2.775   6.265
  655    HE2  MET  90           HE2      MET  90  -1.560  -1.889   6.815
  656    HE3  MET  90           HE3      MET  90  -2.590  -2.717   7.984
  657    H    ILE  91           H        ILE  91   2.953  -4.126   4.687
  658    HA   ILE  91           HA       ILE  91   2.393  -1.361   4.646
  659    HB   ILE  91           HB       ILE  91   4.874  -1.294   5.565
  660   HG12  ILE  91          HG12      ILE  91   4.032  -4.167   6.006
  661   HG13  ILE  91          HG13      ILE  91   5.382  -3.645   5.018
  662   HG21  ILE  91          HG21      ILE  91   3.947  -1.704   7.801
  663   HG22  ILE  91          HG22      ILE  91   2.503  -2.398   7.062
  664   HG23  ILE  91          HG23      ILE  91   2.890  -0.695   6.813
  665   HD11  ILE  91          HD11      ILE  91   6.484  -2.749   7.013
  666   HD12  ILE  91          HD12      ILE  91   6.151  -4.476   7.146
  667   HD13  ILE  91          HD13      ILE  91   5.130  -3.314   7.994
  668    H    ILE  92           H        ILE  92   4.582  -3.339   2.664
  669    HA   ILE  92           HA       ILE  92   5.760  -1.045   1.427
  670    HB   ILE  92           HB       ILE  92   6.574  -2.587  -0.313
  671   HG12  ILE  92          HG12      ILE  92   6.198  -5.128   0.521
  672   HG13  ILE  92          HG13      ILE  92   4.641  -4.430   0.948
  673   HG21  ILE  92          HG21      ILE  92   8.052  -3.898   1.122
  674   HG22  ILE  92          HG22      ILE  92   7.000  -3.569   2.498
  675   HG23  ILE  92          HG23      ILE  92   7.864  -2.247   1.713
  676   HD11  ILE  92          HD11      ILE  92   4.592  -5.445  -1.256
  677   HD12  ILE  92          HD12      ILE  92   5.901  -4.387  -1.782
  678   HD13  ILE  92          HD13      ILE  92   4.333  -3.703  -1.356
  679    H    PHE  93           H        PHE  93   2.886  -2.910   0.923
  680    HA   PHE  93           HA       PHE  93   2.392  -2.145  -1.764
  681    HD1  PHE  93           HD1      PHE  93   1.348  -3.693  -3.253
  682    HD2  PHE  93           HD2      PHE  93  -1.759  -2.854  -0.468
  683    HE1  PHE  93           HE1      PHE  93  -0.306  -3.826  -5.067
  684    HE2  PHE  93           HE2      PHE  93  -3.419  -2.986  -2.280
  685    HZ   PHE  93           HZ       PHE  93  -2.691  -3.471  -4.583
  686    HB2  PHE  93           HB2      PHE  93   1.431  -4.154  -0.602
  687    HB3  PHE  93           HB3      PHE  93   0.384  -3.065   0.298
  688    H    GLU  94           H        GLU  94   1.011  -1.053   1.339
  689    HA   GLU  94           HA       GLU  94  -0.696   0.882   0.249
  690    HB2  GLU  94           HB2      GLU  94  -0.630   1.926   2.537
  691    HB3  GLU  94           HB3      GLU  94  -1.067   0.225   2.502
  692    HG2  GLU  94           HG2      GLU  94   0.916  -0.444   3.465
  693    HG3  GLU  94           HG3      GLU  94   1.771   1.018   2.979
  694    H    LEU  95           H        LEU  95   2.649   1.133   1.363
  695    HA   LEU  95           HA       LEU  95   2.929   3.906   0.987
  696    HG   LEU  95           HG       LEU  95   3.967   2.021   3.141
  697    HB2  LEU  95           HB2      LEU  95   4.960   1.677   0.910
  698    HB3  LEU  95           HB3      LEU  95   5.387   3.374   0.843
  699   HD11  LEU  95          HD11      LEU  95   6.060   2.351   4.346
  700   HD12  LEU  95          HD12      LEU  95   6.802   3.016   2.891
  701   HD13  LEU  95          HD13      LEU  95   6.298   1.327   2.930
  702   HD21  LEU  95          HD21      LEU  95   4.359   4.134   4.320
  703   HD22  LEU  95          HD22      LEU  95   3.320   4.356   2.914
  704   HD23  LEU  95          HD23      LEU  95   5.015   4.835   2.840
  705    H    SER  96           H        SER  96   3.691   1.167  -1.141
  706    HA   SER  96           HA       SER  96   4.675   2.610  -3.312
  707    HG   SER  96           HG       SER  96   4.157  -0.333  -5.291
  708    HB2  SER  96           HB2      SER  96   4.877   0.152  -3.024
  709    HB3  SER  96           HB3      SER  96   3.159  -0.012  -3.380
  710    H    LEU  97           H        LEU  97   1.345   1.685  -2.504
  711    HA   LEU  97           HA       LEU  97   0.092   2.458  -4.876
  712    HG   LEU  97           HG       LEU  97  -0.418   0.349  -2.534
  713    HB2  LEU  97           HB2      LEU  97  -0.977   2.663  -2.058
  714    HB3  LEU  97           HB3      LEU  97  -1.947   2.755  -3.513
  715   HD11  LEU  97          HD11      LEU  97  -3.373   0.899  -2.756
  716   HD12  LEU  97          HD12      LEU  97  -2.438   0.819  -1.264
  717   HD13  LEU  97          HD13      LEU  97  -2.641  -0.626  -2.254
  718   HD21  LEU  97          HD21      LEU  97  -1.437  -0.832  -4.411
  719   HD22  LEU  97          HD22      LEU  97  -0.392   0.473  -4.973
  720   HD23  LEU  97          HD23      LEU  97  -2.145   0.678  -4.987
  721    H    ARG  98           H        ARG  98   0.782   4.352  -1.977
  722    HA   ARG  98           HA       ARG  98  -0.492   6.696  -3.019
  723    HE   ARG  98           HE       ARG  98  -2.442   7.783   0.951
  724    HB2  ARG  98           HB2      ARG  98   1.280   6.391  -0.603
  725    HB3  ARG  98           HB3      ARG  98   0.231   7.760  -0.963
  726    HG2  ARG  98           HG2      ARG  98  -1.715   6.276  -0.876
  727    HG3  ARG  98           HG3      ARG  98  -0.656   4.930  -0.464
  728    HD2  ARG  98           HD2      ARG  98  -1.486   5.619   1.567
  729    HD3  ARG  98           HD3      ARG  98   0.096   6.382   1.506
  730   HH11  ARG  98          HH11      ARG  98   0.812   7.736   2.263
  731   HH12  ARG  98          HH12      ARG  98   0.716   9.366   2.871
  732   HH21  ARG  98          HH21      ARG  98  -2.589   9.881   1.800
  733   HH22  ARG  98          HH22      ARG  98  -1.225  10.578   2.623
  734    H    SER  99           H        SER  99   2.797   5.505  -2.731
  735    HA   SER  99           HA       SER  99   3.952   8.037  -3.538
  736    HG   SER  99           HG       SER  99   4.396   5.931  -1.193
  737    HB2  SER  99           HB2      SER  99   5.327   5.372  -3.125
  738    HB3  SER  99           HB3      SER  99   6.097   6.956  -3.211
  739    H    LEU 100           H        LEU 100   2.431   5.675  -5.214
  740    HA   LEU 100           HA       LEU 100   4.183   5.382  -7.445
  741    HG   LEU 100           HG       LEU 100   2.222   4.889  -9.680
  742    HB2  LEU 100           HB2      LEU 100   2.257   3.860  -6.839
  743    HB3  LEU 100           HB3      LEU 100   1.182   5.099  -7.451
  744   HD11  LEU 100          HD11      LEU 100   3.755   2.628  -8.407
  745   HD12  LEU 100          HD12      LEU 100   4.429   4.141  -9.013
  746   HD13  LEU 100          HD13      LEU 100   3.705   2.988 -10.133
  747   HD21  LEU 100          HD21      LEU 100   0.217   3.604  -9.129
  748   HD22  LEU 100          HD22      LEU 100   1.225   2.284  -8.536
  749   HD23  LEU 100          HD23      LEU 100   1.261   2.723 -10.245
  750    H    ALA 101           H        ALA 101   1.478   7.496  -6.663
  751    HA   ALA 101           HA       ALA 101   1.873   9.065  -9.077
  752    HB1  ALA 101           HB1      ALA 101   0.007  10.415  -8.276
  753    HB2  ALA 101           HB2      ALA 101   0.013   9.542  -6.743
  754    HB3  ALA 101           HB3      ALA 101  -0.406   8.702  -8.237
  755    H    LEU 102           H        LEU 102   2.672   9.092  -5.712
  756    HA   LEU 102           HA       LEU 102   3.921  11.741  -5.965
  757    HG   LEU 102           HG       LEU 102   1.278  10.831  -4.336
  758    HB2  LEU 102           HB2      LEU 102   3.468  10.112  -3.463
  759    HB3  LEU 102           HB3      LEU 102   4.039  11.766  -3.541
  760   HD11  LEU 102          HD11      LEU 102   0.551  12.038  -2.337
  761   HD12  LEU 102          HD12      LEU 102   2.232  12.392  -1.940
  762   HD13  LEU 102          HD13      LEU 102   1.657  10.724  -1.930
  763   HD21  LEU 102          HD21      LEU 102   0.754  13.198  -4.533
  764   HD22  LEU 102          HD22      LEU 102   2.056  12.762  -5.640
  765   HD23  LEU 102          HD23      LEU 102   2.420  13.617  -4.141
  766    H    GLU 103           H        GLU 103   5.556  10.668  -7.322
  767    HA   GLU 103           HA       GLU 103   7.181   8.596  -6.224
  768    HB2  GLU 103           HB2      GLU 103   6.738   8.986  -8.682
  769    HB3  GLU 103           HB3      GLU 103   7.839  10.353  -8.589
  770    HG2  GLU 103           HG2      GLU 103   9.628   8.832  -7.860
  771    HG3  GLU 103           HG3      GLU 103   8.517   7.475  -8.036
  772    H    HIS 104           H        HIS 104   7.395  12.083  -6.462
  773    HA   HIS 104           HA       HIS 104  10.060  12.236  -5.413
  774    HD1  HIS 104           HD1      HIS 104  11.635  14.390  -6.287
  775    HD2  HIS 104           HD2      HIS 104   8.125  14.525  -8.519
  776    HE1  HIS 104           HE1      HIS 104  12.345  14.950  -8.638
  777    HE2  HIS 104           HE2      HIS 104  10.186  15.260  -9.897
  778    HB2  HIS 104           HB2      HIS 104   7.873  14.258  -5.826
  779    HB3  HIS 104           HB3      HIS 104   9.318  14.670  -4.914
  780    H    HIS 105           H        HIS 105  10.452  11.427  -3.462
  781    HA   HIS 105           HA       HIS 105   8.663  12.240  -1.272
  782    HD1  HIS 105           HD1      HIS 105  10.926   8.807   0.509
  783    HD2  HIS 105           HD2      HIS 105  10.518   8.932  -3.634
  784    HE1  HIS 105           HE1      HIS 105  12.687   7.254  -0.399
  785    HE2  HIS 105           HE2      HIS 105  12.328   7.225  -2.892
  786    HB2  HIS 105           HB2      HIS 105   8.949  10.102  -0.186
  787    HB3  HIS 105           HB3      HIS 105   8.356   9.838  -1.817
  788    H    HIS 106           H        HIS 106  11.158  13.354  -2.364
  789    HA   HIS 106           HA       HIS 106  12.594  13.473   0.189
  790    HD1  HIS 106           HD1      HIS 106  15.947  14.363  -2.992
  791    HD2  HIS 106           HD2      HIS 106  15.171  14.072   1.086
  792    HE1  HIS 106           HE1      HIS 106  17.804  15.621  -1.854
  793    HE2  HIS 106           HE2      HIS 106  17.202  15.602   0.591
  794    HB2  HIS 106           HB2      HIS 106  14.054  12.137  -1.146
  795    HB3  HIS 106           HB3      HIS 106  13.832  13.174  -2.552
  796    H    HIS 107           H        HIS 107  11.770  15.404   0.794
  797    HA   HIS 107           HA       HIS 107  11.739  17.657  -1.003
  798    HD1  HIS 107           HD1      HIS 107   9.311  19.525  -0.496
  799    HD2  HIS 107           HD2      HIS 107  12.205  20.200   2.416
  800    HE1  HIS 107           HE1      HIS 107   9.405  22.025  -0.191
  801    HE2  HIS 107           HE2      HIS 107  11.252  22.414   1.477
  802    HB2  HIS 107           HB2      HIS 107  10.045  17.404   0.797
  803    HB3  HIS 107           HB3      HIS 107  11.322  17.585   1.996
  804    H    HIS 108           H        HIS 108  13.656  18.422  -1.610
  805    HA   HIS 108           HA       HIS 108  15.858  18.589   0.284
  806    HD1  HIS 108           HD1      HIS 108  16.641  21.508  -2.837
  807    HD2  HIS 108           HD2      HIS 108  14.329  18.260  -4.020
  808    HE1  HIS 108           HE1      HIS 108  15.498  22.227  -4.951
  809    HE2  HIS 108           HE2      HIS 108  13.899  20.353  -5.473
  810    HB2  HIS 108           HB2      HIS 108  17.211  19.303  -1.613
  811    HB3  HIS 108           HB3      HIS 108  16.299  17.866  -2.052
  812    H    HIS 109           H        HIS 109  17.163  20.762   0.005
  813    HA   HIS 109           HA       HIS 109  15.577  22.880   1.014
  814    HD1  HIS 109           HD1      HIS 109  18.673  25.094  -1.145
  815    HD2  HIS 109           HD2      HIS 109  16.956  25.266   2.644
  816    HE1  HIS 109           HE1      HIS 109  18.649  27.532  -0.515
  817    HE2  HIS 109           HE2      HIS 109  17.526  27.627   1.742
  818    HB2  HIS 109           HB2      HIS 109  17.907  22.765   1.615
  819    HB3  HIS 109           HB3      HIS 109  18.398  22.817  -0.075
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1  19.176 -42.167  -2.451
    2    H1   MET   1           H1       MET   1  19.954 -44.098  -1.272
    3    H2   MET   1           H2       MET   1  20.512 -43.134   0.006
    4    H3   MET   1           H3       MET   1  21.231 -43.008  -1.521
    5    HB2  MET   1           HB2      MET   1  18.252 -42.329   0.425
    6    HB3  MET   1           HB3      MET   1  17.397 -41.458  -0.842
    7    HG2  MET   1           HG2      MET   1  17.958 -44.413  -0.813
    8    HG3  MET   1           HG3      MET   1  16.415 -43.647  -0.432
    9    HE1  MET   1           HE1      MET   1  15.278 -45.285  -2.203
   10    HE2  MET   1           HE2      MET   1  16.837 -45.983  -2.640
   11    HE3  MET   1           HE3      MET   1  15.754 -45.384  -3.896
   12    H    ALA   2           H        ALA   2  20.259 -40.397  -3.036
   13    HA   ALA   2           HA       ALA   2  21.161 -38.554  -0.911
   14    HB1  ALA   2           HB1      ALA   2  22.328 -38.965  -3.659
   15    HB2  ALA   2           HB2      ALA   2  22.996 -39.576  -2.146
   16    HB3  ALA   2           HB3      ALA   2  22.920 -37.839  -2.436
   17    H    MET   3           H        MET   3  18.613 -38.774  -2.776
   18    HA   MET   3           HA       MET   3  18.686 -36.170  -4.037
   19    HB2  MET   3           HB2      MET   3  17.382 -38.055  -5.007
   20    HB3  MET   3           HB3      MET   3  16.322 -38.003  -3.605
   21    HG2  MET   3           HG2      MET   3  15.284 -36.867  -5.450
   22    HG3  MET   3           HG3      MET   3  15.692 -35.702  -4.190
   23    HE1  MET   3           HE1      MET   3  15.427 -33.645  -5.860
   24    HE2  MET   3           HE2      MET   3  14.922 -34.792  -7.100
   25    HE3  MET   3           HE3      MET   3  16.170 -33.598  -7.459
   26    H    LYS   4           H        LYS   4  19.279 -35.058  -2.075
   27    HA   LYS   4           HA       LYS   4  16.936 -34.109  -0.629
   28    HB2  LYS   4           HB2      LYS   4  19.332 -35.383   0.678
   29    HB3  LYS   4           HB3      LYS   4  18.355 -34.200   1.530
   30    HG2  LYS   4           HG2      LYS   4  16.406 -35.614   1.335
   31    HG3  LYS   4           HG3      LYS   4  17.318 -36.779   0.375
   32    HD2  LYS   4           HD2      LYS   4  17.084 -37.473   2.726
   33    HD3  LYS   4           HD3      LYS   4  18.769 -37.247   2.259
   34    HE2  LYS   4           HE2      LYS   4  18.413 -36.305   4.447
   35    HE3  LYS   4           HE3      LYS   4  18.718 -35.004   3.299
   36    HZ1  LYS   4           HZ1      LYS   4  16.034 -35.834   4.273
   37    HZ2  LYS   4           HZ2      LYS   4  16.353 -34.549   3.214
   38    HZ3  LYS   4           HZ3      LYS   4  16.901 -34.488   4.821
   39    H    ASP   5           H        ASP   5  17.859 -32.564  -2.439
   40    HA   ASP   5           HA       ASP   5  19.292 -30.500  -0.956
   41    HB2  ASP   5           HB2      ASP   5  20.811 -29.990  -2.764
   42    HB3  ASP   5           HB3      ASP   5  20.996 -31.689  -2.349
   43    H    VAL   6           H        VAL   6  18.737 -28.428  -1.514
   44    HA   VAL   6           HA       VAL   6  16.771 -28.063  -3.664
   45    HB   VAL   6           HB       VAL   6  15.501 -26.511  -2.138
   46   HG11  VAL   6          HG11      VAL   6  14.593 -28.660  -2.763
   47   HG12  VAL   6          HG12      VAL   6  14.214 -28.325  -1.073
   48   HG13  VAL   6          HG13      VAL   6  15.510 -29.448  -1.480
   49   HG21  VAL   6          HG21      VAL   6  17.170 -26.268  -0.379
   50   HG22  VAL   6          HG22      VAL   6  17.025 -27.983   0.006
   51   HG23  VAL   6          HG23      VAL   6  15.659 -26.900   0.276
   52    H    VAL   7           H        VAL   7  19.344 -27.414  -3.948
   53    HA   VAL   7           HA       VAL   7  19.779 -24.681  -3.087
   54    HB   VAL   7           HB       VAL   7  21.681 -26.087  -2.828
   55   HG11  VAL   7          HG11      VAL   7  22.771 -27.225  -4.726
   56   HG12  VAL   7          HG12      VAL   7  21.409 -26.768  -5.750
   57   HG13  VAL   7          HG13      VAL   7  21.160 -27.852  -4.382
   58   HG21  VAL   7          HG21      VAL   7  22.185 -23.818  -3.517
   59   HG22  VAL   7          HG22      VAL   7  22.085 -24.286  -5.214
   60   HG23  VAL   7          HG23      VAL   7  23.369 -24.937  -4.197
   61    H    ASP   8           H        ASP   8  18.577 -23.294  -4.230
   62    HA   ASP   8           HA       ASP   8  19.524 -22.690  -6.861
   63    HB2  ASP   8           HB2      ASP   8  17.435 -22.746  -8.057
   64    HB3  ASP   8           HB3      ASP   8  17.707 -24.332  -7.358
   65    H    LYS   9           H        LYS   9  20.062 -20.672  -6.541
   66    HA   LYS   9           HA       LYS   9  18.102 -18.685  -5.981
   67    HB2  LYS   9           HB2      LYS   9  18.527 -19.580  -3.688
   68    HB3  LYS   9           HB3      LYS   9  20.212 -19.106  -3.854
   69    HG2  LYS   9           HG2      LYS   9  19.537 -16.768  -4.056
   70    HG3  LYS   9           HG3      LYS   9  17.844 -17.245  -3.901
   71    HD2  LYS   9           HD2      LYS   9  18.307 -18.156  -1.676
   72    HD3  LYS   9           HD3      LYS   9  19.998 -17.676  -1.831
   73    HE2  LYS   9           HE2      LYS   9  19.304 -15.332  -2.006
   74    HE3  LYS   9           HE3      LYS   9  17.620 -15.823  -1.830
   75    HZ1  LYS   9           HZ1      LYS   9  19.740 -16.276   0.200
   76    HZ2  LYS   9           HZ2      LYS   9  18.095 -16.647   0.369
   77    HZ3  LYS   9           HZ3      LYS   9  18.594 -15.029   0.255
   78    H    CYS  10           H        CYS  10  18.950 -17.991  -7.968
   79    HA   CYS  10           HA       CYS  10  21.693 -16.940  -7.897
   80    HG   CYS  10           HG       CYS  10  23.012 -17.256 -11.083
   81    HB2  CYS  10           HB2      CYS  10  21.148 -18.438  -9.780
   82    HB3  CYS  10           HB3      CYS  10  19.837 -17.362 -10.253
   83    H    SER  11           H        SER  11  18.362 -16.071  -8.697
   84    HA   SER  11           HA       SER  11  19.021 -13.260  -8.887
   85    HG   SER  11           HG       SER  11  16.784 -14.019 -11.303
   86    HB2  SER  11           HB2      SER  11  16.299 -14.588  -8.894
   87    HB3  SER  11           HB3      SER  11  16.684 -12.958  -9.450
   88    H    THR  12           H        THR  12  19.603 -12.441  -6.958
   89    HA   THR  12           HA       THR  12  17.738 -12.808  -4.710
   90    HB   THR  12           HB       THR  12  19.896 -13.898  -4.283
   91    HG1  THR  12           HG1      THR  12  19.340 -11.547  -2.780
   92   HG21  THR  12          HG21      THR  12  21.944 -12.555  -4.032
   93   HG22  THR  12          HG22      THR  12  21.077 -11.137  -4.622
   94   HG23  THR  12          HG23      THR  12  21.338 -12.516  -5.688
   95    H    LYS  13           H        LYS  13  18.418 -10.692  -6.980
   96    HA   LYS  13           HA       LYS  13  17.931  -8.401  -5.247
   97    HB2  LYS  13           HB2      LYS  13  19.553  -7.024  -6.548
   98    HB3  LYS  13           HB3      LYS  13  20.305  -8.267  -5.560
   99    HG2  LYS  13           HG2      LYS  13  20.698  -9.642  -7.482
  100    HG3  LYS  13           HG3      LYS  13  19.777  -8.543  -8.510
  101    HD2  LYS  13           HD2      LYS  13  22.176  -8.211  -8.796
  102    HD3  LYS  13           HD3      LYS  13  21.418  -6.779  -8.099
  103    HE2  LYS  13           HE2      LYS  13  22.150  -7.526  -5.860
  104    HE3  LYS  13           HE3      LYS  13  22.971  -8.892  -6.609
  105    HZ1  LYS  13           HZ1      LYS  13  24.379  -7.358  -7.816
  106    HZ2  LYS  13           HZ2      LYS  13  24.489  -7.070  -6.147
  107    HZ3  LYS  13           HZ3      LYS  13  23.574  -6.032  -7.125
  108    H    GLY  14           H        GLY  14  16.319  -7.211  -5.967
  109    HA2  GLY  14           HA2      GLY  14  15.881  -6.768  -8.781
  110    HA3  GLY  14           HA3      GLY  14  14.662  -7.791  -8.037
  111    H    CYS  15           H        CYS  15  14.632  -6.528  -5.488
  112    HA   CYS  15           HA       CYS  15  12.957  -4.273  -6.168
  113    HG   CYS  15           HG       CYS  15  12.538  -3.369  -2.355
  114    HB2  CYS  15           HB2      CYS  15  12.253  -5.919  -4.457
  115    HB3  CYS  15           HB3      CYS  15  13.622  -5.445  -3.456
  116    H    ALA  16           H        ALA  16  14.567  -2.850  -6.975
  117    HA   ALA  16           HA       ALA  16  16.657  -1.930  -5.195
  118    HB1  ALA  16           HB1      ALA  16  17.064  -2.132  -7.608
  119    HB2  ALA  16           HB2      ALA  16  17.314  -0.481  -7.035
  120    HB3  ALA  16           HB3      ALA  16  15.840  -0.898  -7.909
  121    H    ILE  17           H        ILE  17  13.416  -1.165  -5.792
  122    HA   ILE  17           HA       ILE  17  13.586   1.636  -5.194
  123    HB   ILE  17           HB       ILE  17  11.810   0.946  -6.641
  124   HG12  ILE  17          HG12      ILE  17  10.650   1.667  -3.940
  125   HG13  ILE  17          HG13      ILE  17  11.327   2.807  -5.097
  126   HG21  ILE  17          HG21      ILE  17  11.594  -1.371  -5.899
  127   HG22  ILE  17          HG22      ILE  17  10.025  -0.569  -5.959
  128   HG23  ILE  17          HG23      ILE  17  10.826  -0.823  -4.409
  129   HD11  ILE  17          HD11      ILE  17   8.897   1.087  -5.534
  130   HD12  ILE  17          HD12      ILE  17   9.577   2.231  -6.692
  131   HD13  ILE  17          HD13      ILE  17   8.905   2.813  -5.169
  132    H    ASP  18           H        ASP  18  13.640   2.535  -3.278
  133    HA   ASP  18           HA       ASP  18  12.289   1.321  -1.004
  134    HB2  ASP  18           HB2      ASP  18  14.574   0.473  -0.779
  135    HB3  ASP  18           HB3      ASP  18  15.217   2.102  -0.953
  136    H    ILE  19           H        ILE  19  11.240   2.849   0.120
  137    HA   ILE  19           HA       ILE  19  11.526   5.577  -0.894
  138    HB   ILE  19           HB       ILE  19   9.294   4.411   0.775
  139   HG12  ILE  19          HG12      ILE  19   9.339   3.207  -1.307
  140   HG13  ILE  19          HG13      ILE  19   8.037   4.384  -1.397
  141   HG21  ILE  19          HG21      ILE  19   9.419   6.825   0.926
  142   HG22  ILE  19          HG22      ILE  19   8.019   6.354  -0.037
  143   HG23  ILE  19          HG23      ILE  19   9.472   6.957  -0.832
  144   HD11  ILE  19          HD11      ILE  19  10.761   4.689  -2.634
  145   HD12  ILE  19          HD12      ILE  19   9.446   5.862  -2.727
  146   HD13  ILE  19          HD13      ILE  19   9.272   4.278  -3.484
  147    H    GLY  20           H        GLY  20  11.439   3.784   2.162
  148    HA2  GLY  20           HA2      GLY  20  12.375   4.389   4.203
  149    HA3  GLY  20           HA3      GLY  20  12.871   5.919   3.492
  150    H    THR  21           H        THR  21  10.360   4.215   5.178
  151    HA   THR  21           HA       THR  21   9.197   6.722   6.050
  152    HB   THR  21           HB       THR  21   7.453   4.694   4.622
  153    HG1  THR  21           HG1      THR  21   8.936   6.717   3.649
  154   HG21  THR  21          HG21      THR  21   6.819   7.404   5.805
  155   HG22  THR  21          HG22      THR  21   6.292   5.843   6.432
  156   HG23  THR  21          HG23      THR  21   5.701   6.409   4.871
  157    H    VAL  22           H        VAL  22   8.526   6.541   8.109
  158    HA   VAL  22           HA       VAL  22   8.784   3.961   9.402
  159    HB   VAL  22           HB       VAL  22   8.096   6.652  10.593
  160   HG11  VAL  22          HG11      VAL  22   8.690   5.637  12.735
  161   HG12  VAL  22          HG12      VAL  22   8.985   4.096  11.931
  162   HG13  VAL  22          HG13      VAL  22   7.355   4.767  11.977
  163   HG21  VAL  22          HG21      VAL  22  10.306   6.683   9.579
  164   HG22  VAL  22          HG22      VAL  22  10.740   5.202  10.434
  165   HG23  VAL  22          HG23      VAL  22  10.442   6.688  11.337
  166    H    ILE  23           H        ILE  23   7.136   2.617   9.503
  167    HA   ILE  23           HA       ILE  23   4.458   3.469   8.945
  168    HB   ILE  23           HB       ILE  23   3.868   1.105   9.244
  169   HG12  ILE  23          HG12      ILE  23   6.801   0.686   9.844
  170   HG13  ILE  23          HG13      ILE  23   5.521   0.631  11.051
  171   HG21  ILE  23          HG21      ILE  23   5.147   0.238   7.352
  172   HG22  ILE  23          HG22      ILE  23   6.309   1.551   7.537
  173   HG23  ILE  23          HG23      ILE  23   4.642   1.906   7.082
  174   HD11  ILE  23          HD11      ILE  23   4.523  -1.273   9.905
  175   HD12  ILE  23          HD12      ILE  23   6.195  -1.597  10.367
  176   HD13  ILE  23          HD13      ILE  23   5.801  -1.213   8.691
  177    H    ASP  24           H        ASP  24   2.633   3.139  10.301
  178    HA   ASP  24           HA       ASP  24   3.100   3.649  13.102
  179    HB2  ASP  24           HB2      ASP  24   1.262   4.740  11.858
  180    HB3  ASP  24           HB3      ASP  24   0.515   3.170  11.595
  181    H    ASN  25           H        ASN  25   3.032   0.963  11.207
  182    HA   ASN  25           HA       ASN  25   3.046  -1.262  11.553
  183    HB2  ASN  25           HB2      ASN  25   4.315  -0.665  13.646
  184    HB3  ASN  25           HB3      ASN  25   2.782  -0.722  14.512
  185   HD21  ASN  25          HD21      ASN  25   3.752  -2.833  11.876
  186   HD22  ASN  25          HD22      ASN  25   3.797  -4.280  12.811
  187    H    ASP  26           H        ASP  26   1.127  -1.436  10.489
  188    HA   ASP  26           HA       ASP  26  -1.352  -1.411  12.026
  189    HB2  ASP  26           HB2      ASP  26  -0.940  -1.679   9.035
  190    HB3  ASP  26           HB3      ASP  26  -2.464  -1.371   9.861
  191    H    ASN  27           H        ASN  27  -2.601  -3.169   9.995
  192    HA   ASN  27           HA       ASN  27  -1.827  -5.720  11.208
  193    HB2  ASN  27           HB2      ASN  27  -4.261  -4.934   9.585
  194    HB3  ASN  27           HB3      ASN  27  -3.982  -6.536  10.264
  195   HD21  ASN  27          HD21      ASN  27  -4.796  -3.235  10.935
  196   HD22  ASN  27          HD22      ASN  27  -5.319  -3.487  12.568
  197    H    CYS  28           H        CYS  28  -2.703  -7.514   9.274
  198    HA   CYS  28           HA       CYS  28  -0.781  -7.034   7.113
  199    HG   CYS  28           HG       CYS  28  -2.840 -11.076   7.406
  200    HB2  CYS  28           HB2      CYS  28  -1.007  -9.466   6.636
  201    HB3  CYS  28           HB3      CYS  28  -0.422  -9.130   8.258
  202    H    THR  29           H        THR  29  -4.096  -7.070   7.797
  203    HA   THR  29           HA       THR  29  -4.808  -7.154   4.956
  204    HB   THR  29           HB       THR  29  -6.657  -6.822   7.334
  205    HG1  THR  29           HG1      THR  29  -5.234  -8.920   6.812
  206   HG21  THR  29          HG21      THR  29  -8.385  -7.577   5.788
  207   HG22  THR  29          HG22      THR  29  -7.190  -7.740   4.501
  208   HG23  THR  29          HG23      THR  29  -7.578  -6.145   5.149
  209    H    SER  30           H        SER  30  -5.080  -5.300   3.833
  210    HA   SER  30           HA       SER  30  -5.365  -2.805   5.372
  211    HG   SER  30           HG       SER  30  -2.926  -1.042   3.502
  212    HB2  SER  30           HB2      SER  30  -3.020  -3.164   4.492
  213    HB3  SER  30           HB3      SER  30  -3.693  -3.083   2.865
  214    H    LYS  31           H        LYS  31  -7.192  -1.805   4.852
  215    HA   LYS  31           HA       LYS  31  -8.268  -2.136   2.148
  216    HB2  LYS  31           HB2      LYS  31  -9.460  -1.301   4.749
  217    HB3  LYS  31           HB3      LYS  31 -10.157  -0.658   3.269
  218    HG2  LYS  31           HG2      LYS  31 -11.407  -2.561   3.787
  219    HG3  LYS  31           HG3      LYS  31 -10.336  -3.045   2.473
  220    HD2  LYS  31           HD2      LYS  31 -10.327  -4.787   4.073
  221    HD3  LYS  31           HD3      LYS  31  -8.780  -3.958   4.210
  222    HE2  LYS  31           HE2      LYS  31  -9.754  -4.461   6.412
  223    HE3  LYS  31           HE3      LYS  31  -9.572  -2.728   6.138
  224    HZ1  LYS  31           HZ1      LYS  31 -11.950  -2.662   5.518
  225    HZ2  LYS  31           HZ2      LYS  31 -11.695  -3.150   7.121
  226    HZ3  LYS  31           HZ3      LYS  31 -12.083  -4.302   5.936
  227    H    PHE  32           H        PHE  32  -8.835  -0.361   0.907
  228    HA   PHE  32           HA       PHE  32  -7.768   2.229   1.792
  229    HD1  PHE  32           HD2      PHE  32  -5.373   3.348   1.187
  230    HD2  PHE  32           HD1      PHE  32  -7.676   2.961  -2.374
  231    HE1  PHE  32           HE2      PHE  32  -4.675   5.603   0.496
  232    HE2  PHE  32           HE1      PHE  32  -6.982   5.218  -3.069
  233    HZ   PHE  32           HZ       PHE  32  -5.482   6.539  -1.637
  234    HB2  PHE  32           HB2      PHE  32  -6.125   1.113   0.263
  235    HB3  PHE  32           HB3      PHE  32  -7.360   1.101  -0.991
  236    H    SER  33           H        SER  33  -9.392   3.596   1.813
  237    HA   SER  33           HA       SER  33 -11.590   3.220  -0.104
  238    HG   SER  33           HG       SER  33 -11.954   2.003   1.996
  239    HB2  SER  33           HB2      SER  33 -11.706   4.757   2.500
  240    HB3  SER  33           HB3      SER  33 -13.058   4.224   1.501
  241    H    ARG  34           H        ARG  34 -11.453   4.580  -1.755
  242    HA   ARG  34           HA       ARG  34 -10.762   7.380  -1.180
  243    HE   ARG  34           HE       ARG  34  -8.149   9.542  -5.155
  244    HB2  ARG  34           HB2      ARG  34  -8.829   6.161  -2.200
  245    HB3  ARG  34           HB3      ARG  34  -9.828   5.842  -3.610
  246    HG2  ARG  34           HG2      ARG  34  -9.950   8.168  -4.137
  247    HG3  ARG  34           HG3      ARG  34  -9.163   8.604  -2.617
  248    HD2  ARG  34           HD2      ARG  34  -7.130   7.464  -3.339
  249    HD3  ARG  34           HD3      ARG  34  -7.919   7.001  -4.848
  250   HH11  ARG  34          HH11      ARG  34  -5.476   7.975  -3.522
  251   HH12  ARG  34          HH12      ARG  34  -4.326   9.201  -3.935
  252   HH21  ARG  34          HH21      ARG  34  -6.637  11.161  -5.724
  253   HH22  ARG  34          HH22      ARG  34  -4.980  11.014  -5.218
  254    H    PHE  35           H        PHE  35 -11.948   8.891  -2.316
  255    HA   PHE  35           HA       PHE  35 -14.375   7.796  -3.509
  256    HD1  PHE  35           HD2      PHE  35 -16.690   8.563  -1.931
  257    HD2  PHE  35           HD1      PHE  35 -13.049  10.118  -0.371
  258    HE1  PHE  35           HE2      PHE  35 -17.397   7.932   0.338
  259    HE2  PHE  35           HE1      PHE  35 -13.750   9.493   1.902
  260    HZ   PHE  35           HZ       PHE  35 -15.926   8.398   2.258
  261    HB2  PHE  35           HB2      PHE  35 -13.711  10.607  -2.608
  262    HB3  PHE  35           HB3      PHE  35 -15.272  10.090  -3.238
  263    H    PHE  36           H        PHE  36 -15.058   8.208  -5.547
  264    HA   PHE  36           HA       PHE  36 -13.333   9.830  -7.284
  265    HD1  PHE  36           HD1      PHE  36 -11.227   8.756  -8.795
  266    HD2  PHE  36           HD2      PHE  36 -13.086   5.748  -6.431
  267    HE1  PHE  36           HE1      PHE  36  -9.014   7.877  -8.182
  268    HE2  PHE  36           HE2      PHE  36 -10.874   4.865  -5.812
  269    HZ   PHE  36           HZ       PHE  36  -8.837   5.928  -6.689
  270    HB2  PHE  36           HB2      PHE  36 -14.374   7.053  -7.902
  271    HB3  PHE  36           HB3      PHE  36 -13.620   8.117  -9.082
  272    H    ALA  37           H        ALA  37 -14.575   9.893  -9.566
  273    HA   ALA  37           HA       ALA  37 -17.019  11.259  -9.014
  274    HB1  ALA  37           HB1      ALA  37 -17.117  11.650 -11.416
  275    HB2  ALA  37           HB2      ALA  37 -15.823  10.478 -11.674
  276    HB3  ALA  37           HB3      ALA  37 -15.496  11.974 -10.799
  277    H    THR  38           H        THR  38 -16.325   8.388 -11.027
  278    HA   THR  38           HA       THR  38 -18.986   7.369 -10.309
  279    HB   THR  38           HB       THR  38 -19.102   6.398 -12.643
  280    HG1  THR  38           HG1      THR  38 -17.794   7.973 -14.094
  281   HG21  THR  38          HG21      THR  38 -20.471   8.312 -11.962
  282   HG22  THR  38          HG22      THR  38 -19.967   8.457 -13.646
  283   HG23  THR  38          HG23      THR  38 -19.161   9.410 -12.399
  284    H    ARG  39           H        ARG  39 -19.179   4.984 -10.926
  285    HA   ARG  39           HA       ARG  39 -17.151   3.558  -9.590
  286    HE   ARG  39           HE       ARG  39 -21.393   2.182 -10.340
  287    HB2  ARG  39           HB2      ARG  39 -18.453   1.652  -9.929
  288    HB3  ARG  39           HB3      ARG  39 -19.630   2.950  -9.956
  289    HG2  ARG  39           HG2      ARG  39 -19.708   2.895 -12.369
  290    HG3  ARG  39           HG3      ARG  39 -18.451   1.656 -12.403
  291    HD2  ARG  39           HD2      ARG  39 -20.646   0.658 -12.703
  292    HD3  ARG  39           HD3      ARG  39 -19.927   0.131 -11.182
  293   HH11  ARG  39          HH11      ARG  39 -22.222  -0.437 -12.537
  294   HH12  ARG  39          HH12      ARG  39 -23.908  -0.407 -12.120
  295   HH21  ARG  39          HH21      ARG  39 -23.583   2.208  -9.805
  296   HH22  ARG  39          HH22      ARG  39 -24.678   1.090 -10.554
  297    H    GLU  40           H        GLU  40 -17.571   4.455 -12.892
  298    HA   GLU  40           HA       GLU  40 -15.847   2.618 -14.149
  299    HB2  GLU  40           HB2      GLU  40 -16.392   5.508 -14.861
  300    HB3  GLU  40           HB3      GLU  40 -15.698   4.296 -15.923
  301    HG2  GLU  40           HG2      GLU  40 -17.752   3.036 -15.891
  302    HG3  GLU  40           HG3      GLU  40 -18.455   4.168 -14.736
  303    H    GLU  41           H        GLU  41 -15.336   5.823 -12.793
  304    HA   GLU  41           HA       GLU  41 -12.582   6.055 -13.252
  305    HB2  GLU  41           HB2      GLU  41 -14.174   7.211 -10.953
  306    HB3  GLU  41           HB3      GLU  41 -12.637   7.804 -11.555
  307    HG2  GLU  41           HG2      GLU  41 -15.263   7.822 -13.014
  308    HG3  GLU  41           HG3      GLU  41 -14.429   9.214 -12.327
  309    H    ALA  42           H        ALA  42 -14.411   4.337 -10.883
  310    HA   ALA  42           HA       ALA  42 -12.278   3.947  -9.006
  311    HB1  ALA  42           HB1      ALA  42 -13.796   2.402  -7.898
  312    HB2  ALA  42           HB2      ALA  42 -14.879   2.446  -9.290
  313    HB3  ALA  42           HB3      ALA  42 -14.632   3.897  -8.320
  314    H    GLU  43           H        GLU  43 -13.701   2.055 -11.632
  315    HA   GLU  43           HA       GLU  43 -12.284  -0.334 -11.258
  316    HB2  GLU  43           HB2      GLU  43 -13.232   0.910 -13.850
  317    HB3  GLU  43           HB3      GLU  43 -12.748  -0.766 -13.644
  318    HG2  GLU  43           HG2      GLU  43 -15.007   0.473 -12.106
  319    HG3  GLU  43           HG3      GLU  43 -15.223  -0.303 -13.672
  320    H    SER  44           H        SER  44 -11.479   2.594 -13.068
  321    HA   SER  44           HA       SER  44  -9.116   1.689 -14.250
  322    HG   SER  44           HG       SER  44 -10.897   4.678 -15.248
  323    HB2  SER  44           HB2      SER  44  -9.783   4.511 -13.393
  324    HB3  SER  44           HB3      SER  44  -8.605   4.038 -14.620
  325    H    PHE  45           H        PHE  45  -9.758   2.815 -11.002
  326    HA   PHE  45           HA       PHE  45  -7.019   3.287 -10.329
  327    HD1  PHE  45           HD2      PHE  45  -6.632   5.267  -8.736
  328    HD2  PHE  45           HD1      PHE  45  -8.373   2.153  -6.418
  329    HE1  PHE  45           HE2      PHE  45  -5.089   5.783  -6.894
  330    HE2  PHE  45           HE1      PHE  45  -6.833   2.666  -4.567
  331    HZ   PHE  45           HZ       PHE  45  -5.188   4.486  -4.805
  332    HB2  PHE  45           HB2      PHE  45  -9.005   4.296  -9.142
  333    HB3  PHE  45           HB3      PHE  45  -9.317   2.709  -8.451
  334    H    MET  46           H        MET  46  -9.260   0.602 -10.099
  335    HA   MET  46           HA       MET  46  -7.659  -1.124  -8.542
  336    HB2  MET  46           HB2      MET  46 -10.046  -1.499  -8.854
  337    HB3  MET  46           HB3      MET  46  -9.806  -1.742 -10.577
  338    HG2  MET  46           HG2      MET  46 -10.029  -3.891  -9.790
  339    HG3  MET  46           HG3      MET  46  -8.282  -3.694  -9.862
  340    HE1  MET  46           HE1      MET  46  -6.708  -3.598  -7.726
  341    HE2  MET  46           HE2      MET  46  -7.311  -3.342  -6.089
  342    HE3  MET  46           HE3      MET  46  -7.492  -2.074  -7.303
  343    H    THR  47           H        THR  47  -7.695  -0.358 -11.943
  344    HA   THR  47           HA       THR  47  -6.400  -2.579 -13.008
  345    HB   THR  47           HB       THR  47  -6.029   0.269 -13.949
  346    HG1  THR  47           HG1      THR  47  -8.259  -1.352 -13.847
  347   HG21  THR  47          HG21      THR  47  -6.038  -2.359 -15.444
  348   HG22  THR  47          HG22      THR  47  -4.605  -1.406 -15.054
  349   HG23  THR  47          HG23      THR  47  -5.823  -0.762 -16.156
  350    H    LYS  48           H        LYS  48  -4.922   0.489 -11.908
  351    HA   LYS  48           HA       LYS  48  -2.280  -0.500 -12.310
  352    HB2  LYS  48           HB2      LYS  48  -1.544   1.571 -11.207
  353    HB3  LYS  48           HB3      LYS  48  -2.662   1.853 -12.531
  354    HG2  LYS  48           HG2      LYS  48  -4.481   2.075 -10.848
  355    HG3  LYS  48           HG3      LYS  48  -3.245   1.987  -9.589
  356    HD2  LYS  48           HD2      LYS  48  -3.341   4.024 -11.811
  357    HD3  LYS  48           HD3      LYS  48  -3.833   4.296 -10.142
  358    HE2  LYS  48           HE2      LYS  48  -1.618   4.007  -9.346
  359    HE3  LYS  48           HE3      LYS  48  -1.074   3.385 -10.904
  360    HZ1  LYS  48           HZ1      LYS  48  -1.967   6.165 -10.348
  361    HZ2  LYS  48           HZ2      LYS  48  -1.486   5.570 -11.867
  362    HZ3  LYS  48           HZ3      LYS  48  -0.370   5.659 -10.600
  363    H    LEU  49           H        LEU  49  -4.503  -0.466  -9.653
  364    HA   LEU  49           HA       LEU  49  -2.619  -1.029  -7.596
  365    HG   LEU  49           HG       LEU  49  -5.594   0.231  -5.862
  366    HB2  LEU  49           HB2      LEU  49  -5.562  -1.018  -7.885
  367    HB3  LEU  49           HB3      LEU  49  -4.920  -2.050  -6.623
  368   HD11  LEU  49          HD11      LEU  49  -2.683  -0.467  -5.553
  369   HD12  LEU  49          HD12      LEU  49  -4.014  -1.137  -4.610
  370   HD13  LEU  49          HD13      LEU  49  -3.620   0.578  -4.485
  371   HD21  LEU  49          HD21      LEU  49  -4.102   2.104  -6.356
  372   HD22  LEU  49          HD22      LEU  49  -4.886   1.502  -7.816
  373   HD23  LEU  49          HD23      LEU  49  -3.204   1.090  -7.485
  374    H    LYS  50           H        LYS  50  -4.321  -2.992  -9.937
  375    HA   LYS  50           HA       LYS  50  -3.918  -5.515  -8.763
  376    HB2  LYS  50           HB2      LYS  50  -4.856  -4.513 -11.265
  377    HB3  LYS  50           HB3      LYS  50  -3.644  -5.744 -11.595
  378    HG2  LYS  50           HG2      LYS  50  -5.790  -6.787 -11.528
  379    HG3  LYS  50           HG3      LYS  50  -4.884  -7.288 -10.099
  380    HD2  LYS  50           HD2      LYS  50  -6.069  -5.441  -8.852
  381    HD3  LYS  50           HD3      LYS  50  -7.106  -5.263 -10.269
  382    HE2  LYS  50           HE2      LYS  50  -6.764  -7.760  -8.609
  383    HE3  LYS  50           HE3      LYS  50  -8.154  -6.680  -8.578
  384    HZ1  LYS  50           HZ1      LYS  50  -8.670  -7.273 -10.836
  385    HZ2  LYS  50           HZ2      LYS  50  -8.501  -8.696  -9.925
  386    HZ3  LYS  50           HZ3      LYS  50  -7.259  -8.210 -10.965
  387    H    GLU  51           H        GLU  51  -1.904  -3.550 -10.892
  388    HA   GLU  51           HA       GLU  51   0.222  -5.338 -11.237
  389    HB2  GLU  51           HB2      GLU  51   0.230  -2.324 -11.150
  390    HB3  GLU  51           HB3      GLU  51   1.583  -3.308 -11.697
  391    HG2  GLU  51           HG2      GLU  51  -1.147  -3.451 -12.933
  392    HG3  GLU  51           HG3      GLU  51   0.106  -2.345 -13.478
  393    H    LEU  52           H        LEU  52  -0.442  -2.966  -8.724
  394    HA   LEU  52           HA       LEU  52   2.003  -3.196  -7.345
  395    HG   LEU  52           HG       LEU  52   0.168  -0.795  -8.022
  396    HB2  LEU  52           HB2      LEU  52  -0.738  -2.365  -6.392
  397    HB3  LEU  52           HB3      LEU  52   0.712  -2.222  -5.422
  398   HD11  LEU  52          HD11      LEU  52  -1.107   0.092  -6.153
  399   HD12  LEU  52          HD12      LEU  52   0.168   1.212  -6.628
  400   HD13  LEU  52          HD13      LEU  52   0.365   0.213  -5.189
  401   HD21  LEU  52          HD21      LEU  52   2.525  -1.367  -7.798
  402   HD22  LEU  52          HD22      LEU  52   2.553  -0.653  -6.186
  403   HD23  LEU  52          HD23      LEU  52   2.274   0.368  -7.598
  404    H    ALA  53           H        ALA  53  -1.161  -4.728  -6.752
  405    HA   ALA  53           HA       ALA  53  -0.347  -6.221  -4.505
  406    HB1  ALA  53           HB1      ALA  53  -2.572  -6.795  -6.462
  407    HB2  ALA  53           HB2      ALA  53  -2.691  -5.793  -5.013
  408    HB3  ALA  53           HB3      ALA  53  -2.389  -7.526  -4.867
  409    H    ALA  54           H        ALA  54  -0.382  -6.980  -7.953
  410    HA   ALA  54           HA       ALA  54   0.280  -9.714  -7.701
  411    HB1  ALA  54           HB1      ALA  54   0.786  -7.858 -10.022
  412    HB2  ALA  54           HB2      ALA  54  -0.692  -8.779  -9.735
  413    HB3  ALA  54           HB3      ALA  54   0.821  -9.620 -10.074
  414    H    ALA  55           H        ALA  55   2.257  -6.803  -8.000
  415    HA   ALA  55           HA       ALA  55   4.698  -8.298  -8.318
  416    HB1  ALA  55           HB1      ALA  55   4.421  -6.123  -9.387
  417    HB2  ALA  55           HB2      ALA  55   5.801  -6.128  -8.291
  418    HB3  ALA  55           HB3      ALA  55   4.292  -5.357  -7.804
  419    H    ALA  56           H        ALA  56   3.043  -6.636  -5.691
  420    HA   ALA  56           HA       ALA  56   5.208  -6.624  -3.878
  421    HB1  ALA  56           HB1      ALA  56   3.262  -5.163  -3.629
  422    HB2  ALA  56           HB2      ALA  56   3.545  -6.114  -2.172
  423    HB3  ALA  56           HB3      ALA  56   2.253  -6.567  -3.282
  424    H    SER  57           H        SER  57   2.368  -8.773  -4.061
  425    HA   SER  57           HA       SER  57   3.672 -10.532  -2.127
  426    HG   SER  57           HG       SER  57   2.075  -9.190  -1.127
  427    HB2  SER  57           HB2      SER  57   0.840 -10.614  -3.171
  428    HB3  SER  57           HB3      SER  57   1.485 -11.541  -1.817
  429    H    SER  58           H        SER  58   1.943 -10.770  -5.171
  430    HA   SER  58           HA       SER  58   1.961 -12.225  -6.896
  431    HG   SER  58           HG       SER  58   3.922 -10.972  -7.100
  432    HB2  SER  58           HB2      SER  58   4.576 -13.199  -5.714
  433    HB3  SER  58           HB3      SER  58   3.956 -13.624  -7.309
  434    H    ALA  59           H        ALA  59   3.288 -13.975  -4.116
  435    HA   ALA  59           HA       ALA  59   2.820 -15.981  -3.172
  436    HB1  ALA  59           HB1      ALA  59   0.484 -16.563  -2.830
  437    HB2  ALA  59           HB2      ALA  59  -0.004 -15.380  -4.043
  438    HB3  ALA  59           HB3      ALA  59   0.749 -14.844  -2.542
  439    H    ASP  60           H        ASP  60   0.322 -16.274  -5.633
  440    HA   ASP  60           HA       ASP  60   1.907 -17.928  -7.353
  441    HB2  ASP  60           HB2      ASP  60   1.295 -19.527  -5.521
  442    HB3  ASP  60           HB3      ASP  60  -0.403 -19.237  -5.893
  443    H    GLU  61           H        GLU  61  -1.467 -17.438  -6.381
  444    HA   GLU  61           HA       GLU  61  -2.098 -16.760  -9.172
  445    HB2  GLU  61           HB2      GLU  61  -4.442 -17.432  -8.569
  446    HB3  GLU  61           HB3      GLU  61  -3.268 -18.741  -8.558
  447    HG2  GLU  61           HG2      GLU  61  -3.113 -18.569  -6.122
  448    HG3  GLU  61           HG3      GLU  61  -4.317 -17.281  -6.145
  449    H    GLY  62           H        GLY  62  -1.273 -15.147  -6.635
  450    HA2  GLY  62           HA2      GLY  62  -1.607 -12.753  -6.683
  451    HA3  GLY  62           HA3      GLY  62  -3.289 -13.050  -7.086
  452    H    ALA  63           H        ALA  63  -2.907 -11.333  -5.149
  453    HA   ALA  63           HA       ALA  63  -3.081 -12.691  -2.566
  454    HB1  ALA  63           HB1      ALA  63  -3.065  -9.746  -3.214
  455    HB2  ALA  63           HB2      ALA  63  -1.656 -10.696  -2.743
  456    HB3  ALA  63           HB3      ALA  63  -2.982 -10.460  -1.605
  457    H    SER  64           H        SER  64  -4.843 -12.015  -1.088
  458    HA   SER  64           HA       SER  64  -7.373 -12.275  -2.385
  459    HG   SER  64           HG       SER  64  -6.857 -14.024  -0.988
  460    HB2  SER  64           HB2      SER  64  -6.727 -11.663   0.510
  461    HB3  SER  64           HB3      SER  64  -8.299 -12.167  -0.111
  462    H    VAL  65           H        VAL  65  -7.737 -10.525  -3.676
  463    HA   VAL  65           HA       VAL  65  -7.962  -7.931  -2.320
  464    HB   VAL  65           HB       VAL  65  -6.394  -7.766  -4.135
  465   HG11  VAL  65          HG11      VAL  65  -6.994  -8.280  -6.458
  466   HG12  VAL  65          HG12      VAL  65  -8.544  -8.917  -5.908
  467   HG13  VAL  65          HG13      VAL  65  -7.044  -9.712  -5.430
  468   HG21  VAL  65          HG21      VAL  65  -9.038  -6.570  -4.960
  469   HG22  VAL  65          HG22      VAL  65  -7.448  -6.054  -5.525
  470   HG23  VAL  65          HG23      VAL  65  -7.886  -5.864  -3.828
  471    H    ALA  66           H        ALA  66  -9.920  -7.299  -1.876
  472    HA   ALA  66           HA       ALA  66 -12.112  -7.982  -3.713
  473    HB1  ALA  66           HB1      ALA  66 -13.618  -8.319  -1.835
  474    HB2  ALA  66           HB2      ALA  66 -12.304  -8.003  -0.704
  475    HB3  ALA  66           HB3      ALA  66 -12.255  -9.434  -1.732
  476    H    TYR  67           H        TYR  67 -12.331  -6.000  -4.642
  477    HA   TYR  67           HA       TYR  67 -12.438  -3.668  -2.876
  478    HD1  TYR  67           HD2      TYR  67 -11.600  -5.589  -6.478
  479    HD2  TYR  67           HD1      TYR  67 -13.468  -1.767  -6.543
  480    HE1  TYR  67           HE2      TYR  67 -12.422  -6.029  -8.757
  481    HE2  TYR  67           HE1      TYR  67 -14.292  -2.196  -8.817
  482    HH   TYR  67           HH       TYR  67 -13.831  -3.537 -10.714
  483    HB2  TYR  67           HB2      TYR  67 -12.039  -2.298  -4.785
  484    HB3  TYR  67           HB3      TYR  67 -10.925  -3.652  -4.909
  485    H    LYS  68           H        LYS  68 -14.244  -2.481  -2.611
  486    HA   LYS  68           HA       LYS  68 -16.614  -3.341  -4.136
  487    HB2  LYS  68           HB2      LYS  68 -18.004  -2.710  -2.295
  488    HB3  LYS  68           HB3      LYS  68 -16.719  -3.722  -1.653
  489    HG2  LYS  68           HG2      LYS  68 -15.616  -1.888  -0.692
  490    HG3  LYS  68           HG3      LYS  68 -16.571  -0.726  -1.603
  491    HD2  LYS  68           HD2      LYS  68 -18.574  -1.417  -0.370
  492    HD3  LYS  68           HD3      LYS  68 -17.605  -2.568   0.549
  493    HE2  LYS  68           HE2      LYS  68 -16.907   0.346   0.499
  494    HE3  LYS  68           HE3      LYS  68 -18.143  -0.270   1.595
  495    HZ1  LYS  68           HZ1      LYS  68 -15.330  -1.239   1.480
  496    HZ2  LYS  68           HZ2      LYS  68 -16.531  -1.749   2.561
  497    HZ3  LYS  68           HZ3      LYS  68 -15.954  -0.162   2.632
  498    H    ILE  69           H        ILE  69 -18.103  -1.708  -4.709
  499    HA   ILE  69           HA       ILE  69 -16.966   0.996  -4.830
  500    HB   ILE  69           HB       ILE  69 -18.566  -0.341  -7.023
  501   HG12  ILE  69          HG12      ILE  69 -15.647   0.473  -6.936
  502   HG13  ILE  69          HG13      ILE  69 -16.250  -1.181  -6.889
  503   HG21  ILE  69          HG21      ILE  69 -19.033   2.042  -6.827
  504   HG22  ILE  69          HG22      ILE  69 -18.109   1.705  -8.292
  505   HG23  ILE  69          HG23      ILE  69 -17.305   2.395  -6.882
  506   HD11  ILE  69          HD11      ILE  69 -17.150  -0.920  -9.133
  507   HD12  ILE  69          HD12      ILE  69 -15.421  -0.578  -9.094
  508   HD13  ILE  69          HD13      ILE  69 -16.581   0.748  -9.175
  509    H    LYS  70           H        LYS  70 -18.163   2.291  -3.673
  510    HA   LYS  70           HA       LYS  70 -20.999   1.666  -3.285
  511    HB2  LYS  70           HB2      LYS  70 -19.506   2.032  -1.341
  512    HB3  LYS  70           HB3      LYS  70 -19.294   3.690  -1.862
  513    HG2  LYS  70           HG2      LYS  70 -21.715   4.047  -1.595
  514    HG3  LYS  70           HG3      LYS  70 -21.858   2.399  -0.975
  515    HD2  LYS  70           HD2      LYS  70 -20.185   4.603   0.231
  516    HD3  LYS  70           HD3      LYS  70 -21.737   4.033   0.847
  517    HE2  LYS  70           HE2      LYS  70 -20.799   1.847   1.297
  518    HE3  LYS  70           HE3      LYS  70 -19.266   2.323   0.566
  519    HZ1  LYS  70           HZ1      LYS  70 -18.970   3.963   2.307
  520    HZ2  LYS  70           HZ2      LYS  70 -19.183   2.423   2.985
  521    HZ3  LYS  70           HZ3      LYS  70 -20.463   3.538   2.999
  522    H    ASP  71           H        ASP  71 -21.954   2.389  -5.005
  523    HA   ASP  71           HA       ASP  71 -21.368   4.836  -6.345
  524    HB2  ASP  71           HB2      ASP  71 -23.681   2.902  -6.546
  525    HB3  ASP  71           HB3      ASP  71 -23.544   4.340  -7.544
  526    H    LEU  72           H        LEU  72 -21.737   6.713  -5.299
  527    HA   LEU  72           HA       LEU  72 -24.103   6.912  -3.562
  528    HG   LEU  72           HG       LEU  72 -21.235   6.298  -2.585
  529    HB2  LEU  72           HB2      LEU  72 -21.558   8.542  -3.575
  530    HB3  LEU  72           HB3      LEU  72 -22.912   8.804  -2.494
  531   HD11  LEU  72          HD11      LEU  72 -19.968   8.206  -1.756
  532   HD12  LEU  72          HD12      LEU  72 -20.336   7.076  -0.453
  533   HD13  LEU  72          HD13      LEU  72 -21.256   8.572  -0.606
  534   HD21  LEU  72          HD21      LEU  72 -22.398   5.746  -0.498
  535   HD22  LEU  72          HD22      LEU  72 -23.515   5.871  -1.857
  536   HD23  LEU  72          HD23      LEU  72 -23.403   7.183  -0.684
  537    H    GLU  73           H        GLU  73 -24.484   9.499  -3.300
  538    HA   GLU  73           HA       GLU  73 -25.578  10.311  -5.826
  539    HB2  GLU  73           HB2      GLU  73 -26.767  10.684  -3.698
  540    HB3  GLU  73           HB3      GLU  73 -25.479  11.755  -3.170
  541    HG2  GLU  73           HG2      GLU  73 -26.013  13.320  -4.936
  542    HG3  GLU  73           HG3      GLU  73 -27.257  12.230  -5.550
  543    H    GLY  74           H        GLY  74 -24.033  10.881  -7.274
  544    HA2  GLY  74           HA2      GLY  74 -22.980  12.706  -8.320
  545    HA3  GLY  74           HA3      GLY  74 -22.752  13.448  -6.747
  546    H    GLN  75           H        GLN  75 -21.783  10.404  -6.226
  547    HA   GLN  75           HA       GLN  75 -19.225  10.384  -7.488
  548    HB2  GLN  75           HB2      GLN  75 -17.883  10.698  -5.441
  549    HB3  GLN  75           HB3      GLN  75 -18.759  12.152  -5.892
  550    HG2  GLN  75           HG2      GLN  75 -20.503  11.504  -4.203
  551    HG3  GLN  75           HG3      GLN  75 -19.404  10.234  -3.667
  552   HE21  GLN  75          HE21      GLN  75 -17.473  10.813  -2.647
  553   HE22  GLN  75          HE22      GLN  75 -17.222  12.391  -1.984
  554    H    VAL  76           H        VAL  76 -17.767   8.682  -6.214
  555    HA   VAL  76           HA       VAL  76 -19.502   6.604  -5.072
  556    HB   VAL  76           HB       VAL  76 -18.312   4.860  -6.316
  557   HG11  VAL  76          HG11      VAL  76 -19.582   6.951  -8.076
  558   HG12  VAL  76          HG12      VAL  76 -20.410   5.651  -7.217
  559   HG13  VAL  76          HG13      VAL  76 -19.299   5.272  -8.534
  560   HG21  VAL  76          HG21      VAL  76 -16.209   6.005  -6.688
  561   HG22  VAL  76          HG22      VAL  76 -17.000   7.153  -7.770
  562   HG23  VAL  76          HG23      VAL  76 -16.881   5.451  -8.223
  563    H    GLU  77           H        GLU  77 -18.453   5.111  -3.721
  564    HA   GLU  77           HA       GLU  77 -15.848   5.997  -2.678
  565    HB2  GLU  77           HB2      GLU  77 -17.706   5.892  -1.054
  566    HB3  GLU  77           HB3      GLU  77 -17.952   4.197  -1.444
  567    HG2  GLU  77           HG2      GLU  77 -15.569   3.821  -0.677
  568    HG3  GLU  77           HG3      GLU  77 -15.630   5.458  -0.027
  569    H    LEU  78           H        LEU  78 -14.189   4.891  -3.527
  570    HA   LEU  78           HA       LEU  78 -14.574   2.078  -4.259
  571    HG   LEU  78           HG       LEU  78 -11.820   2.317  -6.760
  572    HB2  LEU  78           HB2      LEU  78 -13.541   3.646  -5.911
  573    HB3  LEU  78           HB3      LEU  78 -12.218   3.903  -4.797
  574   HD11  LEU  78          HD11      LEU  78 -11.278   1.334  -3.963
  575   HD12  LEU  78          HD12      LEU  78 -10.280   2.450  -4.896
  576   HD13  LEU  78          HD13      LEU  78 -10.465   0.778  -5.426
  577   HD21  LEU  78          HD21      LEU  78 -12.523  -0.006  -6.414
  578   HD22  LEU  78          HD22      LEU  78 -13.894   1.077  -6.648
  579   HD23  LEU  78          HD23      LEU  78 -13.493   0.503  -5.030
  580    H    ASP  79           H        ASP  79 -14.131   0.642  -2.746
  581    HA   ASP  79           HA       ASP  79 -11.900   1.209  -0.905
  582    HB2  ASP  79           HB2      ASP  79 -13.949   1.518   0.353
  583    HB3  ASP  79           HB3      ASP  79 -14.563  -0.040  -0.193
  584    H    ALA  80           H        ALA  80 -10.347  -0.167  -1.360
  585    HA   ALA  80           HA       ALA  80 -11.081  -2.850  -2.305
  586    HB1  ALA  80           HB1      ALA  80  -9.682  -1.525  -3.812
  587    HB2  ALA  80           HB2      ALA  80  -8.844  -2.969  -3.248
  588    HB3  ALA  80           HB3      ALA  80  -8.451  -1.395  -2.556
  589    H    ALA  81           H        ALA  81 -10.855  -4.501  -0.977
  590    HA   ALA  81           HA       ALA  81  -9.276  -4.181   1.458
  591    HB1  ALA  81           HB1      ALA  81 -11.565  -4.998   1.688
  592    HB2  ALA  81           HB2      ALA  81 -10.399  -6.210   2.221
  593    HB3  ALA  81           HB3      ALA  81 -11.185  -6.373   0.651
  594    H    PHE  82           H        PHE  82  -7.201  -4.694   1.256
  595    HA   PHE  82           HA       PHE  82  -6.449  -6.973  -0.431
  596    HD1  PHE  82           HD1      PHE  82  -6.112  -3.044  -0.562
  597    HD2  PHE  82           HD2      PHE  82  -4.299  -6.388  -2.471
  598    HE1  PHE  82           HE1      PHE  82  -6.417  -1.957  -2.747
  599    HE2  PHE  82           HE2      PHE  82  -4.600  -5.304  -4.660
  600    HZ   PHE  82           HZ       PHE  82  -5.660  -3.089  -4.801
  601    HB2  PHE  82           HB2      PHE  82  -4.851  -4.679   0.703
  602    HB3  PHE  82           HB3      PHE  82  -4.107  -6.063  -0.086
  603    H    THR  83           H        THR  83  -5.920  -8.847   0.462
  604    HA   THR  83           HA       THR  83  -5.258  -8.849   3.340
  605    HB   THR  83           HB       THR  83  -6.456 -11.160   1.804
  606    HG1  THR  83           HG1      THR  83  -7.665  -8.925   2.359
  607   HG21  THR  83          HG21      THR  83  -5.299 -11.766   3.868
  608   HG22  THR  83          HG22      THR  83  -7.042 -11.965   4.055
  609   HG23  THR  83          HG23      THR  83  -6.237 -10.563   4.759
  610    H    PHE  84           H        PHE  84  -3.132  -9.046   3.507
  611    HA   PHE  84           HA       PHE  84  -1.681 -10.689   1.564
  612    HD1  PHE  84           HD2      PHE  84  -0.371  -9.104  -0.072
  613    HD2  PHE  84           HD1      PHE  84  -1.571  -6.655   3.188
  614    HE1  PHE  84           HE2      PHE  84  -0.849  -7.268  -1.636
  615    HE2  PHE  84           HE1      PHE  84  -2.056  -4.814   1.632
  616    HZ   PHE  84           HZ       PHE  84  -1.692  -5.120  -0.785
  617    HB2  PHE  84           HB2      PHE  84  -0.620  -8.728   3.613
  618    HB3  PHE  84           HB3      PHE  84   0.322  -9.538   2.364
  619    H    SER  85           H        SER  85  -0.305 -12.336   2.202
  620    HA   SER  85           HA       SER  85  -1.120 -13.886   4.398
  621    HG   SER  85           HG       SER  85  -0.005 -15.661   1.694
  622    HB2  SER  85           HB2      SER  85   1.528 -14.139   2.968
  623    HB3  SER  85           HB3      SER  85   0.584 -15.416   3.737
  624    H    CYS  86           H        CYS  86   1.505 -11.596   3.965
  625    HA   CYS  86           HA       CYS  86   2.110 -11.815   6.829
  626    HG   CYS  86           HG       CYS  86   4.350 -13.897   4.090
  627    HB2  CYS  86           HB2      CYS  86   4.169 -11.409   4.650
  628    HB3  CYS  86           HB3      CYS  86   4.479 -11.573   6.377
  629    H    GLN  87           H        GLN  87   3.177  -9.862   7.695
  630    HA   GLN  87           HA       GLN  87   1.846  -7.498   6.823
  631    HB2  GLN  87           HB2      GLN  87   2.285  -7.731   9.155
  632    HB3  GLN  87           HB3      GLN  87   3.999  -8.005   8.876
  633    HG2  GLN  87           HG2      GLN  87   4.412  -5.765   8.423
  634    HG3  GLN  87           HG3      GLN  87   2.715  -5.416   8.098
  635   HE21  GLN  87          HE21      GLN  87   1.316  -5.105   9.804
  636   HE22  GLN  87          HE22      GLN  87   1.858  -4.806  11.414
  637    H    ALA  88           H        ALA  88   4.933  -8.920   6.187
  638    HA   ALA  88           HA       ALA  88   6.402  -6.750   5.271
  639    HB1  ALA  88           HB1      ALA  88   7.635  -8.384   3.888
  640    HB2  ALA  88           HB2      ALA  88   6.396  -9.588   4.245
  641    HB3  ALA  88           HB3      ALA  88   7.395  -8.939   5.545
  642    H    GLU  89           H        GLU  89   4.046  -8.765   3.549
  643    HA   GLU  89           HA       GLU  89   4.369  -7.519   1.016
  644    HB2  GLU  89           HB2      GLU  89   1.710  -8.638   1.715
  645    HB3  GLU  89           HB3      GLU  89   2.704  -8.926   0.298
  646    HG2  GLU  89           HG2      GLU  89   3.181 -10.130   3.014
  647    HG3  GLU  89           HG3      GLU  89   2.342 -10.927   1.688
  648    H    MET  90           H        MET  90   2.560  -6.746   3.874
  649    HA   MET  90           HA       MET  90   0.642  -5.046   2.593
  650    HB2  MET  90           HB2      MET  90   0.375  -6.304   4.806
  651    HB3  MET  90           HB3      MET  90   1.374  -5.051   5.521
  652    HG2  MET  90           HG2      MET  90  -1.177  -4.454   4.052
  653    HG3  MET  90           HG3      MET  90  -1.121  -4.804   5.775
  654    HE1  MET  90           HE1      MET  90   0.010  -3.239   7.579
  655    HE2  MET  90           HE2      MET  90   0.967  -1.815   7.170
  656    HE3  MET  90           HE3      MET  90   1.542  -3.422   6.723
  657    H    ILE  91           H        ILE  91   3.548  -4.497   4.579
  658    HA   ILE  91           HA       ILE  91   3.319  -1.686   4.533
  659    HB   ILE  91           HB       ILE  91   5.717  -1.708   5.277
  660   HG12  ILE  91          HG12      ILE  91   5.301  -4.702   5.307
  661   HG13  ILE  91          HG13      ILE  91   6.331  -3.850   4.168
  662   HG21  ILE  91          HG21      ILE  91   3.844  -1.654   6.828
  663   HG22  ILE  91          HG22      ILE  91   5.176  -2.609   7.480
  664   HG23  ILE  91          HG23      ILE  91   3.763  -3.416   6.802
  665   HD11  ILE  91          HD11      ILE  91   6.703  -3.937   7.151
  666   HD12  ILE  91          HD12      ILE  91   7.748  -3.097   6.005
  667   HD13  ILE  91          HD13      ILE  91   7.623  -4.857   5.960
  668    H    ILE  92           H        ILE  92   5.054  -3.953   2.429
  669    HA   ILE  92           HA       ILE  92   6.421  -1.929   0.970
  670    HB   ILE  92           HB       ILE  92   6.803  -3.666  -0.742
  671   HG12  ILE  92          HG12      ILE  92   5.153  -5.457   1.041
  672   HG13  ILE  92          HG13      ILE  92   4.630  -4.830  -0.519
  673   HG21  ILE  92          HG21      ILE  92   7.287  -4.570   2.088
  674   HG22  ILE  92          HG22      ILE  92   8.310  -3.485   1.145
  675   HG23  ILE  92          HG23      ILE  92   8.130  -5.172   0.660
  676   HD11  ILE  92          HD11      ILE  92   6.968  -6.663  -0.047
  677   HD12  ILE  92          HD12      ILE  92   6.447  -6.037  -1.610
  678   HD13  ILE  92          HD13      ILE  92   5.397  -7.124  -0.701
  679    H    PHE  93           H        PHE  93   3.277  -3.393   0.773
  680    HA   PHE  93           HA       PHE  93   2.516  -2.417  -1.765
  681    HD1  PHE  93           HD2      PHE  93   0.471  -3.608  -3.002
  682    HD2  PHE  93           HD1      PHE  93  -1.143  -1.997   0.586
  683    HE1  PHE  93           HE2      PHE  93  -1.604  -3.037  -4.196
  684    HE2  PHE  93           HE1      PHE  93  -3.221  -1.426  -0.595
  685    HZ   PHE  93           HZ       PHE  93  -3.452  -1.942  -2.987
  686    HB2  PHE  93           HB2      PHE  93   1.307  -4.218  -0.651
  687    HB3  PHE  93           HB3      PHE  93   0.857  -3.138   0.662
  688    H    GLU  94           H        GLU  94   2.022  -1.180   1.521
  689    HA   GLU  94           HA       GLU  94   0.601   1.137   0.952
  690    HB2  GLU  94           HB2      GLU  94   2.664   0.623   3.100
  691    HB3  GLU  94           HB3      GLU  94   1.597   2.017   3.075
  692    HG2  GLU  94           HG2      GLU  94   0.505  -0.766   3.039
  693    HG3  GLU  94           HG3      GLU  94   0.981   0.012   4.545
  694    H    LEU  95           H        LEU  95   4.116   0.696   1.175
  695    HA   LEU  95           HA       LEU  95   4.866   3.352   0.745
  696    HG   LEU  95           HG       LEU  95   5.887   1.044   2.504
  697    HB2  LEU  95           HB2      LEU  95   6.334   0.799   0.081
  698    HB3  LEU  95           HB3      LEU  95   7.066   2.391   0.073
  699   HD11  LEU  95          HD11      LEU  95   7.916  -0.068   1.700
  700   HD12  LEU  95          HD12      LEU  95   8.181   0.758   3.235
  701   HD13  LEU  95          HD13      LEU  95   8.769   1.477   1.735
  702   HD21  LEU  95          HD21      LEU  95   6.931   2.858   3.746
  703   HD22  LEU  95          HD22      LEU  95   5.766   3.491   2.584
  704   HD23  LEU  95          HD23      LEU  95   7.494   3.582   2.240
  705    H    SER  96           H        SER  96   4.393   0.687  -1.526
  706    HA   SER  96           HA       SER  96   5.264   2.164  -3.791
  707    HG   SER  96           HG       SER  96   4.864  -0.673  -5.726
  708    HB2  SER  96           HB2      SER  96   5.235  -0.373  -3.523
  709    HB3  SER  96           HB3      SER  96   3.504  -0.290  -3.849
  710    H    LEU  97           H        LEU  97   2.228   1.907  -2.126
  711    HA   LEU  97           HA       LEU  97   0.382   2.515  -4.095
  712    HG   LEU  97           HG       LEU  97   0.090   0.964  -1.541
  713    HB2  LEU  97           HB2      LEU  97   0.500   3.368  -1.210
  714    HB3  LEU  97           HB3      LEU  97  -0.863   3.739  -2.245
  715   HD11  LEU  97          HD11      LEU  97  -2.297   2.550  -0.602
  716   HD12  LEU  97          HD12      LEU  97  -0.909   2.060   0.371
  717   HD13  LEU  97          HD13      LEU  97  -2.013   0.842  -0.266
  718   HD21  LEU  97          HD21      LEU  97  -1.948   0.217  -2.646
  719   HD22  LEU  97          HD22      LEU  97  -0.914   1.101  -3.769
  720   HD23  LEU  97          HD23      LEU  97  -2.335   1.883  -3.078
  721    H    ARG  98           H        ARG  98   2.103   4.848  -2.024
  722    HA   ARG  98           HA       ARG  98   1.124   7.027  -3.635
  723    HE   ARG  98           HE       ARG  98   4.367   6.044   1.239
  724    HB2  ARG  98           HB2      ARG  98   2.665   8.443  -2.207
  725    HB3  ARG  98           HB3      ARG  98   1.348   7.628  -1.385
  726    HG2  ARG  98           HG2      ARG  98   3.997   6.284  -1.459
  727    HG3  ARG  98           HG3      ARG  98   3.792   7.682  -0.402
  728    HD2  ARG  98           HD2      ARG  98   1.680   6.492   0.442
  729    HD3  ARG  98           HD3      ARG  98   2.330   5.059  -0.350
  730   HH11  ARG  98          HH11      ARG  98   1.109   4.811   1.717
  731   HH12  ARG  98          HH12      ARG  98   1.429   4.265   3.343
  732   HH21  ARG  98          HH21      ARG  98   4.773   5.326   3.349
  733   HH22  ARG  98          HH22      ARG  98   3.509   4.562   4.264
  734    H    SER  99           H        SER  99   3.985   5.086  -3.538
  735    HA   SER  99           HA       SER  99   5.632   6.958  -4.952
  736    HG   SER  99           HG       SER  99   6.095   4.797  -2.471
  737    HB2  SER  99           HB2      SER  99   6.062   4.008  -4.452
  738    HB3  SER  99           HB3      SER  99   7.289   5.173  -4.959
  739    H    LEU 100           H        LEU 100   3.165   4.888  -5.939
  740    HA   LEU 100           HA       LEU 100   4.264   4.341  -8.555
  741    HG   LEU 100           HG       LEU 100   1.749   3.787 -10.095
  742    HB2  LEU 100           HB2      LEU 100   2.611   2.871  -7.347
  743    HB3  LEU 100           HB3      LEU 100   1.397   4.091  -7.666
  744   HD11  LEU 100          HD11      LEU 100   4.041   3.018 -10.091
  745   HD12  LEU 100          HD12      LEU 100   3.010   1.822 -10.877
  746   HD13  LEU 100          HD13      LEU 100   3.578   1.551  -9.228
  747   HD21  LEU 100          HD21      LEU 100  -0.035   2.580  -8.992
  748   HD22  LEU 100          HD22      LEU 100   1.079   1.280  -8.565
  749   HD23  LEU 100          HD23      LEU 100   0.683   1.583 -10.258
  750    H    ALA 101           H        ALA 101   2.201   6.694  -7.035
  751    HA   ALA 101           HA       ALA 101   1.629   8.018  -9.564
  752    HB1  ALA 101           HB1      ALA 101  -0.129   7.916  -7.848
  753    HB2  ALA 101           HB2      ALA 101   0.317   9.580  -8.222
  754    HB3  ALA 101           HB3      ALA 101   0.906   8.821  -6.743
  755    H    LEU 102           H        LEU 102   3.819   8.122  -6.923
  756    HA   LEU 102           HA       LEU 102   5.145  10.458  -8.114
  757    HG   LEU 102           HG       LEU 102   2.813  11.097  -6.225
  758    HB2  LEU 102           HB2      LEU 102   4.739   9.934  -5.173
  759    HB3  LEU 102           HB3      LEU 102   5.809  11.164  -5.817
  760   HD11  LEU 102          HD11      LEU 102   3.388  11.522  -3.900
  761   HD12  LEU 102          HD12      LEU 102   2.782  12.989  -4.671
  762   HD13  LEU 102          HD13      LEU 102   4.513  12.787  -4.395
  763   HD21  LEU 102          HD21      LEU 102   3.116  13.354  -7.090
  764   HD22  LEU 102          HD22      LEU 102   4.039  12.193  -8.044
  765   HD23  LEU 102          HD23      LEU 102   4.859  13.220  -6.868
  766    H    GLU 103           H        GLU 103   6.595   9.094  -9.144
  767    HA   GLU 103           HA       GLU 103   8.083   7.061  -7.914
  768    HB2  GLU 103           HB2      GLU 103   7.981   7.304 -10.347
  769    HB3  GLU 103           HB3      GLU 103   8.831   8.841 -10.242
  770    HG2  GLU 103           HG2      GLU 103  10.691   7.460  -9.093
  771    HG3  GLU 103           HG3      GLU 103   9.876   6.077  -9.823
  772    H    HIS 104           H        HIS 104   9.343   7.314  -6.198
  773    HA   HIS 104           HA       HIS 104  10.820   9.821  -5.850
  774    HD1  HIS 104           HD1      HIS 104   9.712  11.300  -4.137
  775    HD2  HIS 104           HD2      HIS 104   7.858   7.783  -2.901
  776    HE1  HIS 104           HE1      HIS 104   7.474  11.992  -3.223
  777    HE2  HIS 104           HE2      HIS 104   6.473   9.882  -2.281
  778    HB2  HIS 104           HB2      HIS 104  10.338   7.539  -3.917
  779    HB3  HIS 104           HB3      HIS 104  11.288   8.974  -3.556
  780    H    HIS 105           H        HIS 105  12.597   9.689  -7.106
  781    HA   HIS 105           HA       HIS 105  14.346   7.360  -6.683
  782    HD1  HIS 105           HD1      HIS 105  12.657   9.242 -10.593
  783    HD2  HIS 105           HD2      HIS 105  15.921  10.901  -8.603
  784    HE1  HIS 105           HE1      HIS 105  12.885  11.587 -11.482
  785    HE2  HIS 105           HE2      HIS 105  14.766  12.615 -10.157
  786    HB2  HIS 105           HB2      HIS 105  15.434   7.910  -8.820
  787    HB3  HIS 105           HB3      HIS 105  13.715   7.619  -9.040
  788    H    HIS 106           H        HIS 106  16.658   7.820  -6.628
  789    HA   HIS 106           HA       HIS 106  17.451  10.515  -5.919
  790    HD1  HIS 106           HD1      HIS 106  19.716   7.457  -3.855
  791    HD2  HIS 106           HD2      HIS 106  15.611   7.265  -3.223
  792    HE1  HIS 106           HE1      HIS 106  19.270   5.131  -3.033
  793    HE2  HIS 106           HE2      HIS 106  16.761   4.977  -2.847
  794    HB2  HIS 106           HB2      HIS 106  18.440   9.803  -3.742
  795    HB3  HIS 106           HB3      HIS 106  16.685   9.727  -3.755
  796    H    HIS 107           H        HIS 107  19.931  10.101  -4.945
  797    HA   HIS 107           HA       HIS 107  21.561   9.377  -7.041
  798    HD1  HIS 107           HD1      HIS 107  24.497  10.857  -6.322
  799    HD2  HIS 107           HD2      HIS 107  24.100   7.029  -4.738
  800    HE1  HIS 107           HE1      HIS 107  26.723   9.735  -6.676
  801    HE2  HIS 107           HE2      HIS 107  26.398   7.370  -5.875
  802    HB2  HIS 107           HB2      HIS 107  22.364  10.550  -5.020
  803    HB3  HIS 107           HB3      HIS 107  22.177   9.068  -4.089
  804    H    HIS 108           H        HIS 108  21.437   7.545  -8.123
  805    HA   HIS 108           HA       HIS 108  21.505   5.011  -6.612
  806    HD1  HIS 108           HD1      HIS 108  19.813   2.956  -6.495
  807    HD2  HIS 108           HD2      HIS 108  20.261   3.154 -10.627
  808    HE1  HIS 108           HE1      HIS 108  19.634   0.587  -7.312
  809    HE2  HIS 108           HE2      HIS 108  19.681   0.761  -9.826
  810    HB2  HIS 108           HB2      HIS 108  19.336   5.390  -7.782
  811    HB3  HIS 108           HB3      HIS 108  20.203   5.501  -9.307
  812    H    HIS 109           H        HIS 109  22.987   7.080  -8.797
  813    HA   HIS 109           HA       HIS 109  25.200   5.254  -9.098
  814    HD1  HIS 109           HD1      HIS 109  25.735   3.212 -11.595
  815    HD2  HIS 109           HD2      HIS 109  26.459   7.208 -12.509
  816    HE1  HIS 109           HE1      HIS 109  27.882   3.239 -12.910
  817    HE2  HIS 109           HE2      HIS 109  28.403   5.679 -13.256
  818    HB2  HIS 109           HB2      HIS 109  23.769   4.737 -11.078
  819    HB3  HIS 109           HB3      HIS 109  23.887   6.427 -11.563
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1  48.027 -10.070  30.428
    2    H1   MET   1           H1       MET   1  49.915  -7.860  30.983
    3    H2   MET   1           H2       MET   1  50.302  -9.409  30.398
    4    H3   MET   1           H3       MET   1  49.688  -9.223  31.964
    5    HB2  MET   1           HB2      MET   1  47.584  -7.304  31.565
    6    HB3  MET   1           HB3      MET   1  46.291  -8.277  30.879
    7    HG2  MET   1           HG2      MET   1  46.273  -8.487  33.268
    8    HG3  MET   1           HG3      MET   1  46.745 -10.024  32.545
    9    HE1  MET   1           HE1      MET   1  48.782 -10.083  35.856
   10    HE2  MET   1           HE2      MET   1  47.685 -10.970  34.799
   11    HE3  MET   1           HE3      MET   1  47.139  -9.498  35.600
   12    H    ALA   2           H        ALA   2  46.860  -9.873  28.547
   13    HA   ALA   2           HA       ALA   2  47.892  -7.835  26.683
   14    HB1  ALA   2           HB1      ALA   2  48.707 -10.081  26.142
   15    HB2  ALA   2           HB2      ALA   2  47.647  -9.448  24.884
   16    HB3  ALA   2           HB3      ALA   2  47.042 -10.651  26.021
   17    H    MET   3           H        MET   3  46.367  -6.361  26.435
   18    HA   MET   3           HA       MET   3  43.601  -7.287  25.980
   19    HB2  MET   3           HB2      MET   3  44.509  -4.667  27.197
   20    HB3  MET   3           HB3      MET   3  42.843  -5.086  26.830
   21    HG2  MET   3           HG2      MET   3  42.930  -6.908  28.435
   22    HG3  MET   3           HG3      MET   3  44.615  -6.526  28.788
   23    HE1  MET   3           HE1      MET   3  41.055  -3.764  29.796
   24    HE2  MET   3           HE2      MET   3  40.883  -5.373  29.094
   25    HE3  MET   3           HE3      MET   3  41.598  -4.070  28.145
   26    H    LYS   4           H        LYS   4  44.192  -7.514  23.765
   27    HA   LYS   4           HA       LYS   4  44.497  -4.947  22.360
   28    HB2  LYS   4           HB2      LYS   4  45.687  -7.622  21.598
   29    HB3  LYS   4           HB3      LYS   4  45.805  -6.148  20.646
   30    HG2  LYS   4           HG2      LYS   4  47.089  -5.075  22.374
   31    HG3  LYS   4           HG3      LYS   4  46.881  -6.467  23.436
   32    HD2  LYS   4           HD2      LYS   4  48.123  -7.860  21.858
   33    HD3  LYS   4           HD3      LYS   4  48.322  -6.471  20.786
   34    HE2  LYS   4           HE2      LYS   4  49.595  -5.309  22.487
   35    HE3  LYS   4           HE3      LYS   4  49.336  -6.635  23.619
   36    HZ1  LYS   4           HZ1      LYS   4  50.604  -8.091  22.206
   37    HZ2  LYS   4           HZ2      LYS   4  51.531  -6.712  22.565
   38    HZ3  LYS   4           HZ3      LYS   4  50.797  -6.870  21.041
   39    H    ASP   5           H        ASP   5  42.439  -4.597  21.740
   40    HA   ASP   5           HA       ASP   5  41.183  -6.701  20.091
   41    HB2  ASP   5           HB2      ASP   5  39.912  -6.076  22.151
   42    HB3  ASP   5           HB3      ASP   5  39.793  -4.431  21.534
   43    H    VAL   6           H        VAL   6  41.789  -6.239  18.080
   44    HA   VAL   6           HA       VAL   6  41.452  -3.468  17.122
   45    HB   VAL   6           HB       VAL   6  43.316  -5.581  16.016
   46   HG11  VAL   6          HG11      VAL   6  44.251  -3.727  14.690
   47   HG12  VAL   6          HG12      VAL   6  42.992  -2.663  15.318
   48   HG13  VAL   6          HG13      VAL   6  42.558  -4.039  14.304
   49   HG21  VAL   6          HG21      VAL   6  45.133  -4.200  16.922
   50   HG22  VAL   6          HG22      VAL   6  44.083  -4.818  18.196
   51   HG23  VAL   6          HG23      VAL   6  43.943  -3.139  17.677
   52    H    VAL   7           H        VAL   7  39.953  -3.162  15.602
   53    HA   VAL   7           HA       VAL   7  39.195  -5.347  13.826
   54    HB   VAL   7           HB       VAL   7  37.705  -5.515  15.826
   55   HG11  VAL   7          HG11      VAL   7  36.718  -2.816  14.920
   56   HG12  VAL   7          HG12      VAL   7  37.559  -3.175  16.428
   57   HG13  VAL   7          HG13      VAL   7  35.948  -3.830  16.140
   58   HG21  VAL   7          HG21      VAL   7  36.340  -4.758  13.249
   59   HG22  VAL   7          HG22      VAL   7  35.615  -5.683  14.565
   60   HG23  VAL   7          HG23      VAL   7  36.977  -6.349  13.664
   61    H    ASP   8           H        ASP   8  38.260  -4.621  11.873
   62    HA   ASP   8           HA       ASP   8  38.014  -1.718  11.548
   63    HB2  ASP   8           HB2      ASP   8  40.331  -2.284  10.949
   64    HB3  ASP   8           HB3      ASP   8  39.744  -3.478   9.797
   65    H    LYS   9           H        LYS   9  36.091  -1.365  10.681
   66    HA   LYS   9           HA       LYS   9  35.221  -2.982   8.412
   67    HB2  LYS   9           HB2      LYS   9  34.241  -4.046  10.428
   68    HB3  LYS   9           HB3      LYS   9  33.478  -2.518  10.842
   69    HG2  LYS   9           HG2      LYS   9  32.198  -2.607   8.749
   70    HG3  LYS   9           HG3      LYS   9  32.940  -4.165   8.381
   71    HD2  LYS   9           HD2      LYS   9  31.987  -5.059  10.495
   72    HD3  LYS   9           HD3      LYS   9  31.163  -3.517  10.732
   73    HE2  LYS   9           HE2      LYS   9  29.967  -3.843   8.616
   74    HE3  LYS   9           HE3      LYS   9  30.785  -5.386   8.391
   75    HZ1  LYS   9           HZ1      LYS   9  28.786  -4.668  10.458
   76    HZ2  LYS   9           HZ2      LYS   9  29.769  -6.037  10.592
   77    HZ3  LYS   9           HZ3      LYS   9  28.695  -5.894   9.285
   78    H    CYS  10           H        CYS  10  34.762  -1.555   6.852
   79    HA   CYS  10           HA       CYS  10  33.035   0.699   7.479
   80    HG   CYS  10           HG       CYS  10  33.778   3.674   7.212
   81    HB2  CYS  10           HB2      CYS  10  35.337   1.582   7.743
   82    HB3  CYS  10           HB3      CYS  10  35.690   1.104   6.087
   83    H    SER  11           H        SER  11  31.457  -0.232   6.244
   84    HA   SER  11           HA       SER  11  31.491   0.363   3.483
   85    HG   SER  11           HG       SER  11  30.879  -2.866   4.843
   86    HB2  SER  11           HB2      SER  11  31.172  -2.013   2.660
   87    HB3  SER  11           HB3      SER  11  32.810  -1.619   3.181
   88    H    THR  12           H        THR  12  29.539   1.335   3.686
   89    HA   THR  12           HA       THR  12  27.203  -0.347   3.917
   90    HB   THR  12           HB       THR  12  27.644   1.848   5.957
   91    HG1  THR  12           HG1      THR  12  28.208  -0.766   6.012
   92   HG21  THR  12          HG21      THR  12  25.324   1.787   5.151
   93   HG22  THR  12          HG22      THR  12  25.440   1.248   6.825
   94   HG23  THR  12          HG23      THR  12  25.238   0.066   5.531
   95    H    LYS  13           H        LYS  13  26.052   0.301   2.230
   96    HA   LYS  13           HA       LYS  13  25.138   2.989   1.954
   97    HB2  LYS  13           HB2      LYS  13  26.112   3.488  -0.229
   98    HB3  LYS  13           HB3      LYS  13  27.376   3.274   0.974
   99    HG2  LYS  13           HG2      LYS  13  27.847   1.056   0.151
  100    HG3  LYS  13           HG3      LYS  13  26.503   1.166  -0.988
  101    HD2  LYS  13           HD2      LYS  13  27.645   3.100  -2.056
  102    HD3  LYS  13           HD3      LYS  13  29.020   2.827  -0.983
  103    HE2  LYS  13           HE2      LYS  13  29.343   0.615  -1.906
  104    HE3  LYS  13           HE3      LYS  13  27.911   0.799  -2.919
  105    HZ1  LYS  13           HZ1      LYS  13  30.441   2.345  -3.114
  106    HZ2  LYS  13           HZ2      LYS  13  29.044   2.689  -4.009
  107    HZ3  LYS  13           HZ3      LYS  13  29.849   1.212  -4.228
  108    H    GLY  14           H        GLY  14  23.405   3.155   0.480
  109    HA2  GLY  14           HA2      GLY  14  22.245   2.190  -1.460
  110    HA3  GLY  14           HA3      GLY  14  22.648   0.606  -0.814
  111    H    CYS  15           H        CYS  15  21.310   3.481   0.796
  112    HA   CYS  15           HA       CYS  15  18.892   1.900   1.362
  113    HG   CYS  15           HG       CYS  15  17.999   4.018   4.606
  114    HB2  CYS  15           HB2      CYS  15  20.362   2.117   3.367
  115    HB3  CYS  15           HB3      CYS  15  20.181   3.866   3.265
  116    H    ALA  16           H        ALA  16  17.589   2.789  -0.147
  117    HA   ALA  16           HA       ALA  16  16.838   5.595   0.264
  118    HB1  ALA  16           HB1      ALA  16  17.502   4.440  -2.445
  119    HB2  ALA  16           HB2      ALA  16  18.471   5.617  -1.558
  120    HB3  ALA  16           HB3      ALA  16  16.860   6.053  -2.133
  121    H    ILE  17           H        ILE  17  15.680   2.903   0.799
  122    HA   ILE  17           HA       ILE  17  13.302   3.016  -0.921
  123    HB   ILE  17           HB       ILE  17  12.773   0.775   0.214
  124   HG12  ILE  17          HG12      ILE  17  14.958  -0.466   0.774
  125   HG13  ILE  17          HG13      ILE  17  15.666   1.131   0.975
  126   HG21  ILE  17          HG21      ILE  17  15.086   1.030  -1.696
  127   HG22  ILE  17          HG22      ILE  17  13.373   0.977  -2.113
  128   HG23  ILE  17          HG23      ILE  17  14.155  -0.442  -1.414
  129   HD11  ILE  17          HD11      ILE  17  13.342   0.011   2.531
  130   HD12  ILE  17          HD12      ILE  17  14.038   1.619   2.734
  131   HD13  ILE  17          HD13      ILE  17  15.001   0.190   3.104
  132    H    ASP  18           H        ASP  18  14.179   4.487   1.701
  133    HA   ASP  18           HA       ASP  18  11.961   3.792   3.448
  134    HB2  ASP  18           HB2      ASP  18  14.117   4.247   4.500
  135    HB3  ASP  18           HB3      ASP  18  14.159   5.848   3.767
  136    H    ILE  19           H        ILE  19  10.056   4.635   3.113
  137    HA   ILE  19           HA       ILE  19   9.761   7.197   1.753
  138    HB   ILE  19           HB       ILE  19   7.633   5.305   2.790
  139   HG12  ILE  19          HG12      ILE  19   8.903   4.209   1.039
  140   HG13  ILE  19          HG13      ILE  19   7.341   4.693   0.395
  141   HG21  ILE  19          HG21      ILE  19   6.105   6.550   1.331
  142   HG22  ILE  19          HG22      ILE  19   7.411   7.667   0.930
  143   HG23  ILE  19          HG23      ILE  19   6.805   7.575   2.584
  144   HD11  ILE  19          HD11      ILE  19   9.920   6.184  -0.018
  145   HD12  ILE  19          HD12      ILE  19   8.351   6.588  -0.715
  146   HD13  ILE  19          HD13      ILE  19   9.163   5.093  -1.180
  147    H    GLY  20           H        GLY  20   9.660   5.810   4.912
  148    HA2  GLY  20           HA2      GLY  20   9.710   6.921   6.953
  149    HA3  GLY  20           HA3      GLY  20   9.392   8.433   6.110
  150    H    THR  21           H        THR  21   7.595   5.384   6.132
  151    HA   THR  21           HA       THR  21   5.371   6.733   7.473
  152    HB   THR  21           HB       THR  21   4.989   5.105   4.950
  153    HG1  THR  21           HG1      THR  21   5.675   7.717   5.296
  154   HG21  THR  21          HG21      THR  21   3.086   6.857   6.511
  155   HG22  THR  21          HG22      THR  21   3.094   5.094   6.524
  156   HG23  THR  21          HG23      THR  21   2.705   5.962   5.039
  157    H    VAL  22           H        VAL  22   4.734   5.523   9.127
  158    HA   VAL  22           HA       VAL  22   4.373   2.674   8.821
  159    HB   VAL  22           HB       VAL  22   6.709   2.760   9.542
  160   HG11  VAL  22          HG11      VAL  22   6.694   4.917  10.672
  161   HG12  VAL  22          HG12      VAL  22   7.351   3.657  11.716
  162   HG13  VAL  22          HG13      VAL  22   5.706   4.240  11.967
  163   HG21  VAL  22          HG21      VAL  22   6.544   1.337  11.530
  164   HG22  VAL  22          HG22      VAL  22   5.356   0.897  10.303
  165   HG23  VAL  22          HG23      VAL  22   4.857   1.816  11.723
  166    H    ILE  23           H        ILE  23   2.730   1.926  10.100
  167    HA   ILE  23           HA       ILE  23   1.313   3.977  11.619
  168    HB   ILE  23           HB       ILE  23   0.281   1.219  10.934
  169   HG12  ILE  23          HG12      ILE  23  -1.082   2.626   9.195
  170   HG13  ILE  23          HG13      ILE  23   0.262   3.754   9.320
  171   HG21  ILE  23          HG21      ILE  23  -1.918   2.260  11.300
  172   HG22  ILE  23          HG22      ILE  23  -1.115   3.760  11.764
  173   HG23  ILE  23          HG23      ILE  23  -0.901   2.307  12.740
  174   HD11  ILE  23          HD11      ILE  23   0.443   0.862   8.503
  175   HD12  ILE  23          HD12      ILE  23   1.803   1.980   8.637
  176   HD13  ILE  23          HD13      ILE  23   0.543   2.261   7.433
  177    H    ASP  24           H        ASP  24   0.768   0.644  12.351
  178    HA   ASP  24           HA       ASP  24   2.515   0.621  14.666
  179    HB2  ASP  24           HB2      ASP  24  -0.501   0.545  14.910
  180    HB3  ASP  24           HB3      ASP  24   0.567  -0.068  16.165
  181    H    ASN  25           H        ASN  25  -0.351  -1.314  14.576
  182    HA   ASN  25           HA       ASN  25   1.032  -3.503  13.235
  183    HB2  ASN  25           HB2      ASN  25  -0.105  -3.623  16.027
  184    HB3  ASN  25           HB3      ASN  25   0.144  -5.066  15.048
  185   HD21  ASN  25          HD21      ASN  25   2.232  -5.719  14.550
  186   HD22  ASN  25          HD22      ASN  25   3.602  -5.134  15.433
  187    H    ASP  26           H        ASP  26  -0.237  -4.490  11.847
  188    HA   ASP  26           HA       ASP  26  -3.152  -4.373  12.209
  189    HB2  ASP  26           HB2      ASP  26  -2.168  -3.186  10.161
  190    HB3  ASP  26           HB3      ASP  26  -1.667  -4.773   9.591
  191    H    ASN  27           H        ASN  27  -3.739  -6.413  10.364
  192    HA   ASN  27           HA       ASN  27  -2.550  -8.727  11.709
  193    HB2  ASN  27           HB2      ASN  27  -4.380 -10.049  10.707
  194    HB3  ASN  27           HB3      ASN  27  -4.993  -8.717  11.675
  195   HD21  ASN  27          HD21      ASN  27  -4.717 -10.073   8.508
  196   HD22  ASN  27          HD22      ASN  27  -5.790  -8.966   7.714
  197    H    CYS  28           H        CYS  28  -3.282  -7.492   8.508
  198    HA   CYS  28           HA       CYS  28  -0.921  -7.777   7.239
  199    HG   CYS  28           HG       CYS  28  -2.880 -11.796   6.078
  200    HB2  CYS  28           HB2      CYS  28  -1.112  -9.925   5.972
  201    HB3  CYS  28           HB3      CYS  28  -0.815 -10.148   7.692
  202    H    THR  29           H        THR  29  -3.773  -6.664   7.317
  203    HA   THR  29           HA       THR  29  -4.422  -7.005   4.466
  204    HB   THR  29           HB       THR  29  -6.362  -6.374   6.701
  205    HG1  THR  29           HG1      THR  29  -6.481  -8.784   5.277
  206   HG21  THR  29          HG21      THR  29  -7.067  -5.486   4.541
  207   HG22  THR  29          HG22      THR  29  -8.079  -6.855   5.001
  208   HG23  THR  29          HG23      THR  29  -6.810  -7.063   3.793
  209    H    SER  30           H        SER  30  -4.200  -5.246   3.278
  210    HA   SER  30           HA       SER  30  -4.073  -2.628   4.587
  211    HG   SER  30           HG       SER  30  -2.649  -1.091   3.205
  212    HB2  SER  30           HB2      SER  30  -2.238  -3.304   3.033
  213    HB3  SER  30           HB3      SER  30  -3.417  -3.400   1.727
  214    H    LYS  31           H        LYS  31  -5.792  -1.334   4.547
  215    HA   LYS  31           HA       LYS  31  -7.924  -1.938   2.605
  216    HB2  LYS  31           HB2      LYS  31  -8.196  -0.478   5.238
  217    HB3  LYS  31           HB3      LYS  31  -9.501  -0.909   4.147
  218    HG2  LYS  31           HG2      LYS  31  -9.658  -2.507   5.807
  219    HG3  LYS  31           HG3      LYS  31  -8.731  -3.344   4.560
  220    HD2  LYS  31           HD2      LYS  31  -6.689  -2.949   5.714
  221    HD3  LYS  31           HD3      LYS  31  -7.481  -1.864   6.853
  222    HE2  LYS  31           HE2      LYS  31  -8.825  -3.778   7.672
  223    HE3  LYS  31           HE3      LYS  31  -7.937  -4.836   6.578
  224    HZ1  LYS  31           HZ1      LYS  31  -5.902  -4.306   7.758
  225    HZ2  LYS  31           HZ2      LYS  31  -7.059  -4.909   8.835
  226    HZ3  LYS  31           HZ3      LYS  31  -6.738  -3.247   8.783
  227    H    PHE  32           H        PHE  32  -9.037  -0.213   1.671
  228    HA   PHE  32           HA       PHE  32  -8.091   2.483   1.890
  229    HD1  PHE  32           HD1      PHE  32  -6.070   3.984   0.950
  230    HD2  PHE  32           HD2      PHE  32  -8.084   2.322  -2.409
  231    HE1  PHE  32           HE1      PHE  32  -5.825   6.119  -0.248
  232    HE2  PHE  32           HE2      PHE  32  -7.835   4.451  -3.616
  233    HZ   PHE  32           HZ       PHE  32  -6.706   6.353  -2.533
  234    HB2  PHE  32           HB2      PHE  32  -6.282   1.473   0.536
  235    HB3  PHE  32           HB3      PHE  32  -7.475   0.940  -0.642
  236    H    SER  33           H        SER  33  -9.864   3.671   1.593
  237    HA   SER  33           HA       SER  33 -11.689   2.931  -0.587
  238    HG   SER  33           HG       SER  33 -11.937   1.510   1.472
  239    HB2  SER  33           HB2      SER  33 -12.691   4.079   2.027
  240    HB3  SER  33           HB3      SER  33 -13.631   3.360   0.722
  241    H    ARG  34           H        ARG  34 -11.345   4.509  -2.028
  242    HA   ARG  34           HA       ARG  34 -11.217   7.275  -1.015
  243    HE   ARG  34           HE       ARG  34  -8.529  10.509  -3.363
  244    HB2  ARG  34           HB2      ARG  34  -9.158   6.407  -2.204
  245    HB3  ARG  34           HB3      ARG  34 -10.133   6.306  -3.664
  246    HG2  ARG  34           HG2      ARG  34 -10.553   8.713  -3.554
  247    HG3  ARG  34           HG3      ARG  34  -9.579   8.813  -2.087
  248    HD2  ARG  34           HD2      ARG  34  -7.653   7.906  -3.422
  249    HD3  ARG  34           HD3      ARG  34  -8.656   8.088  -4.863
  250   HH11  ARG  34          HH11      ARG  34  -6.760   8.565  -5.685
  251   HH12  ARG  34          HH12      ARG  34  -5.822   9.909  -6.273
  252   HH21  ARG  34          HH21      ARG  34  -7.282  12.254  -4.110
  253   HH22  ARG  34          HH22      ARG  34  -6.114  11.998  -5.375
  254    H    PHE  35           H        PHE  35 -12.518   8.819  -1.941
  255    HA   PHE  35           HA       PHE  35 -14.772   7.795  -3.470
  256    HD1  PHE  35           HD1      PHE  35 -16.955   7.981  -1.907
  257    HD2  PHE  35           HD2      PHE  35 -13.879  10.256  -0.044
  258    HE1  PHE  35           HE1      PHE  35 -17.683   7.156   0.294
  259    HE2  PHE  35           HE2      PHE  35 -14.601   9.436   2.160
  260    HZ   PHE  35           HZ       PHE  35 -16.505   7.882   2.332
  261    HB2  PHE  35           HB2      PHE  35 -14.312  10.551  -2.305
  262    HB3  PHE  35           HB3      PHE  35 -15.812   9.968  -3.019
  263    H    PHE  36           H        PHE  36 -15.126   8.206  -5.559
  264    HA   PHE  36           HA       PHE  36 -13.275  10.051  -6.926
  265    HD1  PHE  36           HD1      PHE  36 -11.151   8.852  -8.644
  266    HD2  PHE  36           HD2      PHE  36 -13.348   6.064  -6.299
  267    HE1  PHE  36           HE1      PHE  36  -9.050   7.762  -7.976
  268    HE2  PHE  36           HE2      PHE  36 -11.251   4.968  -5.630
  269    HZ   PHE  36           HZ       PHE  36  -9.098   5.819  -6.466
  270    HB2  PHE  36           HB2      PHE  36 -14.455   7.452  -7.925
  271    HB3  PHE  36           HB3      PHE  36 -13.551   8.579  -8.929
  272    H    ALA  37           H        ALA  37 -14.119  11.073  -8.864
  273    HA   ALA  37           HA       ALA  37 -16.623  12.269  -8.453
  274    HB1  ALA  37           HB1      ALA  37 -16.317  13.254 -10.677
  275    HB2  ALA  37           HB2      ALA  37 -14.988  12.137 -10.987
  276    HB3  ALA  37           HB3      ALA  37 -14.842  13.350  -9.716
  277    H    THR  38           H        THR  38 -15.639   9.647 -10.639
  278    HA   THR  38           HA       THR  38 -18.475   8.924 -10.875
  279    HB   THR  38           HB       THR  38 -18.036   8.211 -13.243
  280    HG1  THR  38           HG1      THR  38 -16.155   9.469 -14.164
  281   HG21  THR  38          HG21      THR  38 -18.217  10.449 -14.213
  282   HG22  THR  38          HG22      THR  38 -17.662  11.161 -12.700
  283   HG23  THR  38          HG23      THR  38 -19.208  10.316 -12.760
  284    H    ARG  39           H        ARG  39 -18.804   6.628 -11.458
  285    HA   ARG  39           HA       ARG  39 -17.156   4.909  -9.953
  286    HE   ARG  39           HE       ARG  39 -18.582   0.045 -11.876
  287    HB2  ARG  39           HB2      ARG  39 -19.440   4.286 -10.335
  288    HB3  ARG  39           HB3      ARG  39 -19.215   4.296 -12.078
  289    HG2  ARG  39           HG2      ARG  39 -17.766   2.374 -11.947
  290    HG3  ARG  39           HG3      ARG  39 -17.838   2.406 -10.185
  291    HD2  ARG  39           HD2      ARG  39 -20.201   1.898 -10.242
  292    HD3  ARG  39           HD3      ARG  39 -20.199   1.969 -12.006
  293   HH11  ARG  39          HH11      ARG  39 -20.944   0.636  -9.352
  294   HH12  ARG  39          HH12      ARG  39 -20.991  -1.028  -8.841
  295   HH21  ARG  39          HH21      ARG  39 -18.646  -2.121 -11.216
  296   HH22  ARG  39          HH22      ARG  39 -19.686  -2.604  -9.910
  297    H    GLU  40           H        GLU  40 -17.114   5.866 -13.293
  298    HA   GLU  40           HA       GLU  40 -15.367   4.018 -14.405
  299    HB2  GLU  40           HB2      GLU  40 -15.476   6.999 -14.888
  300    HB3  GLU  40           HB3      GLU  40 -14.750   5.808 -15.954
  301    HG2  GLU  40           HG2      GLU  40 -16.888   4.814 -16.385
  302    HG3  GLU  40           HG3      GLU  40 -17.657   5.862 -15.196
  303    H    GLU  41           H        GLU  41 -14.660   7.057 -12.762
  304    HA   GLU  41           HA       GLU  41 -11.883   6.993 -12.807
  305    HB2  GLU  41           HB2      GLU  41 -13.773   8.133 -10.737
  306    HB3  GLU  41           HB3      GLU  41 -12.054   8.480 -10.791
  307    HG2  GLU  41           HG2      GLU  41 -14.014   9.099 -12.981
  308    HG3  GLU  41           HG3      GLU  41 -13.407  10.254 -11.794
  309    H    ALA  42           H        ALA  42 -14.156   5.339 -10.766
  310    HA   ALA  42           HA       ALA  42 -12.239   4.542  -8.773
  311    HB1  ALA  42           HB1      ALA  42 -15.009   3.462  -9.287
  312    HB2  ALA  42           HB2      ALA  42 -14.621   4.820  -8.228
  313    HB3  ALA  42           HB3      ALA  42 -14.034   3.202  -7.840
  314    H    GLU  43           H        GLU  43 -13.999   2.855 -11.369
  315    HA   GLU  43           HA       GLU  43 -12.786   0.349 -10.948
  316    HB2  GLU  43           HB2      GLU  43 -13.968   1.418 -13.517
  317    HB3  GLU  43           HB3      GLU  43 -13.718  -0.274 -13.109
  318    HG2  GLU  43           HG2      GLU  43 -15.309  -0.002 -11.228
  319    HG3  GLU  43           HG3      GLU  43 -15.619   1.643 -11.778
  320    H    SER  44           H        SER  44 -11.888   3.121 -12.882
  321    HA   SER  44           HA       SER  44  -9.867   1.904 -14.428
  322    HG   SER  44           HG       SER  44  -9.068   3.805 -16.006
  323    HB2  SER  44           HB2      SER  44 -10.927   4.128 -14.895
  324    HB3  SER  44           HB3      SER  44 -10.023   4.795 -13.538
  325    H    PHE  45           H        PHE  45  -9.926   3.126 -11.159
  326    HA   PHE  45           HA       PHE  45  -7.078   3.278 -10.884
  327    HD1  PHE  45           HD1      PHE  45  -5.899   4.758  -9.409
  328    HD2  PHE  45           HD2      PHE  45  -8.447   2.728  -6.669
  329    HE1  PHE  45           HE1      PHE  45  -4.148   4.892  -7.686
  330    HE2  PHE  45           HE2      PHE  45  -6.698   2.859  -4.942
  331    HZ   PHE  45           HZ       PHE  45  -4.545   3.940  -5.450
  332    HB2  PHE  45           HB2      PHE  45  -8.595   4.664  -9.516
  333    HB3  PHE  45           HB3      PHE  45  -9.235   3.210  -8.762
  334    H    MET  46           H        MET  46  -9.600   0.964  -9.995
  335    HA   MET  46           HA       MET  46  -7.960  -0.814  -8.558
  336    HB2  MET  46           HB2      MET  46 -10.383  -0.871  -8.367
  337    HB3  MET  46           HB3      MET  46 -10.535  -1.314 -10.061
  338    HG2  MET  46           HG2      MET  46 -10.880  -3.228  -8.603
  339    HG3  MET  46           HG3      MET  46  -9.461  -3.444  -9.624
  340    HE1  MET  46           HE1      MET  46 -10.767  -2.645  -6.007
  341    HE2  MET  46           HE2      MET  46  -9.779  -1.231  -6.376
  342    HE3  MET  46           HE3      MET  46  -9.257  -2.371  -5.136
  343    H    THR  47           H        THR  47  -8.381  -0.316 -11.954
  344    HA   THR  47           HA       THR  47  -7.642  -2.747 -13.051
  345    HB   THR  47           HB       THR  47  -6.782  -0.025 -14.057
  346    HG1  THR  47           HG1      THR  47  -8.756   0.044 -15.098
  347   HG21  THR  47          HG21      THR  47  -6.801  -1.074 -16.257
  348   HG22  THR  47          HG22      THR  47  -7.283  -2.610 -15.537
  349   HG23  THR  47          HG23      THR  47  -5.697  -1.928 -15.178
  350    H    LYS  48           H        LYS  48  -5.512  -0.076 -12.034
  351    HA   LYS  48           HA       LYS  48  -3.147  -1.515 -12.721
  352    HB2  LYS  48           HB2      LYS  48  -1.942   0.345 -11.646
  353    HB3  LYS  48           HB3      LYS  48  -3.090   0.863 -12.870
  354    HG2  LYS  48           HG2      LYS  48  -4.701   1.274 -10.955
  355    HG3  LYS  48           HG3      LYS  48  -3.301   1.100  -9.897
  356    HD2  LYS  48           HD2      LYS  48  -3.630   3.093 -12.134
  357    HD3  LYS  48           HD3      LYS  48  -3.669   3.427 -10.407
  358    HE2  LYS  48           HE2      LYS  48  -1.354   2.819 -10.176
  359    HE3  LYS  48           HE3      LYS  48  -1.291   2.283 -11.854
  360    HZ1  LYS  48           HZ1      LYS  48  -1.682   5.069 -10.899
  361    HZ2  LYS  48           HZ2      LYS  48  -1.773   4.590 -12.522
  362    HZ3  LYS  48           HZ3      LYS  48  -0.308   4.446 -11.681
  363    H    LEU  49           H        LEU  49  -5.058  -1.182  -9.839
  364    HA   LEU  49           HA       LEU  49  -3.172  -2.155  -7.981
  365    HG   LEU  49           HG       LEU  49  -5.916  -0.825  -5.915
  366    HB2  LEU  49           HB2      LEU  49  -6.156  -2.008  -8.050
  367    HB3  LEU  49           HB3      LEU  49  -5.394  -3.011  -6.831
  368   HD11  LEU  49          HD11      LEU  49  -2.952  -1.157  -6.349
  369   HD12  LEU  49          HD12      LEU  49  -3.912  -1.968  -5.112
  370   HD13  LEU  49          HD13      LEU  49  -3.718  -0.216  -5.069
  371   HD21  LEU  49          HD21      LEU  49  -4.136   0.269  -8.088
  372   HD22  LEU  49          HD22      LEU  49  -4.818   1.196  -6.753
  373   HD23  LEU  49          HD23      LEU  49  -5.882   0.482  -7.964
  374    H    LYS  50           H        LYS  50  -5.260  -3.738 -10.287
  375    HA   LYS  50           HA       LYS  50  -5.066  -6.391  -9.472
  376    HB2  LYS  50           HB2      LYS  50  -5.625  -4.951 -11.964
  377    HB3  LYS  50           HB3      LYS  50  -4.928  -6.540 -12.221
  378    HG2  LYS  50           HG2      LYS  50  -7.377  -6.565 -12.249
  379    HG3  LYS  50           HG3      LYS  50  -6.707  -7.576 -10.970
  380    HD2  LYS  50           HD2      LYS  50  -7.222  -5.910  -9.313
  381    HD3  LYS  50           HD3      LYS  50  -7.730  -4.767 -10.561
  382    HE2  LYS  50           HE2      LYS  50  -9.640  -5.850  -9.443
  383    HE3  LYS  50           HE3      LYS  50  -9.581  -6.196 -11.170
  384    HZ1  LYS  50           HZ1      LYS  50 -10.086  -8.201 -10.006
  385    HZ2  LYS  50           HZ2      LYS  50  -8.770  -8.011  -8.958
  386    HZ3  LYS  50           HZ3      LYS  50  -8.506  -8.340 -10.598
  387    H    GLU  51           H        GLU  51  -2.814  -4.429 -11.349
  388    HA   GLU  51           HA       GLU  51  -0.929  -6.546 -11.763
  389    HB2  GLU  51           HB2      GLU  51  -0.580  -3.550 -11.961
  390    HB3  GLU  51           HB3      GLU  51   0.576  -4.746 -12.526
  391    HG2  GLU  51           HG2      GLU  51  -1.056  -5.564 -14.137
  392    HG3  GLU  51           HG3      GLU  51  -2.218  -4.366 -13.570
  393    H    LEU  52           H        LEU  52  -1.073  -3.710  -9.658
  394    HA   LEU  52           HA       LEU  52   1.442  -3.962  -8.493
  395    HG   LEU  52           HG       LEU  52  -0.405  -1.683  -9.449
  396    HB2  LEU  52           HB2      LEU  52  -1.070  -2.768  -7.322
  397    HB3  LEU  52           HB3      LEU  52   0.551  -2.509  -6.705
  398   HD11  LEU  52          HD11      LEU  52   0.115  -0.024  -6.986
  399   HD12  LEU  52          HD12      LEU  52  -1.470  -0.388  -7.671
  400   HD13  LEU  52          HD13      LEU  52  -0.319   0.589  -8.583
  401   HD21  LEU  52          HD21      LEU  52   2.166  -1.079  -7.990
  402   HD22  LEU  52          HD22      LEU  52   1.703  -0.481  -9.584
  403   HD23  LEU  52          HD23      LEU  52   1.992  -2.204  -9.339
  404    H    ALA  53           H        ALA  53  -1.667  -5.309  -7.429
  405    HA   ALA  53           HA       ALA  53  -0.850  -6.244  -4.923
  406    HB1  ALA  53           HB1      ALA  53  -2.798  -7.691  -4.992
  407    HB2  ALA  53           HB2      ALA  53  -2.938  -7.454  -6.733
  408    HB3  ALA  53           HB3      ALA  53  -3.200  -6.099  -5.636
  409    H    ALA  54           H        ALA  54  -0.648  -7.757  -8.103
  410    HA   ALA  54           HA       ALA  54   0.215 -10.293  -7.085
  411    HB1  ALA  54           HB1      ALA  54  -1.017 -10.146  -9.176
  412    HB2  ALA  54           HB2      ALA  54   0.565 -10.886  -9.429
  413    HB3  ALA  54           HB3      ALA  54   0.292  -9.207  -9.895
  414    H    ALA  55           H        ALA  55   1.788  -7.381  -8.178
  415    HA   ALA  55           HA       ALA  55   4.379  -8.606  -8.466
  416    HB1  ALA  55           HB1      ALA  55   3.614  -5.690  -8.391
  417    HB2  ALA  55           HB2      ALA  55   3.744  -6.689  -9.838
  418    HB3  ALA  55           HB3      ALA  55   5.181  -6.339  -8.878
  419    H    ALA  56           H        ALA  56   2.649  -6.823  -6.000
  420    HA   ALA  56           HA       ALA  56   4.979  -6.422  -4.346
  421    HB1  ALA  56           HB1      ALA  56   3.400  -5.477  -2.732
  422    HB2  ALA  56           HB2      ALA  56   2.053  -6.011  -3.736
  423    HB3  ALA  56           HB3      ALA  56   3.173  -4.792  -4.341
  424    H    SER  57           H        SER  57   2.186  -8.595  -4.362
  425    HA   SER  57           HA       SER  57   2.995  -9.790  -1.852
  426    HG   SER  57           HG       SER  57   0.090 -11.909  -2.331
  427    HB2  SER  57           HB2      SER  57   0.614  -9.433  -2.265
  428    HB3  SER  57           HB3      SER  57   0.697 -10.424  -3.720
  429    H    SER  58           H        SER  58   4.206 -11.520  -1.648
  430    HA   SER  58           HA       SER  58   5.280 -12.873  -3.938
  431    HG   SER  58           HG       SER  58   6.264 -11.410  -1.387
  432    HB2  SER  58           HB2      SER  58   5.582 -13.522  -0.999
  433    HB3  SER  58           HB3      SER  58   6.618 -14.083  -2.310
  434    H    ALA  59           H        ALA  59   2.332 -13.169  -2.916
  435    HA   ALA  59           HA       ALA  59   2.170 -16.048  -2.544
  436    HB1  ALA  59           HB1      ALA  59  -0.200 -15.675  -2.168
  437    HB2  ALA  59           HB2      ALA  59  -0.030 -13.990  -2.658
  438    HB3  ALA  59           HB3      ALA  59   0.763 -14.568  -1.192
  439    H    ASP  60           H        ASP  60   2.930 -14.600  -5.123
  440    HA   ASP  60           HA       ASP  60   2.882 -15.146  -7.324
  441    HB2  ASP  60           HB2      ASP  60   1.112 -17.339  -6.292
  442    HB3  ASP  60           HB3      ASP  60   1.317 -17.094  -8.019
  443    H    GLU  61           H        GLU  61  -0.467 -15.691  -6.278
  444    HA   GLU  61           HA       GLU  61  -1.373 -14.295  -8.675
  445    HB2  GLU  61           HB2      GLU  61  -2.931 -15.909  -6.645
  446    HB3  GLU  61           HB3      GLU  61  -3.527 -15.336  -8.199
  447    HG2  GLU  61           HG2      GLU  61  -1.993 -16.747  -9.379
  448    HG3  GLU  61           HG3      GLU  61  -1.211 -17.225  -7.874
  449    H    GLY  62           H        GLY  62  -0.278 -12.792  -6.460
  450    HA2  GLY  62           HA2      GLY  62  -0.800 -10.663  -5.672
  451    HA3  GLY  62           HA3      GLY  62  -2.479 -10.938  -6.117
  452    H    ALA  63           H        ALA  63  -3.631 -10.631  -4.326
  453    HA   ALA  63           HA       ALA  63  -3.029 -12.258  -1.984
  454    HB1  ALA  63           HB1      ALA  63  -3.425  -9.269  -1.807
  455    HB2  ALA  63           HB2      ALA  63  -1.887 -10.107  -1.599
  456    HB3  ALA  63           HB3      ALA  63  -3.201 -10.378  -0.454
  457    H    SER  64           H        SER  64  -4.876 -11.977  -0.339
  458    HA   SER  64           HA       SER  64  -7.351 -12.395  -1.725
  459    HG   SER  64           HG       SER  64  -6.207 -14.120  -0.499
  460    HB2  SER  64           HB2      SER  64  -6.672 -12.252   1.215
  461    HB3  SER  64           HB3      SER  64  -8.271 -12.646   0.589
  462    H    VAL  65           H        VAL  65  -8.164 -10.562  -2.661
  463    HA   VAL  65           HA       VAL  65  -8.440  -8.231  -0.892
  464    HB   VAL  65           HB       VAL  65  -7.067  -7.663  -2.777
  465   HG11  VAL  65          HG11      VAL  65  -7.873  -7.794  -5.091
  466   HG12  VAL  65          HG12      VAL  65  -9.317  -8.637  -4.530
  467   HG13  VAL  65          HG13      VAL  65  -7.731  -9.385  -4.347
  468   HG21  VAL  65          HG21      VAL  65  -8.616  -5.957  -1.992
  469   HG22  VAL  65          HG22      VAL  65  -9.837  -6.528  -3.127
  470   HG23  VAL  65          HG23      VAL  65  -8.344  -5.810  -3.729
  471    H    ALA  66           H        ALA  66 -10.360  -8.038  -0.080
  472    HA   ALA  66           HA       ALA  66 -12.713  -8.754  -1.662
  473    HB1  ALA  66           HB1      ALA  66 -13.971  -8.315   0.423
  474    HB2  ALA  66           HB2      ALA  66 -12.459  -7.888   1.225
  475    HB3  ALA  66           HB3      ALA  66 -12.715  -9.534   0.645
  476    H    TYR  67           H        TYR  67 -13.008  -7.161  -3.132
  477    HA   TYR  67           HA       TYR  67 -12.944  -4.397  -2.130
  478    HD1  TYR  67           HD1      TYR  67 -11.303  -7.260  -4.685
  479    HD2  TYR  67           HD2      TYR  67 -12.926  -3.685  -6.329
  480    HE1  TYR  67           HE1      TYR  67 -11.489  -8.360  -6.879
  481    HE2  TYR  67           HE2      TYR  67 -13.128  -4.777  -8.522
  482    HH   TYR  67           HH       TYR  67 -13.046  -7.985  -9.005
  483    HB2  TYR  67           HB2      TYR  67 -11.985  -3.640  -4.187
  484    HB3  TYR  67           HB3      TYR  67 -11.000  -4.969  -3.598
  485    H    LYS  68           H        LYS  68 -14.322  -2.894  -3.190
  486    HA   LYS  68           HA       LYS  68 -16.391  -3.973  -4.922
  487    HB2  LYS  68           HB2      LYS  68 -18.235  -3.277  -3.550
  488    HB3  LYS  68           HB3      LYS  68 -17.207  -4.328  -2.588
  489    HG2  LYS  68           HG2      LYS  68 -16.214  -2.357  -1.513
  490    HG3  LYS  68           HG3      LYS  68 -17.294  -1.321  -2.448
  491    HD2  LYS  68           HD2      LYS  68 -18.281  -1.590  -0.300
  492    HD3  LYS  68           HD3      LYS  68 -19.216  -2.577  -1.421
  493    HE2  LYS  68           HE2      LYS  68 -18.884  -3.871   0.543
  494    HE3  LYS  68           HE3      LYS  68 -17.832  -4.539  -0.704
  495    HZ1  LYS  68           HZ1      LYS  68 -15.976  -3.309   0.267
  496    HZ2  LYS  68           HZ2      LYS  68 -16.673  -4.364   1.397
  497    HZ3  LYS  68           HZ3      LYS  68 -17.000  -2.704   1.478
  498    H    ILE  69           H        ILE  69 -17.665  -2.342  -5.905
  499    HA   ILE  69           HA       ILE  69 -16.458   0.350  -5.817
  500    HB   ILE  69           HB       ILE  69 -17.740  -0.908  -8.253
  501   HG12  ILE  69          HG12      ILE  69 -14.774  -0.645  -7.711
  502   HG13  ILE  69          HG13      ILE  69 -15.672  -2.142  -7.491
  503   HG21  ILE  69          HG21      ILE  69 -16.557   0.913  -9.427
  504   HG22  ILE  69          HG22      ILE  69 -15.992   1.518  -7.868
  505   HG23  ILE  69          HG23      ILE  69 -17.715   1.513  -8.240
  506   HD11  ILE  69          HD11      ILE  69 -16.232  -2.154  -9.861
  507   HD12  ILE  69          HD12      ILE  69 -14.488  -2.125  -9.602
  508   HD13  ILE  69          HD13      ILE  69 -15.334  -0.652 -10.078
  509    H    LYS  70           H        LYS  70 -17.931   1.612  -4.773
  510    HA   LYS  70           HA       LYS  70 -20.745   0.772  -5.003
  511    HB2  LYS  70           HB2      LYS  70 -19.759   0.526  -2.786
  512    HB3  LYS  70           HB3      LYS  70 -19.341   2.229  -2.771
  513    HG2  LYS  70           HG2      LYS  70 -21.680   2.835  -2.749
  514    HG3  LYS  70           HG3      LYS  70 -22.143   1.132  -2.863
  515    HD2  LYS  70           HD2      LYS  70 -21.186   0.657  -0.727
  516    HD3  LYS  70           HD3      LYS  70 -20.450   2.256  -0.642
  517    HE2  LYS  70           HE2      LYS  70 -22.733   3.237  -0.616
  518    HE3  LYS  70           HE3      LYS  70 -23.387   1.599  -0.537
  519    HZ1  LYS  70           HZ1      LYS  70 -21.474   2.705   1.437
  520    HZ2  LYS  70           HZ2      LYS  70 -22.331   1.251   1.550
  521    HZ3  LYS  70           HZ3      LYS  70 -23.152   2.731   1.654
  522    H    ASP  71           H        ASP  71 -22.067   2.030  -5.988
  523    HA   ASP  71           HA       ASP  71 -21.290   4.625  -6.932
  524    HB2  ASP  71           HB2      ASP  71 -23.852   3.038  -7.179
  525    HB3  ASP  71           HB3      ASP  71 -23.602   4.609  -7.922
  526    H    LEU  72           H        LEU  72 -21.693   6.519  -5.964
  527    HA   LEU  72           HA       LEU  72 -23.838   6.620  -3.944
  528    HG   LEU  72           HG       LEU  72 -20.941   5.794  -3.192
  529    HB2  LEU  72           HB2      LEU  72 -21.228   8.143  -3.938
  530    HB3  LEU  72           HB3      LEU  72 -22.515   8.332  -2.762
  531   HD11  LEU  72          HD11      LEU  72 -20.721   7.863  -1.013
  532   HD12  LEU  72          HD12      LEU  72 -19.538   7.573  -2.288
  533   HD13  LEU  72          HD13      LEU  72 -19.852   6.328  -1.078
  534   HD21  LEU  72          HD21      LEU  72 -22.925   6.574  -1.059
  535   HD22  LEU  72          HD22      LEU  72 -21.979   5.085  -1.088
  536   HD23  LEU  72          HD23      LEU  72 -23.185   5.388  -2.340
  537    H    GLU  73           H        GLU  73 -24.191   9.178  -3.512
  538    HA   GLU  73           HA       GLU  73 -25.155  10.148  -6.072
  539    HB2  GLU  73           HB2      GLU  73 -26.676  10.224  -4.167
  540    HB3  GLU  73           HB3      GLU  73 -25.536  11.213  -3.265
  541    HG2  GLU  73           HG2      GLU  73 -25.819  13.035  -4.826
  542    HG3  GLU  73           HG3      GLU  73 -26.870  12.040  -5.835
  543    H    GLY  74           H        GLY  74 -23.579  11.043  -7.249
  544    HA2  GLY  74           HA2      GLY  74 -22.472  13.025  -7.892
  545    HA3  GLY  74           HA3      GLY  74 -22.400  13.509  -6.203
  546    H    GLN  75           H        GLN  75 -21.510  10.406  -6.143
  547    HA   GLN  75           HA       GLN  75 -18.835  10.529  -7.122
  548    HB2  GLN  75           HB2      GLN  75 -17.708  10.376  -4.924
  549    HB3  GLN  75           HB3      GLN  75 -18.490  11.930  -5.166
  550    HG2  GLN  75           HG2      GLN  75 -20.338  11.249  -3.750
  551    HG3  GLN  75           HG3      GLN  75 -19.617   9.653  -3.549
  552   HE21  GLN  75          HE21      GLN  75 -19.524   9.909  -1.314
  553   HE22  GLN  75          HE22      GLN  75 -18.363  10.937  -0.557
  554    H    VAL  76           H        VAL  76 -17.574   8.574  -6.111
  555    HA   VAL  76           HA       VAL  76 -19.378   6.413  -5.282
  556    HB   VAL  76           HB       VAL  76 -18.224   4.810  -6.763
  557   HG11  VAL  76          HG11      VAL  76 -19.283   5.466  -8.873
  558   HG12  VAL  76          HG12      VAL  76 -19.515   7.097  -8.244
  559   HG13  VAL  76          HG13      VAL  76 -20.349   5.736  -7.494
  560   HG21  VAL  76          HG21      VAL  76 -16.945   7.262  -7.959
  561   HG22  VAL  76          HG22      VAL  76 -16.858   5.632  -8.628
  562   HG23  VAL  76          HG23      VAL  76 -16.128   5.982  -7.061
  563    H    GLU  77           H        GLU  77 -18.277   4.739  -4.091
  564    HA   GLU  77           HA       GLU  77 -15.625   5.608  -3.177
  565    HB2  GLU  77           HB2      GLU  77 -16.001   4.468  -1.089
  566    HB3  GLU  77           HB3      GLU  77 -17.354   5.547  -1.398
  567    HG2  GLU  77           HG2      GLU  77 -18.632   3.611  -2.229
  568    HG3  GLU  77           HG3      GLU  77 -17.297   2.567  -1.768
  569    H    LEU  78           H        LEU  78 -13.966   4.456  -3.687
  570    HA   LEU  78           HA       LEU  78 -14.357   1.749  -4.719
  571    HG   LEU  78           HG       LEU  78 -11.364   2.071  -6.843
  572    HB2  LEU  78           HB2      LEU  78 -13.024   3.479  -6.002
  573    HB3  LEU  78           HB3      LEU  78 -11.830   3.403  -4.724
  574   HD11  LEU  78          HD11      LEU  78 -10.356   0.216  -5.639
  575   HD12  LEU  78          HD12      LEU  78 -11.330   0.596  -4.220
  576   HD13  LEU  78          HD13      LEU  78 -10.108   1.736  -4.780
  577   HD21  LEU  78          HD21      LEU  78 -13.603   1.142  -7.127
  578   HD22  LEU  78          HD22      LEU  78 -13.412   0.230  -5.629
  579   HD23  LEU  78          HD23      LEU  78 -12.381  -0.124  -7.015
  580    H    ASP  79           H        ASP  79 -14.260   0.218  -3.284
  581    HA   ASP  79           HA       ASP  79 -12.647   0.633  -0.855
  582    HB2  ASP  79           HB2      ASP  79 -14.931   0.375  -0.234
  583    HB3  ASP  79           HB3      ASP  79 -15.160  -0.969  -1.349
  584    H    ALA  80           H        ALA  80 -10.925  -0.608  -0.567
  585    HA   ALA  80           HA       ALA  80 -10.880  -3.273  -1.787
  586    HB1  ALA  80           HB1      ALA  80  -8.630  -1.275  -2.016
  587    HB2  ALA  80           HB2      ALA  80  -9.704  -1.773  -3.324
  588    HB3  ALA  80           HB3      ALA  80  -8.605  -2.943  -2.592
  589    H    ALA  81           H        ALA  81 -10.052  -4.793  -0.489
  590    HA   ALA  81           HA       ALA  81  -8.340  -3.968   1.745
  591    HB1  ALA  81           HB1      ALA  81 -10.606  -5.950   1.960
  592    HB2  ALA  81           HB2      ALA  81 -10.601  -4.316   2.624
  593    HB3  ALA  81           HB3      ALA  81  -9.471  -5.521   3.241
  594    H    PHE  82           H        PHE  82  -6.459  -4.770   1.023
  595    HA   PHE  82           HA       PHE  82  -6.382  -7.418  -0.227
  596    HD1  PHE  82           HD1      PHE  82  -5.594  -3.534  -0.710
  597    HD2  PHE  82           HD2      PHE  82  -4.781  -7.050  -2.965
  598    HE1  PHE  82           HE1      PHE  82  -6.273  -2.369  -2.766
  599    HE2  PHE  82           HE2      PHE  82  -5.464  -5.892  -5.024
  600    HZ   PHE  82           HZ       PHE  82  -6.211  -3.548  -4.928
  601    HB2  PHE  82           HB2      PHE  82  -4.187  -5.361   0.164
  602    HB3  PHE  82           HB3      PHE  82  -4.024  -6.864  -0.732
  603    H    THR  83           H        THR  83  -6.240  -9.072   1.133
  604    HA   THR  83           HA       THR  83  -4.675  -8.812   3.585
  605    HB   THR  83           HB       THR  83  -6.344 -11.141   2.602
  606    HG1  THR  83           HG1      THR  83  -7.791  -9.576   3.115
  607   HG21  THR  83          HG21      THR  83  -4.574 -11.807   4.166
  608   HG22  THR  83          HG22      THR  83  -6.170 -11.959   4.900
  609   HG23  THR  83          HG23      THR  83  -5.136 -10.592   5.316
  610    H    PHE  84           H        PHE  84  -2.578  -9.113   3.348
  611    HA   PHE  84           HA       PHE  84  -1.558 -10.803   1.205
  612    HD1  PHE  84           HD1      PHE  84   0.312  -9.110  -0.437
  613    HD2  PHE  84           HD2      PHE  84  -1.438  -7.065   2.863
  614    HE1  PHE  84           HE1      PHE  84  -0.129  -7.163  -1.878
  615    HE2  PHE  84           HE2      PHE  84  -1.881  -5.116   1.427
  616    HZ   PHE  84           HZ       PHE  84  -1.225  -5.166  -0.945
  617    HB2  PHE  84           HB2      PHE  84  -0.100  -9.045   3.196
  618    HB3  PHE  84           HB3      PHE  84   0.643  -9.882   1.838
  619    H    SER  85           H        SER  85   0.378 -12.204   1.771
  620    HA   SER  85           HA       SER  85  -0.405 -14.055   3.816
  621    HG   SER  85           HG       SER  85   2.931 -14.300   1.559
  622    HB2  SER  85           HB2      SER  85   1.742 -15.222   3.057
  623    HB3  SER  85           HB3      SER  85   0.494 -15.002   1.829
  624    H    CYS  86           H        CYS  86   1.762 -11.392   3.576
  625    HA   CYS  86           HA       CYS  86   2.579 -11.811   6.351
  626    HG   CYS  86           HG       CYS  86   3.665 -14.056   5.330
  627    HB2  CYS  86           HB2      CYS  86   4.499 -11.088   4.122
  628    HB3  CYS  86           HB3      CYS  86   4.899 -11.200   5.835
  629    H    GLN  87           H        GLN  87   3.202  -9.849   7.425
  630    HA   GLN  87           HA       GLN  87   1.643  -7.608   6.628
  631    HB2  GLN  87           HB2      GLN  87   1.970  -8.019   8.970
  632    HB3  GLN  87           HB3      GLN  87   3.717  -7.949   8.794
  633    HG2  GLN  87           HG2      GLN  87   3.654  -5.604   8.366
  634    HG3  GLN  87           HG3      GLN  87   1.895  -5.610   8.277
  635   HE21  GLN  87          HE21      GLN  87   0.707  -5.875  10.201
  636   HE22  GLN  87          HE22      GLN  87   1.420  -5.607  11.753
  637    H    ALA  88           H        ALA  88   5.037  -8.449   6.359
  638    HA   ALA  88           HA       ALA  88   6.099  -5.979   5.644
  639    HB1  ALA  88           HB1      ALA  88   7.472  -7.945   6.081
  640    HB2  ALA  88           HB2      ALA  88   7.864  -7.235   4.515
  641    HB3  ALA  88           HB3      ALA  88   6.882  -8.696   4.599
  642    H    GLU  89           H        GLU  89   4.429  -8.377   3.666
  643    HA   GLU  89           HA       GLU  89   4.795  -7.170   1.155
  644    HB2  GLU  89           HB2      GLU  89   2.366  -8.747   2.019
  645    HB3  GLU  89           HB3      GLU  89   3.005  -8.579   0.392
  646    HG2  GLU  89           HG2      GLU  89   4.415  -9.978   2.651
  647    HG3  GLU  89           HG3      GLU  89   3.448 -10.779   1.415
  648    H    MET  90           H        MET  90   2.536  -6.594   3.751
  649    HA   MET  90           HA       MET  90   0.690  -5.000   2.297
  650    HB2  MET  90           HB2      MET  90   0.107  -6.091   4.417
  651    HB3  MET  90           HB3      MET  90   1.273  -5.082   5.263
  652    HG2  MET  90           HG2      MET  90  -0.043  -3.092   4.529
  653    HG3  MET  90           HG3      MET  90  -1.262  -4.201   3.907
  654    HE1  MET  90           HE1      MET  90  -0.152  -3.668   8.349
  655    HE2  MET  90           HE2      MET  90   0.467  -2.670   7.032
  656    HE3  MET  90           HE3      MET  90   0.967  -4.356   7.173
  657    H    ILE  91           H        ILE  91   3.350  -4.175   4.521
  658    HA   ILE  91           HA       ILE  91   2.959  -1.391   4.243
  659    HB   ILE  91           HB       ILE  91   5.407  -1.341   5.180
  660   HG12  ILE  91          HG12      ILE  91   4.564  -4.143   5.928
  661   HG13  ILE  91          HG13      ILE  91   5.766  -3.787   4.700
  662   HG21  ILE  91          HG21      ILE  91   3.437  -0.662   6.406
  663   HG22  ILE  91          HG22      ILE  91   4.488  -1.626   7.442
  664   HG23  ILE  91          HG23      ILE  91   3.036  -2.346   6.746
  665   HD11  ILE  91          HD11      ILE  91   7.175  -2.722   6.372
  666   HD12  ILE  91          HD12      ILE  91   6.792  -4.384   6.825
  667   HD13  ILE  91          HD13      ILE  91   5.958  -3.043   7.607
  668    H    ILE  92           H        ILE  92   5.196  -3.652   2.604
  669    HA   ILE  92           HA       ILE  92   6.603  -1.617   1.239
  670    HB   ILE  92           HB       ILE  92   7.311  -3.354  -0.356
  671   HG12  ILE  92          HG12      ILE  92   6.590  -5.769   0.593
  672   HG13  ILE  92          HG13      ILE  92   5.106  -4.873   0.903
  673   HG21  ILE  92          HG21      ILE  92   7.462  -4.140   2.542
  674   HG22  ILE  92          HG22      ILE  92   8.546  -3.046   1.685
  675   HG23  ILE  92          HG23      ILE  92   8.509  -4.757   1.265
  676   HD11  ILE  92          HD11      ILE  92   5.025  -4.234  -1.465
  677   HD12  ILE  92          HD12      ILE  92   4.994  -5.982  -1.237
  678   HD13  ILE  92          HD13      ILE  92   6.481  -5.186  -1.756
  679    H    PHE  93           H        PHE  93   3.571  -3.198   0.656
  680    HA   PHE  93           HA       PHE  93   3.155  -2.405  -2.018
  681    HD1  PHE  93           HD2      PHE  93   1.496  -3.701  -3.456
  682    HD2  PHE  93           HD1      PHE  93  -0.917  -2.126  -0.320
  683    HE1  PHE  93           HE2      PHE  93  -0.353  -3.383  -5.044
  684    HE2  PHE  93           HE1      PHE  93  -2.771  -1.808  -1.906
  685    HZ   PHE  93           HZ       PHE  93  -2.488  -2.437  -4.270
  686    HB2  PHE  93           HB2      PHE  93   1.859  -4.170  -0.897
  687    HB3  PHE  93           HB3      PHE  93   1.156  -2.976   0.182
  688    H    GLU  94           H        GLU  94   2.081  -0.966   1.062
  689    HA   GLU  94           HA       GLU  94   0.842   1.250  -0.225
  690    HB2  GLU  94           HB2      GLU  94   0.652   2.184   2.091
  691    HB3  GLU  94           HB3      GLU  94  -0.063   0.596   1.868
  692    HG2  GLU  94           HG2      GLU  94   1.847  -0.442   2.935
  693    HG3  GLU  94           HG3      GLU  94   2.628   1.130   3.108
  694    H    LEU  95           H        LEU  95   4.046   0.678   1.059
  695    HA   LEU  95           HA       LEU  95   4.931   3.353   1.095
  696    HG   LEU  95           HG       LEU  95   5.619   0.965   2.906
  697    HB2  LEU  95           HB2      LEU  95   6.442   0.786   0.609
  698    HB3  LEU  95           HB3      LEU  95   7.221   2.349   0.753
  699   HD11  LEU  95          HD11      LEU  95   8.574   1.524   2.707
  700   HD12  LEU  95          HD12      LEU  95   7.809  -0.049   2.490
  701   HD13  LEU  95          HD13      LEU  95   7.743   0.753   4.058
  702   HD21  LEU  95          HD21      LEU  95   7.075   3.606   2.931
  703   HD22  LEU  95          HD22      LEU  95   6.412   2.800   4.354
  704   HD23  LEU  95          HD23      LEU  95   5.334   3.357   3.073
  705    H    SER  96           H        SER  96   5.211   0.869  -1.449
  706    HA   SER  96           HA       SER  96   6.279   2.505  -3.439
  707    HG   SER  96           HG       SER  96   7.265   0.343  -4.090
  708    HB2  SER  96           HB2      SER  96   4.471   0.092  -3.669
  709    HB3  SER  96           HB3      SER  96   5.293   0.839  -5.037
  710    H    LEU  97           H        LEU  97   2.891   1.922  -2.567
  711    HA   LEU  97           HA       LEU  97   1.668   3.321  -4.644
  712    HG   LEU  97           HG       LEU  97   0.902   0.888  -2.736
  713    HB2  LEU  97           HB2      LEU  97   0.792   3.113  -1.760
  714    HB3  LEU  97           HB3      LEU  97  -0.222   3.671  -3.075
  715   HD11  LEU  97          HD11      LEU  97  -1.446   0.256  -2.480
  716   HD12  LEU  97          HD12      LEU  97  -1.912   1.953  -2.591
  717   HD13  LEU  97          HD13      LEU  97  -0.938   1.394  -1.230
  718   HD21  LEU  97          HD21      LEU  97  -0.400   0.312  -4.715
  719   HD22  LEU  97          HD22      LEU  97   0.824   1.525  -5.096
  720   HD23  LEU  97          HD23      LEU  97  -0.865   2.000  -4.912
  721    H    ARG  98           H        ARG  98   2.750   4.502  -1.474
  722    HA   ARG  98           HA       ARG  98   1.961   7.190  -1.973
  723    HE   ARG  98           HE       ARG  98   0.164   7.000   2.877
  724    HB2  ARG  98           HB2      ARG  98   3.779   5.962   0.090
  725    HB3  ARG  98           HB3      ARG  98   3.415   7.681   0.040
  726    HG2  ARG  98           HG2      ARG  98   1.054   7.209   0.351
  727    HG3  ARG  98           HG3      ARG  98   1.393   5.477   0.345
  728    HD2  ARG  98           HD2      ARG  98   2.770   5.729   2.331
  729    HD3  ARG  98           HD3      ARG  98   2.467   7.465   2.340
  730   HH11  ARG  98          HH11      ARG  98   2.323   4.249   3.067
  731   HH12  ARG  98          HH12      ARG  98   1.293   3.341   4.136
  732   HH21  ARG  98          HH21      ARG  98  -1.182   5.840   4.283
  733   HH22  ARG  98          HH22      ARG  98  -0.710   4.253   4.823
  734    H    SER  99           H        SER  99   4.895   5.362  -2.507
  735    HA   SER  99           HA       SER  99   6.612   7.558  -2.975
  736    HG   SER  99           HG       SER  99   8.460   6.977  -4.107
  737    HB2  SER  99           HB2      SER  99   7.372   5.213  -2.554
  738    HB3  SER  99           HB3      SER  99   6.804   4.780  -4.166
  739    H    LEU 100           H        LEU 100   4.294   5.876  -4.956
  740    HA   LEU 100           HA       LEU 100   5.137   7.203  -7.392
  741    HG   LEU 100           HG       LEU 100   3.685   6.633  -9.363
  742    HB2  LEU 100           HB2      LEU 100   4.305   4.902  -7.436
  743    HB3  LEU 100           HB3      LEU 100   2.765   5.429  -6.799
  744   HD11  LEU 100          HD11      LEU 100   4.163   4.228  -9.619
  745   HD12  LEU 100          HD12      LEU 100   2.828   4.756 -10.642
  746   HD13  LEU 100          HD13      LEU 100   2.499   3.864  -9.156
  747   HD21  LEU 100          HD21      LEU 100   1.304   6.580  -9.859
  748   HD22  LEU 100          HD22      LEU 100   1.583   7.334  -8.289
  749   HD23  LEU 100          HD23      LEU 100   0.997   5.674  -8.378
  750    H    ALA 101           H        ALA 101   2.327   7.214  -5.243
  751    HA   ALA 101           HA       ALA 101   1.096   9.405  -6.669
  752    HB1  ALA 101           HB1      ALA 101  -0.725   9.123  -5.063
  753    HB2  ALA 101           HB2      ALA 101   0.257   7.985  -4.140
  754    HB3  ALA 101           HB3      ALA 101  -0.262   7.578  -5.777
  755    H    LEU 102           H        LEU 102   3.696   9.831  -5.270
  756    HA   LEU 102           HA       LEU 102   3.433  11.351  -2.951
  757    HG   LEU 102           HG       LEU 102   5.650   9.612  -3.585
  758    HB2  LEU 102           HB2      LEU 102   5.384  11.465  -5.229
  759    HB3  LEU 102           HB3      LEU 102   5.483  12.610  -3.907
  760   HD11  LEU 102          HD11      LEU 102   7.834  11.693  -3.584
  761   HD12  LEU 102          HD12      LEU 102   7.563  10.476  -4.831
  762   HD13  LEU 102          HD13      LEU 102   8.035   9.983  -3.204
  763   HD21  LEU 102          HD21      LEU 102   6.214  11.860  -1.655
  764   HD22  LEU 102          HD22      LEU 102   6.419  10.138  -1.336
  765   HD23  LEU 102          HD23      LEU 102   4.807  10.799  -1.613
  766    H    GLU 103           H        GLU 103   3.931  12.726  -6.188
  767    HA   GLU 103           HA       GLU 103   3.389  14.702  -7.134
  768    HB2  GLU 103           HB2      GLU 103   1.031  14.518  -5.261
  769    HB3  GLU 103           HB3      GLU 103   1.212  15.778  -6.475
  770    HG2  GLU 103           HG2      GLU 103   1.384  13.932  -8.186
  771    HG3  GLU 103           HG3      GLU 103   0.877  12.824  -6.909
  772    H    HIS 104           H        HIS 104   2.485  15.178  -3.720
  773    HA   HIS 104           HA       HIS 104   4.307  17.489  -3.668
  774    HD1  HIS 104           HD1      HIS 104   0.064  16.779  -3.566
  775    HD2  HIS 104           HD2      HIS 104   1.893  16.369   0.156
  776    HE1  HIS 104           HE1      HIS 104  -1.539  15.445  -2.156
  777    HE2  HIS 104           HE2      HIS 104  -0.470  15.314   0.125
  778    HB2  HIS 104           HB2      HIS 104   2.923  18.253  -1.688
  779    HB3  HIS 104           HB3      HIS 104   2.113  18.296  -3.244
  780    H    HIS 105           H        HIS 105   6.177  16.611  -3.030
  781    HA   HIS 105           HA       HIS 105   6.342  14.644  -0.964
  782    HD1  HIS 105           HD1      HIS 105  10.694  16.454  -1.463
  783    HD2  HIS 105           HD2      HIS 105   7.432  17.567  -3.788
  784    HE1  HIS 105           HE1      HIS 105  11.382  18.573  -2.630
  785    HE2  HIS 105           HE2      HIS 105   9.320  19.327  -3.874
  786    HB2  HIS 105           HB2      HIS 105   8.793  14.928  -1.148
  787    HB3  HIS 105           HB3      HIS 105   8.035  14.657  -2.710
  788    H    HIS 106           H        HIS 106   5.347  15.482   0.826
  789    HA   HIS 106           HA       HIS 106   6.680  17.761   2.121
  790    HD1  HIS 106           HD1      HIS 106   3.429  18.384   4.472
  791    HD2  HIS 106           HD2      HIS 106   5.517  20.806   1.804
  792    HE1  HIS 106           HE1      HIS 106   3.547  20.652   5.557
  793    HE2  HIS 106           HE2      HIS 106   4.634  22.142   3.837
  794    HB2  HIS 106           HB2      HIS 106   4.514  18.348   0.893
  795    HB3  HIS 106           HB3      HIS 106   3.688  17.375   2.102
  796    H    HIS 107           H        HIS 107   7.627  16.702   3.797
  797    HA   HIS 107           HA       HIS 107   5.866  15.090   5.528
  798    HD1  HIS 107           HD1      HIS 107   9.905  12.884   4.582
  799    HD2  HIS 107           HD2      HIS 107   5.769  13.180   4.198
  800    HE1  HIS 107           HE1      HIS 107   9.216  10.957   3.121
  801    HE2  HIS 107           HE2      HIS 107   6.737  11.258   2.758
  802    HB2  HIS 107           HB2      HIS 107   8.886  15.180   5.337
  803    HB3  HIS 107           HB3      HIS 107   8.014  14.321   6.605
  804    H    HIS 108           H        HIS 108   4.984  17.258   6.054
  805    HA   HIS 108           HA       HIS 108   4.667  19.012   7.427
  806    HD1  HIS 108           HD1      HIS 108   5.757  15.687  10.169
  807    HD2  HIS 108           HD2      HIS 108   3.017  18.720   9.407
  808    HE1  HIS 108           HE1      HIS 108   3.549  14.834  11.009
  809    HE2  HIS 108           HE2      HIS 108   1.882  16.630  10.428
  810    HB2  HIS 108           HB2      HIS 108   6.804  17.610   9.021
  811    HB3  HIS 108           HB3      HIS 108   6.076  19.121   9.557
  812    H    HIS 109           H        HIS 109   5.831  20.994   8.414
  813    HA   HIS 109           HA       HIS 109   8.287  21.683   7.048
  814    HD1  HIS 109           HD1      HIS 109   8.409  22.567   3.904
  815    HD2  HIS 109           HD2      HIS 109   7.375  25.638   6.512
  816    HE1  HIS 109           HE1      HIS 109   9.695  24.577   3.123
  817    HE2  HIS 109           HE2      HIS 109   9.148  26.391   4.782
  818    HB2  HIS 109           HB2      HIS 109   6.414  22.015   5.367
  819    HB3  HIS 109           HB3      HIS 109   5.792  23.273   6.427
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1  62.440  16.533   6.463
    2    H1   MET   1           H1       MET   1  64.350  16.687   4.206
    3    H2   MET   1           H2       MET   1  64.373  15.586   5.497
    4    H3   MET   1           H3       MET   1  64.660  17.234   5.780
    5    HB2  MET   1           HB2      MET   1  61.231  18.361   5.369
    6    HB3  MET   1           HB3      MET   1  62.849  18.866   5.828
    7    HG2  MET   1           HG2      MET   1  63.591  18.568   3.514
    8    HG3  MET   1           HG3      MET   1  61.958  18.080   3.064
    9    HE1  MET   1           HE1      MET   1  63.537  20.405   1.580
   10    HE2  MET   1           HE2      MET   1  62.272  21.626   1.430
   11    HE3  MET   1           HE3      MET   1  61.893  19.925   1.156
   12    H    ALA   2           H        ALA   2  60.486  15.563   5.979
   13    HA   ALA   2           HA       ALA   2  60.567  13.937   3.551
   14    HB1  ALA   2           HB1      ALA   2  60.289  12.776   5.691
   15    HB2  ALA   2           HB2      ALA   2  58.906  12.531   4.623
   16    HB3  ALA   2           HB3      ALA   2  58.789  13.665   5.969
   17    H    MET   3           H        MET   3  58.558  13.512   2.421
   18    HA   MET   3           HA       MET   3  56.434  15.469   2.688
   19    HB2  MET   3           HB2      MET   3  56.441  15.956   0.252
   20    HB3  MET   3           HB3      MET   3  57.875  16.558   1.069
   21    HG2  MET   3           HG2      MET   3  59.124  14.595   0.259
   22    HG3  MET   3           HG3      MET   3  57.685  14.067  -0.610
   23    HE1  MET   3           HE1      MET   3  60.088  15.302  -3.468
   24    HE2  MET   3           HE2      MET   3  59.156  13.944  -2.838
   25    HE3  MET   3           HE3      MET   3  60.575  14.521  -1.963
   26    H    LYS   4           H        LYS   4  54.452  14.647   2.044
   27    HA   LYS   4           HA       LYS   4  54.488  11.862   1.085
   28    HB2  LYS   4           HB2      LYS   4  52.888  12.985   3.389
   29    HB3  LYS   4           HB3      LYS   4  52.588  11.412   2.664
   30    HG2  LYS   4           HG2      LYS   4  54.794  10.654   3.314
   31    HG3  LYS   4           HG3      LYS   4  55.171  12.250   3.967
   32    HD2  LYS   4           HD2      LYS   4  53.406  12.012   5.620
   33    HD3  LYS   4           HD3      LYS   4  52.959  10.445   4.941
   34    HE2  LYS   4           HE2      LYS   4  55.086   9.512   5.566
   35    HE3  LYS   4           HE3      LYS   4  55.665  11.089   6.105
   36    HZ1  LYS   4           HZ1      LYS   4  54.042  11.092   7.855
   37    HZ2  LYS   4           HZ2      LYS   4  54.933   9.649   7.943
   38    HZ3  LYS   4           HZ3      LYS   4  53.363   9.639   7.299
   39    H    ASP   5           H        ASP   5  53.539  11.865  -0.815
   40    HA   ASP   5           HA       ASP   5  51.160  13.551  -1.210
   41    HB2  ASP   5           HB2      ASP   5  52.943  13.976  -2.818
   42    HB3  ASP   5           HB3      ASP   5  53.007  12.268  -3.237
   43    H    VAL   6           H        VAL   6  50.120  11.887   0.149
   44    HA   VAL   6           HA       VAL   6  49.189   9.618  -1.486
   45    HB   VAL   6           HB       VAL   6  49.468   9.591   1.515
   46   HG11  VAL   6          HG11      VAL   6  49.108   7.177   1.284
   47   HG12  VAL   6          HG12      VAL   6  48.899   7.386  -0.454
   48   HG13  VAL   6          HG13      VAL   6  47.744   8.110   0.665
   49   HG21  VAL   6          HG21      VAL   6  51.695   9.687   0.530
   50   HG22  VAL   6          HG22      VAL   6  51.292   8.342  -0.539
   51   HG23  VAL   6          HG23      VAL   6  51.386   8.084   1.202
   52    H    VAL   7           H        VAL   7  47.292  10.487  -2.139
   53    HA   VAL   7           HA       VAL   7  45.300  11.064  -0.077
   54    HB   VAL   7           HB       VAL   7  45.762  12.965  -2.385
   55   HG11  VAL   7          HG11      VAL   7  44.083  14.353  -1.281
   56   HG12  VAL   7          HG12      VAL   7  43.878  13.121  -0.036
   57   HG13  VAL   7          HG13      VAL   7  43.426  12.771  -1.703
   58   HG21  VAL   7          HG21      VAL   7  47.544  13.223  -0.760
   59   HG22  VAL   7          HG22      VAL   7  46.365  13.334   0.547
   60   HG23  VAL   7          HG23      VAL   7  46.444  14.599  -0.681
   61    H    ASP   8           H        ASP   8  43.973   9.382  -0.590
   62    HA   ASP   8           HA       ASP   8  42.496   9.819  -3.076
   63    HB2  ASP   8           HB2      ASP   8  42.210   7.460  -3.525
   64    HB3  ASP   8           HB3      ASP   8  43.926   7.828  -3.460
   65    H    LYS   9           H        LYS   9  40.338   9.733  -2.886
   66    HA   LYS   9           HA       LYS   9  39.165   8.723  -0.411
   67    HB2  LYS   9           HB2      LYS   9  39.589  11.075   0.049
   68    HB3  LYS   9           HB3      LYS   9  38.794  11.541  -1.447
   69    HG2  LYS   9           HG2      LYS   9  36.672  10.711  -0.594
   70    HG3  LYS   9           HG3      LYS   9  37.461  10.203   0.900
   71    HD2  LYS   9           HD2      LYS   9  38.008  12.485   1.444
   72    HD3  LYS   9           HD3      LYS   9  37.395  13.041  -0.114
   73    HE2  LYS   9           HE2      LYS   9  35.147  12.328   0.499
   74    HE3  LYS   9           HE3      LYS   9  35.748  11.725   2.043
   75    HZ1  LYS   9           HZ1      LYS   9  34.694  13.955   2.151
   76    HZ2  LYS   9           HZ2      LYS   9  35.955  14.558   1.188
   77    HZ3  LYS   9           HZ3      LYS   9  36.291  13.920   2.722
   78    H    CYS  10           H        CYS  10  37.746   7.298  -1.112
   79    HA   CYS  10           HA       CYS  10  36.065   8.008  -3.425
   80    HG   CYS  10           HG       CYS  10  38.491   5.323  -1.583
   81    HB2  CYS  10           HB2      CYS  10  35.869   5.518  -3.779
   82    HB3  CYS  10           HB3      CYS  10  37.475   6.182  -4.061
   83    H    SER  11           H        SER  11  35.328   8.869  -0.938
   84    HA   SER  11           HA       SER  11  33.775   7.053   0.566
   85    HG   SER  11           HG       SER  11  35.318   8.280   1.695
   86    HB2  SER  11           HB2      SER  11  33.579  10.069   0.441
   87    HB3  SER  11           HB3      SER  11  32.916   9.040   1.712
   88    H    THR  12           H        THR  12  32.459   5.948  -0.831
   89    HA   THR  12           HA       THR  12  29.879   7.031  -1.341
   90    HB   THR  12           HB       THR  12  30.265   6.256  -3.913
   91    HG1  THR  12           HG1      THR  12  32.709   6.578  -2.986
   92   HG21  THR  12          HG21      THR  12  30.238   8.622  -4.519
   93   HG22  THR  12          HG22      THR  12  30.693   9.059  -2.872
   94   HG23  THR  12          HG23      THR  12  29.128   8.305  -3.184
   95    H    LYS  13           H        LYS  13  28.815   5.293  -0.580
   96    HA   LYS  13           HA       LYS  13  29.434   2.704  -1.830
   97    HB2  LYS  13           HB2      LYS  13  28.711   3.271   1.040
   98    HB3  LYS  13           HB3      LYS  13  28.533   1.673   0.328
   99    HG2  LYS  13           HG2      LYS  13  30.947   1.708  -0.229
  100    HG3  LYS  13           HG3      LYS  13  31.082   3.248   0.615
  101    HD2  LYS  13           HD2      LYS  13  29.938   0.867   2.017
  102    HD3  LYS  13           HD3      LYS  13  31.684   1.030   1.844
  103    HE2  LYS  13           HE2      LYS  13  31.041   1.930   3.965
  104    HE3  LYS  13           HE3      LYS  13  31.524   3.262   2.920
  105    HZ1  LYS  13           HZ1      LYS  13  28.709   2.453   3.421
  106    HZ2  LYS  13           HZ2      LYS  13  29.236   3.814   2.556
  107    HZ3  LYS  13           HZ3      LYS  13  29.513   3.714   4.223
  108    H    GLY  14           H        GLY  14  27.397   1.173  -1.271
  109    HA2  GLY  14           HA2      GLY  14  25.401   2.316  -2.975
  110    HA3  GLY  14           HA3      GLY  14  25.389   0.699  -2.291
  111    H    CYS  15           H        CYS  15  23.952   3.718  -2.240
  112    HA   CYS  15           HA       CYS  15  22.768   3.368   0.399
  113    HG   CYS  15           HG       CYS  15  21.958   6.595   1.353
  114    HB2  CYS  15           HB2      CYS  15  23.378   5.643  -0.543
  115    HB3  CYS  15           HB3      CYS  15  22.066   5.434  -1.695
  116    H    ALA  16           H        ALA  16  20.291   3.446   0.491
  117    HA   ALA  16           HA       ALA  16  19.112   1.941  -1.730
  118    HB1  ALA  16           HB1      ALA  16  20.054   0.275  -0.214
  119    HB2  ALA  16           HB2      ALA  16  18.292   0.203  -0.225
  120    HB3  ALA  16           HB3      ALA  16  19.135   0.967   1.123
  121    H    ILE  17           H        ILE  17  16.806   1.175  -0.523
  122    HA   ILE  17           HA       ILE  17  14.727   1.716   0.044
  123    HB   ILE  17           HB       ILE  17  14.217   3.083   1.842
  124   HG12  ILE  17          HG12      ILE  17  16.752   4.679   1.380
  125   HG13  ILE  17          HG13      ILE  17  15.121   5.209   0.977
  126   HG21  ILE  17          HG21      ILE  17  15.632   1.269   2.521
  127   HG22  ILE  17          HG22      ILE  17  15.992   2.686   3.508
  128   HG23  ILE  17          HG23      ILE  17  17.078   2.226   2.197
  129   HD11  ILE  17          HD11      ILE  17  15.877   6.229   3.037
  130   HD12  ILE  17          HD12      ILE  17  16.175   4.637   3.736
  131   HD13  ILE  17          HD13      ILE  17  14.528   5.137   3.351
  132    H    ASP  18           H        ASP  18  13.021   2.701  -0.772
  133    HA   ASP  18           HA       ASP  18  13.446   4.972  -2.575
  134    HB2  ASP  18           HB2      ASP  18  12.312   3.094  -3.589
  135    HB3  ASP  18           HB3      ASP  18  11.174   2.997  -2.252
  136    H    ILE  19           H        ILE  19  11.006   3.869  -0.225
  137    HA   ILE  19           HA       ILE  19  10.773   6.627   0.760
  138    HB   ILE  19           HB       ILE  19   9.048   4.228   1.418
  139   HG12  ILE  19          HG12      ILE  19   8.832   4.908  -0.944
  140   HG13  ILE  19          HG13      ILE  19   7.362   5.235  -0.040
  141   HG21  ILE  19          HG21      ILE  19   9.085   5.898   3.193
  142   HG22  ILE  19          HG22      ILE  19   7.514   5.871   2.393
  143   HG23  ILE  19          HG23      ILE  19   8.665   7.158   2.033
  144   HD11  ILE  19          HD11      ILE  19   7.885   7.048  -1.565
  145   HD12  ILE  19          HD12      ILE  19   9.459   7.258  -0.797
  146   HD13  ILE  19          HD13      ILE  19   7.983   7.595   0.109
  147    H    GLY  20           H        GLY  20  11.109   3.276   1.866
  148    HA2  GLY  20           HA2      GLY  20  12.654   2.410   3.348
  149    HA3  GLY  20           HA3      GLY  20  13.267   4.031   3.611
  150    H    THR  21           H        THR  21  11.815   5.461   4.953
  151    HA   THR  21           HA       THR  21  11.469   4.012   7.405
  152    HB   THR  21           HB       THR  21  12.601   6.179   7.414
  153    HG1  THR  21           HG1      THR  21  10.840   7.141   9.016
  154   HG21  THR  21          HG21      THR  21  11.349   7.315   5.652
  155   HG22  THR  21          HG22      THR  21  11.337   8.265   7.139
  156   HG23  THR  21          HG23      THR  21   9.910   7.337   6.673
  157    H    VAL  22           H        VAL  22   9.683   3.314   8.281
  158    HA   VAL  22           HA       VAL  22   7.186   4.612   8.199
  159    HB   VAL  22           HB       VAL  22   7.089   3.748   5.891
  160   HG11  VAL  22          HG11      VAL  22   6.960   1.329   5.473
  161   HG12  VAL  22          HG12      VAL  22   7.368   1.027   7.162
  162   HG13  VAL  22          HG13      VAL  22   8.534   1.815   6.099
  163   HG21  VAL  22          HG21      VAL  22   5.011   3.967   7.116
  164   HG22  VAL  22          HG22      VAL  22   5.210   2.349   7.791
  165   HG23  VAL  22          HG23      VAL  22   4.944   2.556   6.060
  166    H    ILE  23           H        ILE  23   5.966   3.892   9.889
  167    HA   ILE  23           HA       ILE  23   6.638   1.253  11.008
  168    HB   ILE  23           HB       ILE  23   6.082   3.742  12.636
  169   HG12  ILE  23          HG12      ILE  23   8.602   2.099  12.313
  170   HG13  ILE  23          HG13      ILE  23   8.346   3.725  11.692
  171   HG21  ILE  23          HG21      ILE  23   5.143   1.703  13.632
  172   HG22  ILE  23          HG22      ILE  23   6.483   2.346  14.582
  173   HG23  ILE  23          HG23      ILE  23   6.733   0.943  13.543
  174   HD11  ILE  23          HD11      ILE  23   8.436   2.923  14.590
  175   HD12  ILE  23          HD12      ILE  23   8.142   4.555  13.987
  176   HD13  ILE  23          HD13      ILE  23   9.696   3.772  13.695
  177    H    ASP  24           H        ASP  24   4.873   0.262  10.128
  178    HA   ASP  24           HA       ASP  24   2.322   0.905  11.402
  179    HB2  ASP  24           HB2      ASP  24   2.258   2.051   9.207
  180    HB3  ASP  24           HB3      ASP  24   2.599   0.520   8.408
  181    H    ASN  25           H        ASN  25   1.469  -0.915  12.200
  182    HA   ASN  25           HA       ASN  25   1.508  -3.369  10.778
  183    HB2  ASN  25           HB2      ASN  25   2.922  -4.710  12.185
  184    HB3  ASN  25           HB3      ASN  25   3.864  -3.331  11.634
  185   HD21  ASN  25          HD21      ASN  25   2.504  -4.979  14.315
  186   HD22  ASN  25          HD22      ASN  25   3.199  -3.998  15.554
  187    H    ASP  26           H        ASP  26  -0.262  -4.370  11.283
  188    HA   ASP  26           HA       ASP  26  -1.139  -4.669  14.023
  189    HB2  ASP  26           HB2      ASP  26  -2.219  -2.541  13.347
  190    HB3  ASP  26           HB3      ASP  26  -2.944  -3.359  11.968
  191    H    ASN  27           H        ASN  27  -2.269  -4.971  10.678
  192    HA   ASN  27           HA       ASN  27  -2.320  -7.857  10.906
  193    HB2  ASN  27           HB2      ASN  27  -4.653  -8.089  10.225
  194    HB3  ASN  27           HB3      ASN  27  -4.555  -7.191  11.736
  195   HD21  ASN  27          HD21      ASN  27  -5.049  -4.989  11.753
  196   HD22  ASN  27          HD22      ASN  27  -5.916  -4.248  10.444
  197    H    CYS  28           H        CYS  28  -3.243  -8.706   8.626
  198    HA   CYS  28           HA       CYS  28  -1.617  -7.215   6.690
  199    HG   CYS  28           HG       CYS  28  -0.117 -11.036   7.591
  200    HB2  CYS  28           HB2      CYS  28  -2.441 -10.125   6.706
  201    HB3  CYS  28           HB3      CYS  28  -1.401  -9.362   5.507
  202    H    THR  29           H        THR  29  -4.516  -6.770   7.363
  203    HA   THR  29           HA       THR  29  -5.604  -7.158   4.652
  204    HB   THR  29           HB       THR  29  -7.216  -6.717   7.172
  205    HG1  THR  29           HG1      THR  29  -6.110  -9.027   6.074
  206   HG21  THR  29          HG21      THR  29  -9.082  -7.517   5.799
  207   HG22  THR  29          HG22      THR  29  -7.999  -7.700   4.420
  208   HG23  THR  29          HG23      THR  29  -8.333  -6.096   5.073
  209    H    SER  30           H        SER  30  -5.404  -5.304   3.544
  210    HA   SER  30           HA       SER  30  -5.575  -2.760   4.987
  211    HG   SER  30           HG       SER  30  -3.979  -1.024   3.605
  212    HB2  SER  30           HB2      SER  30  -3.610  -3.137   3.523
  213    HB3  SER  30           HB3      SER  30  -4.690  -3.303   2.139
  214    H    LYS  31           H        LYS  31  -7.476  -1.807   5.058
  215    HA   LYS  31           HA       LYS  31  -9.374  -2.164   2.841
  216    HB2  LYS  31           HB2      LYS  31  -9.738  -1.214   5.689
  217    HB3  LYS  31           HB3      LYS  31 -11.005  -1.127   4.474
  218    HG2  LYS  31           HG2      LYS  31  -9.647  -3.693   5.249
  219    HG3  LYS  31           HG3      LYS  31 -11.104  -3.083   6.033
  220    HD2  LYS  31           HD2      LYS  31 -10.830  -3.671   3.089
  221    HD3  LYS  31           HD3      LYS  31 -11.610  -4.725   4.269
  222    HE2  LYS  31           HE2      LYS  31 -13.169  -2.851   4.794
  223    HE3  LYS  31           HE3      LYS  31 -12.456  -1.950   3.458
  224    HZ1  LYS  31           HZ1      LYS  31 -13.880  -4.551   3.260
  225    HZ2  LYS  31           HZ2      LYS  31 -13.145  -3.745   1.964
  226    HZ3  LYS  31           HZ3      LYS  31 -14.464  -3.042   2.753
  227    H    PHE  32           H        PHE  32  -9.275  -0.636   1.373
  228    HA   PHE  32           HA       PHE  32  -8.754   2.131   2.237
  229    HD1  PHE  32           HD1      PHE  32  -6.703   3.747   1.694
  230    HD2  PHE  32           HD2      PHE  32  -8.072   2.257  -2.048
  231    HE1  PHE  32           HE1      PHE  32  -6.319   5.954   0.680
  232    HE2  PHE  32           HE2      PHE  32  -7.693   4.463  -3.070
  233    HZ   PHE  32           HZ       PHE  32  -6.817   6.314  -1.704
  234    HB2  PHE  32           HB2      PHE  32  -6.774   1.253   1.097
  235    HB3  PHE  32           HB3      PHE  32  -7.758   0.785  -0.284
  236    H    SER  33           H        SER  33 -10.434   3.393   1.858
  237    HA   SER  33           HA       SER  33 -12.051   2.862  -0.532
  238    HG   SER  33           HG       SER  33 -13.741   3.697   3.053
  239    HB2  SER  33           HB2      SER  33 -14.006   3.747   0.940
  240    HB3  SER  33           HB3      SER  33 -13.471   2.079   1.145
  241    H    ARG  34           H        ARG  34 -11.757   4.499  -1.878
  242    HA   ARG  34           HA       ARG  34 -11.623   7.218  -0.737
  243    HE   ARG  34           HE       ARG  34  -8.437  10.446  -2.937
  244    HB2  ARG  34           HB2      ARG  34  -9.473   6.426  -1.768
  245    HB3  ARG  34           HB3      ARG  34 -10.314   6.298  -3.308
  246    HG2  ARG  34           HG2      ARG  34 -10.867   8.744  -3.092
  247    HG3  ARG  34           HG3      ARG  34  -9.774   8.787  -1.709
  248    HD2  ARG  34           HD2      ARG  34  -7.955   7.965  -3.177
  249    HD3  ARG  34           HD3      ARG  34  -9.061   8.057  -4.549
  250   HH11  ARG  34          HH11      ARG  34  -8.519   8.802  -6.034
  251   HH12  ARG  34          HH12      ARG  34  -8.107  10.222  -6.942
  252   HH21  ARG  34          HH21      ARG  34  -7.938  12.323  -4.142
  253   HH22  ARG  34          HH22      ARG  34  -7.776  12.210  -5.871
  254    H    PHE  35           H        PHE  35 -12.655   8.877  -1.901
  255    HA   PHE  35           HA       PHE  35 -14.906   8.001  -3.490
  256    HD1  PHE  35           HD1      PHE  35 -17.114   8.667  -2.351
  257    HD2  PHE  35           HD2      PHE  35 -14.051  10.777  -0.292
  258    HE1  PHE  35           HE1      PHE  35 -18.266   8.241  -0.215
  259    HE2  PHE  35           HE2      PHE  35 -15.190  10.358   1.847
  260    HZ   PHE  35           HZ       PHE  35 -17.299   9.088   1.889
  261    HB2  PHE  35           HB2      PHE  35 -14.058  10.761  -2.598
  262    HB3  PHE  35           HB3      PHE  35 -15.547  10.398  -3.462
  263    H    PHE  36           H        PHE  36 -15.165   8.241  -5.611
  264    HA   PHE  36           HA       PHE  36 -13.142   9.753  -7.123
  265    HD1  PHE  36           HD2      PHE  36 -11.048   8.337  -8.760
  266    HD2  PHE  36           HD1      PHE  36 -13.195   5.919  -5.998
  267    HE1  PHE  36           HE2      PHE  36  -8.932   7.364  -7.974
  268    HE2  PHE  36           HE1      PHE  36 -11.081   4.939  -5.205
  269    HZ   PHE  36           HZ       PHE  36  -8.947   5.663  -6.193
  270    HB2  PHE  36           HB2      PHE  36 -14.326   7.051  -7.803
  271    HB3  PHE  36           HB3      PHE  36 -13.438   8.039  -8.959
  272    H    ALA  37           H        ALA  37 -13.938  10.429  -9.276
  273    HA   ALA  37           HA       ALA  37 -16.386  11.773  -9.105
  274    HB1  ALA  37           HB1      ALA  37 -14.588  12.509 -10.575
  275    HB2  ALA  37           HB2      ALA  37 -16.080  12.276 -11.487
  276    HB3  ALA  37           HB3      ALA  37 -14.797  11.069 -11.573
  277    H    THR  38           H        THR  38 -15.556   8.954 -11.131
  278    HA   THR  38           HA       THR  38 -18.402   8.231 -11.069
  279    HB   THR  38           HB       THR  38 -18.100   7.224 -13.324
  280    HG1  THR  38           HG1      THR  38 -16.176   8.120 -14.484
  281   HG21  THR  38          HG21      THR  38 -18.099   9.348 -14.570
  282   HG22  THR  38          HG22      THR  38 -17.502  10.178 -13.133
  283   HG23  THR  38          HG23      THR  38 -19.101   9.433 -13.120
  284    H    ARG  39           H        ARG  39 -18.846   5.928 -11.305
  285    HA   ARG  39           HA       ARG  39 -17.255   4.266  -9.708
  286    HE   ARG  39           HE       ARG  39 -18.775  -0.544 -11.509
  287    HB2  ARG  39           HB2      ARG  39 -19.468   3.575  -9.875
  288    HB3  ARG  39           HB3      ARG  39 -19.517   3.784 -11.614
  289    HG2  ARG  39           HG2      ARG  39 -18.078   1.805 -11.872
  290    HG3  ARG  39           HG3      ARG  39 -18.085   1.595 -10.120
  291    HD2  ARG  39           HD2      ARG  39 -20.519   1.318 -10.178
  292    HD3  ARG  39           HD3      ARG  39 -20.494   1.514 -11.930
  293   HH11  ARG  39          HH11      ARG  39 -22.082   0.104 -10.532
  294   HH12  ARG  39          HH12      ARG  39 -22.546  -1.577 -10.511
  295   HH21  ARG  39          HH21      ARG  39 -19.371  -2.772 -11.442
  296   HH22  ARG  39          HH22      ARG  39 -21.005  -3.197 -11.025
  297    H    GLU  40           H        GLU  40 -17.272   4.893 -13.131
  298    HA   GLU  40           HA       GLU  40 -15.619   2.843 -14.040
  299    HB2  GLU  40           HB2      GLU  40 -15.932   5.697 -14.972
  300    HB3  GLU  40           HB3      GLU  40 -15.027   4.471 -15.851
  301    HG2  GLU  40           HG2      GLU  40 -17.007   3.142 -16.123
  302    HG3  GLU  40           HG3      GLU  40 -17.938   4.255 -15.129
  303    H    GLU  41           H        GLU  41 -14.770   6.120 -12.987
  304    HA   GLU  41           HA       GLU  41 -12.004   5.951 -13.059
  305    HB2  GLU  41           HB2      GLU  41 -13.840   7.425 -11.176
  306    HB3  GLU  41           HB3      GLU  41 -12.094   7.627 -11.145
  307    HG2  GLU  41           HG2      GLU  41 -13.819   8.130 -13.555
  308    HG3  GLU  41           HG3      GLU  41 -13.299   9.375 -12.421
  309    H    ALA  42           H        ALA  42 -14.262   4.700 -10.715
  310    HA   ALA  42           HA       ALA  42 -12.369   4.186  -8.657
  311    HB1  ALA  42           HB1      ALA  42 -14.148   2.894  -7.610
  312    HB2  ALA  42           HB2      ALA  42 -15.085   2.949  -9.103
  313    HB3  ALA  42           HB3      ALA  42 -14.761   4.434  -8.209
  314    H    GLU  43           H        GLU  43 -13.991   2.043 -11.007
  315    HA   GLU  43           HA       GLU  43 -12.547  -0.272 -10.249
  316    HB2  GLU  43           HB2      GLU  43 -14.022   0.368 -12.804
  317    HB3  GLU  43           HB3      GLU  43 -13.403  -1.223 -12.385
  318    HG2  GLU  43           HG2      GLU  43 -14.835  -1.184 -10.359
  319    HG3  GLU  43           HG3      GLU  43 -15.523   0.336 -10.926
  320    H    SER  44           H        SER  44 -11.928   2.283 -12.553
  321    HA   SER  44           HA       SER  44  -9.861   0.976 -13.981
  322    HG   SER  44           HG       SER  44 -12.110   2.927 -14.547
  323    HB2  SER  44           HB2      SER  44 -10.334   3.939 -13.583
  324    HB3  SER  44           HB3      SER  44  -9.292   3.219 -14.811
  325    H    PHE  45           H        PHE  45  -9.956   2.697 -10.954
  326    HA   PHE  45           HA       PHE  45  -7.137   3.120 -10.750
  327    HD1  PHE  45           HD1      PHE  45  -6.301   5.184  -9.282
  328    HD2  PHE  45           HD2      PHE  45  -8.226   2.493  -6.601
  329    HE1  PHE  45           HE1      PHE  45  -4.583   5.650  -7.582
  330    HE2  PHE  45           HE2      PHE  45  -6.512   2.958  -4.900
  331    HZ   PHE  45           HZ       PHE  45  -4.688   4.537  -5.388
  332    HB2  PHE  45           HB2      PHE  45  -8.764   4.477  -9.491
  333    HB3  PHE  45           HB3      PHE  45  -9.268   3.048  -8.599
  334    H    MET  46           H        MET  46  -9.378   0.605  -9.845
  335    HA   MET  46           HA       MET  46  -7.711  -0.870  -8.131
  336    HB2  MET  46           HB2      MET  46 -10.093  -1.240  -8.176
  337    HB3  MET  46           HB3      MET  46 -10.032  -1.719  -9.866
  338    HG2  MET  46           HG2      MET  46 -10.302  -3.617  -8.339
  339    HG3  MET  46           HG3      MET  46  -8.831  -3.725  -9.304
  340    HE1  MET  46           HE1      MET  46  -9.398  -1.371  -6.241
  341    HE2  MET  46           HE2      MET  46  -8.811  -2.352  -4.897
  342    HE3  MET  46           HE3      MET  46 -10.291  -2.805  -5.743
  343    H    THR  47           H        THR  47  -8.123  -0.928 -11.626
  344    HA   THR  47           HA       THR  47  -7.016  -3.378 -12.245
  345    HB   THR  47           HB       THR  47  -6.654  -0.871 -13.891
  346    HG1  THR  47           HG1      THR  47  -8.921  -2.465 -13.331
  347   HG21  THR  47          HG21      THR  47  -5.453  -2.841 -14.722
  348   HG22  THR  47          HG22      THR  47  -6.792  -2.421 -15.791
  349   HG23  THR  47          HG23      THR  47  -6.946  -3.777 -14.673
  350    H    LYS  48           H        LYS  48  -5.255  -0.262 -12.013
  351    HA   LYS  48           HA       LYS  48  -2.754  -1.476 -12.609
  352    HB2  LYS  48           HB2      LYS  48  -1.759   0.677 -11.991
  353    HB3  LYS  48           HB3      LYS  48  -3.089   0.848 -13.127
  354    HG2  LYS  48           HG2      LYS  48  -4.565   1.504 -11.302
  355    HG3  LYS  48           HG3      LYS  48  -3.227   1.334 -10.166
  356    HD2  LYS  48           HD2      LYS  48  -3.331   3.241 -12.498
  357    HD3  LYS  48           HD3      LYS  48  -3.569   3.656 -10.806
  358    HE2  LYS  48           HE2      LYS  48  -1.280   2.902 -10.310
  359    HE3  LYS  48           HE3      LYS  48  -1.047   2.539 -12.021
  360    HZ1  LYS  48           HZ1      LYS  48  -0.110   4.691 -11.442
  361    HZ2  LYS  48           HZ2      LYS  48  -1.617   5.222 -10.877
  362    HZ3  LYS  48           HZ3      LYS  48  -1.402   4.882 -12.525
  363    H    LEU  49           H        LEU  49  -4.528  -0.912  -9.681
  364    HA   LEU  49           HA       LEU  49  -2.339  -1.250  -7.889
  365    HG   LEU  49           HG       LEU  49  -4.883   0.457  -5.873
  366    HB2  LEU  49           HB2      LEU  49  -5.288  -1.109  -7.661
  367    HB3  LEU  49           HB3      LEU  49  -4.441  -1.924  -6.361
  368   HD11  LEU  49          HD11      LEU  49  -2.618   1.029  -5.149
  369   HD12  LEU  49          HD12      LEU  49  -1.969  -0.241  -6.185
  370   HD13  LEU  49          HD13      LEU  49  -3.001  -0.659  -4.818
  371   HD21  LEU  49          HD21      LEU  49  -3.626   2.190  -7.050
  372   HD22  LEU  49          HD22      LEU  49  -4.731   1.348  -8.137
  373   HD23  LEU  49          HD23      LEU  49  -3.006   0.982  -8.174
  374    H    LYS  50           H        LYS  50  -4.712  -3.433  -9.322
  375    HA   LYS  50           HA       LYS  50  -4.176  -5.758  -7.899
  376    HB2  LYS  50           HB2      LYS  50  -4.753  -5.522 -10.860
  377    HB3  LYS  50           HB3      LYS  50  -4.984  -6.958  -9.872
  378    HG2  LYS  50           HG2      LYS  50  -6.766  -5.997  -8.697
  379    HG3  LYS  50           HG3      LYS  50  -6.382  -4.376  -9.277
  380    HD2  LYS  50           HD2      LYS  50  -8.146  -4.907 -10.621
  381    HD3  LYS  50           HD3      LYS  50  -6.803  -5.444 -11.621
  382    HE2  LYS  50           HE2      LYS  50  -7.120  -7.732 -10.840
  383    HE3  LYS  50           HE3      LYS  50  -8.448  -7.206  -9.807
  384    HZ1  LYS  50           HZ1      LYS  50  -8.363  -7.154 -12.773
  385    HZ2  LYS  50           HZ2      LYS  50  -9.599  -6.458 -11.847
  386    HZ3  LYS  50           HZ3      LYS  50  -9.344  -8.133 -11.794
  387    H    GLU  51           H        GLU  51  -2.604  -4.545 -10.831
  388    HA   GLU  51           HA       GLU  51  -0.712  -6.568 -11.177
  389    HB2  GLU  51           HB2      GLU  51  -0.269  -3.637 -11.743
  390    HB3  GLU  51           HB3      GLU  51   0.529  -4.996 -12.519
  391    HG2  GLU  51           HG2      GLU  51  -1.629  -5.670 -13.489
  392    HG3  GLU  51           HG3      GLU  51  -2.376  -4.248 -12.760
  393    H    LEU  52           H        LEU  52  -0.609  -3.642  -9.221
  394    HA   LEU  52           HA       LEU  52   2.107  -3.884  -8.438
  395    HG   LEU  52           HG       LEU  52   0.435  -1.572  -9.455
  396    HB2  LEU  52           HB2      LEU  52  -0.189  -2.379  -7.182
  397    HB3  LEU  52           HB3      LEU  52   1.488  -2.212  -6.698
  398   HD11  LEU  52          HD11      LEU  52   0.733   0.771  -8.811
  399   HD12  LEU  52          HD12      LEU  52   1.142   0.264  -7.170
  400   HD13  LEU  52          HD13      LEU  52  -0.475  -0.035  -7.807
  401   HD21  LEU  52          HD21      LEU  52   2.612  -0.499  -9.751
  402   HD22  LEU  52          HD22      LEU  52   2.775  -2.225  -9.429
  403   HD23  LEU  52          HD23      LEU  52   3.101  -1.055  -8.150
  404    H    ALA  53           H        ALA  53  -0.964  -4.827  -6.931
  405    HA   ALA  53           HA       ALA  53   0.121  -5.742  -4.496
  406    HB1  ALA  53           HB1      ALA  53  -2.255  -5.271  -4.780
  407    HB2  ALA  53           HB2      ALA  53  -2.003  -6.917  -4.198
  408    HB3  ALA  53           HB3      ALA  53  -2.401  -6.632  -5.893
  409    H    ALA  54           H        ALA  54  -0.520  -7.389  -7.559
  410    HA   ALA  54           HA       ALA  54   0.074 -10.001  -6.725
  411    HB1  ALA  54           HB1      ALA  54  -1.065  -9.429  -8.836
  412    HB2  ALA  54           HB2      ALA  54   0.295 -10.528  -9.075
  413    HB3  ALA  54           HB3      ALA  54   0.464  -8.818  -9.471
  414    H    ALA  55           H        ALA  55   2.155  -7.381  -7.818
  415    HA   ALA  55           HA       ALA  55   4.487  -9.093  -7.918
  416    HB1  ALA  55           HB1      ALA  55   4.217  -7.281  -9.534
  417    HB2  ALA  55           HB2      ALA  55   5.684  -7.082  -8.577
  418    HB3  ALA  55           HB3      ALA  55   4.261  -6.104  -8.221
  419    H    ALA  56           H        ALA  56   3.011  -6.824  -5.717
  420    HA   ALA  56           HA       ALA  56   5.286  -6.439  -4.047
  421    HB1  ALA  56           HB1      ALA  56   3.441  -4.846  -4.085
  422    HB2  ALA  56           HB2      ALA  56   3.700  -5.473  -2.456
  423    HB3  ALA  56           HB3      ALA  56   2.356  -6.073  -3.429
  424    H    SER  57           H        SER  57   2.594  -8.705  -4.072
  425    HA   SER  57           HA       SER  57   3.426  -9.903  -1.566
  426    HG   SER  57           HG       SER  57   0.725 -12.220  -2.084
  427    HB2  SER  57           HB2      SER  57   1.026  -9.705  -2.113
  428    HB3  SER  57           HB3      SER  57   1.264 -10.747  -3.514
  429    H    SER  58           H        SER  58   5.076 -11.260  -1.521
  430    HA   SER  58           HA       SER  58   6.017 -12.622  -3.876
  431    HG   SER  58           HG       SER  58   7.105 -10.842  -1.407
  432    HB2  SER  58           HB2      SER  58   6.908 -13.010  -1.017
  433    HB3  SER  58           HB3      SER  58   7.814 -13.370  -2.484
  434    H    ALA  59           H        ALA  59   3.349 -13.283  -2.600
  435    HA   ALA  59           HA       ALA  59   3.658 -16.015  -1.696
  436    HB1  ALA  59           HB1      ALA  59   1.160 -14.396  -2.181
  437    HB2  ALA  59           HB2      ALA  59   2.006 -14.559  -0.642
  438    HB3  ALA  59           HB3      ALA  59   1.240 -15.966  -1.381
  439    H    ASP  60           H        ASP  60   4.022 -14.866  -4.595
  440    HA   ASP  60           HA       ASP  60   4.068 -15.803  -6.661
  441    HB2  ASP  60           HB2      ASP  60   2.727 -18.162  -5.326
  442    HB3  ASP  60           HB3      ASP  60   3.246 -18.139  -7.006
  443    H    GLU  61           H        GLU  61   0.985 -16.531  -5.070
  444    HA   GLU  61           HA       GLU  61  -0.454 -16.092  -7.560
  445    HB2  GLU  61           HB2      GLU  61  -0.853 -17.999  -5.890
  446    HB3  GLU  61           HB3      GLU  61  -1.625 -16.790  -4.875
  447    HG2  GLU  61           HG2      GLU  61  -3.256 -16.344  -6.624
  448    HG3  GLU  61           HG3      GLU  61  -2.468 -17.531  -7.667
  449    H    GLY  62           H        GLY  62   0.845 -13.854  -6.160
  450    HA2  GLY  62           HA2      GLY  62   0.389 -11.639  -5.757
  451    HA3  GLY  62           HA3      GLY  62  -1.222 -11.936  -6.396
  452    H    ALA  63           H        ALA  63  -2.589 -11.089  -4.969
  453    HA   ALA  63           HA       ALA  63  -2.455 -12.061  -2.203
  454    HB1  ALA  63           HB1      ALA  63  -2.869  -9.840  -1.306
  455    HB2  ALA  63           HB2      ALA  63  -2.828  -9.159  -2.933
  456    HB3  ALA  63           HB3      ALA  63  -1.369  -9.859  -2.234
  457    H    SER  64           H        SER  64  -4.541 -11.194  -1.027
  458    HA   SER  64           HA       SER  64  -6.807 -11.933  -2.692
  459    HG   SER  64           HG       SER  64  -5.679 -13.328  -0.951
  460    HB2  SER  64           HB2      SER  64  -6.767 -11.221   0.249
  461    HB3  SER  64           HB3      SER  64  -8.045 -12.067  -0.623
  462    H    VAL  65           H        VAL  65  -8.048 -10.449  -3.656
  463    HA   VAL  65           HA       VAL  65  -8.145  -7.765  -2.488
  464    HB   VAL  65           HB       VAL  65  -6.528  -7.556  -4.243
  465   HG11  VAL  65          HG11      VAL  65  -7.067  -9.546  -5.538
  466   HG12  VAL  65          HG12      VAL  65  -6.996  -8.121  -6.576
  467   HG13  VAL  65          HG13      VAL  65  -8.557  -8.789  -6.101
  468   HG21  VAL  65          HG21      VAL  65  -8.072  -5.697  -4.017
  469   HG22  VAL  65          HG22      VAL  65  -9.189  -6.465  -5.145
  470   HG23  VAL  65          HG23      VAL  65  -7.614  -5.909  -5.708
  471    H    ALA  66           H        ALA  66 -10.149  -7.335  -2.007
  472    HA   ALA  66           HA       ALA  66 -12.263  -8.086  -3.922
  473    HB1  ALA  66           HB1      ALA  66 -12.489  -7.965  -0.910
  474    HB2  ALA  66           HB2      ALA  66 -12.448  -9.435  -1.885
  475    HB3  ALA  66           HB3      ALA  66 -13.805  -8.316  -2.029
  476    H    TYR  67           H        TYR  67 -13.275  -6.357  -4.763
  477    HA   TYR  67           HA       TYR  67 -13.113  -3.852  -3.237
  478    HD1  TYR  67           HD2      TYR  67 -12.301  -5.876  -6.861
  479    HD2  TYR  67           HD1      TYR  67 -14.283  -2.112  -6.868
  480    HE1  TYR  67           HE2      TYR  67 -13.192  -6.351  -9.106
  481    HE2  TYR  67           HE1      TYR  67 -15.175  -2.578  -9.110
  482    HH   TYR  67           HH       TYR  67 -14.688  -3.948 -11.040
  483    HB2  TYR  67           HB2      TYR  67 -12.720  -2.584  -5.185
  484    HB3  TYR  67           HB3      TYR  67 -11.639  -3.964  -5.307
  485    H    LYS  68           H        LYS  68 -14.904  -2.728  -2.939
  486    HA   LYS  68           HA       LYS  68 -17.327  -3.582  -4.378
  487    HB2  LYS  68           HB2      LYS  68 -17.075  -2.308  -1.653
  488    HB3  LYS  68           HB3      LYS  68 -18.597  -2.591  -2.481
  489    HG2  LYS  68           HG2      LYS  68 -18.125  -5.007  -2.453
  490    HG3  LYS  68           HG3      LYS  68 -16.656  -4.669  -1.536
  491    HD2  LYS  68           HD2      LYS  68 -19.495  -4.098  -0.694
  492    HD3  LYS  68           HD3      LYS  68 -18.400  -5.291   0.009
  493    HE2  LYS  68           HE2      LYS  68 -17.047  -3.646   0.980
  494    HE3  LYS  68           HE3      LYS  68 -17.702  -2.375  -0.048
  495    HZ1  LYS  68           HZ1      LYS  68 -18.683  -2.024   2.010
  496    HZ2  LYS  68           HZ2      LYS  68 -18.956  -3.674   2.290
  497    HZ3  LYS  68           HZ3      LYS  68 -19.888  -2.844   1.140
  498    H    ILE  69           H        ILE  69 -18.944  -1.805  -4.560
  499    HA   ILE  69           HA       ILE  69 -17.656   0.783  -5.068
  500    HB   ILE  69           HB       ILE  69 -19.434  -0.573  -7.098
  501   HG12  ILE  69          HG12      ILE  69 -16.460  -0.098  -7.320
  502   HG13  ILE  69          HG13      ILE  69 -17.151  -1.636  -6.813
  503   HG21  ILE  69          HG21      ILE  69 -17.785   1.949  -7.244
  504   HG22  ILE  69          HG22      ILE  69 -19.542   1.869  -7.096
  505   HG23  ILE  69          HG23      ILE  69 -18.751   1.268  -8.553
  506   HD11  ILE  69          HD11      ILE  69 -16.559  -1.660  -9.163
  507   HD12  ILE  69          HD12      ILE  69 -17.618  -0.280  -9.456
  508   HD13  ILE  69          HD13      ILE  69 -18.302  -1.826  -8.949
  509    H    LYS  70           H        LYS  70 -18.803   2.125  -3.800
  510    HA   LYS  70           HA       LYS  70 -21.722   1.802  -3.830
  511    HB2  LYS  70           HB2      LYS  70 -20.541   1.834  -1.618
  512    HB3  LYS  70           HB3      LYS  70 -20.148   3.514  -1.931
  513    HG2  LYS  70           HG2      LYS  70 -22.501   4.080  -2.012
  514    HG3  LYS  70           HG3      LYS  70 -22.934   2.383  -1.793
  515    HD2  LYS  70           HD2      LYS  70 -21.813   2.415   0.409
  516    HD3  LYS  70           HD3      LYS  70 -21.477   4.136   0.190
  517    HE2  LYS  70           HE2      LYS  70 -23.894   4.567   0.031
  518    HE3  LYS  70           HE3      LYS  70 -24.207   2.851   0.290
  519    HZ1  LYS  70           HZ1      LYS  70 -23.171   3.031   2.466
  520    HZ2  LYS  70           HZ2      LYS  70 -24.464   4.109   2.330
  521    HZ3  LYS  70           HZ3      LYS  70 -22.868   4.680   2.216
  522    H    ASP  71           H        ASP  71 -22.354   2.788  -5.522
  523    HA   ASP  71           HA       ASP  71 -21.299   5.267  -6.489
  524    HB2  ASP  71           HB2      ASP  71 -23.237   5.100  -8.094
  525    HB3  ASP  71           HB3      ASP  71 -22.127   3.741  -8.128
  526    H    LEU  72           H        LEU  72 -21.696   7.089  -5.406
  527    HA   LEU  72           HA       LEU  72 -24.146   7.302  -3.814
  528    HG   LEU  72           HG       LEU  72 -21.140   6.784  -2.966
  529    HB2  LEU  72           HB2      LEU  72 -21.686   9.059  -3.794
  530    HB3  LEU  72           HB3      LEU  72 -23.015   9.125  -2.654
  531   HD11  LEU  72          HD11      LEU  72 -19.971   8.733  -2.101
  532   HD12  LEU  72          HD12      LEU  72 -20.189   7.525  -0.837
  533   HD13  LEU  72          HD13      LEU  72 -21.220   8.956  -0.875
  534   HD21  LEU  72          HD21      LEU  72 -23.254   7.397  -0.904
  535   HD22  LEU  72          HD22      LEU  72 -22.148   6.023  -0.872
  536   HD23  LEU  72          HD23      LEU  72 -23.349   6.159  -2.155
  537    H    GLU  73           H        GLU  73 -24.492   9.945  -3.583
  538    HA   GLU  73           HA       GLU  73 -25.559  10.729  -6.123
  539    HB2  GLU  73           HB2      GLU  73 -26.590  11.250  -3.872
  540    HB3  GLU  73           HB3      GLU  73 -25.295  12.415  -3.630
  541    HG2  GLU  73           HG2      GLU  73 -26.038  13.656  -5.591
  542    HG3  GLU  73           HG3      GLU  73 -27.329  12.481  -5.845
  543    H    GLY  74           H        GLY  74 -24.085  11.216  -7.638
  544    HA2  GLY  74           HA2      GLY  74 -22.713  12.827  -8.685
  545    HA3  GLY  74           HA3      GLY  74 -22.285  13.464  -7.103
  546    H    GLN  75           H        GLN  75 -21.186  11.599  -5.711
  547    HA   GLN  75           HA       GLN  75 -18.870  10.781  -7.332
  548    HB2  GLN  75           HB2      GLN  75 -17.625  10.829  -5.187
  549    HB3  GLN  75           HB3      GLN  75 -18.320  12.387  -5.607
  550    HG2  GLN  75           HG2      GLN  75 -20.230  11.845  -4.079
  551    HG3  GLN  75           HG3      GLN  75 -19.321  10.430  -3.554
  552   HE21  GLN  75          HE21      GLN  75 -19.191  11.191  -1.431
  553   HE22  GLN  75          HE22      GLN  75 -18.156  12.503  -0.990
  554    H    VAL  76           H        VAL  76 -17.677   8.848  -6.347
  555    HA   VAL  76           HA       VAL  76 -19.577   6.871  -5.257
  556    HB   VAL  76           HB       VAL  76 -18.576   5.111  -6.614
  557   HG11  VAL  76          HG11      VAL  76 -19.442   5.780  -8.828
  558   HG12  VAL  76          HG12      VAL  76 -19.565   7.444  -8.251
  559   HG13  VAL  76          HG13      VAL  76 -20.545   6.176  -7.510
  560   HG21  VAL  76          HG21      VAL  76 -16.975   7.312  -7.916
  561   HG22  VAL  76          HG22      VAL  76 -17.040   5.630  -8.449
  562   HG23  VAL  76          HG23      VAL  76 -16.343   6.033  -6.879
  563    H    GLU  77           H        GLU  77 -18.625   5.213  -3.966
  564    HA   GLU  77           HA       GLU  77 -15.936   5.907  -2.990
  565    HB2  GLU  77           HB2      GLU  77 -17.710   6.033  -1.281
  566    HB3  GLU  77           HB3      GLU  77 -18.113   4.348  -1.584
  567    HG2  GLU  77           HG2      GLU  77 -15.826   3.719  -0.884
  568    HG3  GLU  77           HG3      GLU  77 -15.523   5.406  -0.479
  569    H    LEU  78           H        LEU  78 -14.396   4.650  -3.761
  570    HA   LEU  78           HA       LEU  78 -14.972   1.896  -4.548
  571    HG   LEU  78           HG       LEU  78 -12.001   1.944  -6.777
  572    HB2  LEU  78           HB2      LEU  78 -13.608   3.452  -5.990
  573    HB3  LEU  78           HB3      LEU  78 -12.378   3.440  -4.746
  574   HD11  LEU  78          HD11      LEU  78 -11.024   0.131  -5.452
  575   HD12  LEU  78          HD12      LEU  78 -11.916   0.692  -4.037
  576   HD13  LEU  78          HD13      LEU  78 -10.671   1.714  -4.759
  577   HD21  LEU  78          HD21      LEU  78 -14.078   0.267  -5.375
  578   HD22  LEU  78          HD22      LEU  78 -13.072  -0.255  -6.726
  579   HD23  LEU  78          HD23      LEU  78 -14.252   1.035  -6.954
  580    H    ASP  79           H        ASP  79 -14.820   0.378  -3.067
  581    HA   ASP  79           HA       ASP  79 -13.062   0.835  -0.745
  582    HB2  ASP  79           HB2      ASP  79 -15.358   0.686  -0.043
  583    HB3  ASP  79           HB3      ASP  79 -15.613  -0.769  -1.002
  584    H    ALA  80           H        ALA  80 -11.262  -0.304  -0.785
  585    HA   ALA  80           HA       ALA  80 -11.273  -2.900  -2.178
  586    HB1  ALA  80           HB1      ALA  80  -8.984  -0.966  -1.869
  587    HB2  ALA  80           HB2      ALA  80  -9.954  -1.181  -3.325
  588    HB3  ALA  80           HB3      ALA  80  -8.941  -2.501  -2.737
  589    H    ALA  81           H        ALA  81 -10.682  -4.631  -1.075
  590    HA   ALA  81           HA       ALA  81  -9.286  -4.299   1.490
  591    HB1  ALA  81           HB1      ALA  81 -11.542  -5.245   1.716
  592    HB2  ALA  81           HB2      ALA  81 -10.298  -6.399   2.194
  593    HB3  ALA  81           HB3      ALA  81 -11.094  -6.559   0.629
  594    H    PHE  82           H        PHE  82  -7.200  -4.640   1.129
  595    HA   PHE  82           HA       PHE  82  -6.375  -6.811  -0.669
  596    HD1  PHE  82           HD2      PHE  82  -4.451  -6.055  -2.800
  597    HD2  PHE  82           HD1      PHE  82  -6.205  -2.800  -0.696
  598    HE1  PHE  82           HE2      PHE  82  -4.897  -4.918  -4.936
  599    HE2  PHE  82           HE1      PHE  82  -6.651  -1.658  -2.828
  600    HZ   PHE  82           HZ       PHE  82  -5.995  -2.714  -4.951
  601    HB2  PHE  82           HB2      PHE  82  -4.872  -4.442   0.453
  602    HB3  PHE  82           HB3      PHE  82  -4.085  -5.750  -0.419
  603    H    THR  83           H        THR  83  -6.061  -8.690   0.309
  604    HA   THR  83           HA       THR  83  -4.928  -8.683   3.023
  605    HB   THR  83           HB       THR  83  -6.351 -10.959   1.629
  606    HG1  THR  83           HG1      THR  83  -7.820 -10.150   3.610
  607   HG21  THR  83          HG21      THR  83  -4.791 -11.675   3.375
  608   HG22  THR  83          HG22      THR  83  -6.461 -11.929   3.879
  609   HG23  THR  83          HG23      THR  83  -5.548 -10.562   4.515
  610    H    PHE  84           H        PHE  84  -2.798  -8.809   2.892
  611    HA   PHE  84           HA       PHE  84  -1.541 -10.424   0.814
  612    HD1  PHE  84           HD1      PHE  84  -2.098  -6.928   1.514
  613    HD2  PHE  84           HD2      PHE  84   1.228  -8.871  -0.288
  614    HE1  PHE  84           HE1      PHE  84  -2.189  -5.338  -0.356
  615    HE2  PHE  84           HE2      PHE  84   1.145  -7.283  -2.163
  616    HZ   PHE  84           HZ       PHE  84  -0.568  -5.512  -2.200
  617    HB2  PHE  84           HB2      PHE  84  -0.469  -8.424   2.801
  618    HB3  PHE  84           HB3      PHE  84   0.597  -9.462   1.860
  619    H    SER  85           H        SER  85   0.079 -12.004   1.342
  620    HA   SER  85           HA       SER  85  -0.827 -13.717   3.442
  621    HG   SER  85           HG       SER  85  -0.996 -13.960   1.023
  622    HB2  SER  85           HB2      SER  85   1.602 -14.033   1.670
  623    HB3  SER  85           HB3      SER  85   0.752 -15.307   2.551
  624    H    CYS  86           H        CYS  86   1.868 -11.546   2.973
  625    HA   CYS  86           HA       CYS  86   2.756 -12.134   5.714
  626    HG   CYS  86           HG       CYS  86   3.671 -14.356   4.303
  627    HB2  CYS  86           HB2      CYS  86   4.541 -11.218   3.450
  628    HB3  CYS  86           HB3      CYS  86   5.038 -11.707   5.067
  629    H    GLN  87           H        GLN  87   3.283 -10.373   6.993
  630    HA   GLN  87           HA       GLN  87   1.930  -7.960   6.419
  631    HB2  GLN  87           HB2      GLN  87   2.163  -8.675   8.690
  632    HB3  GLN  87           HB3      GLN  87   3.916  -8.693   8.567
  633    HG2  GLN  87           HG2      GLN  87   4.069  -6.380   8.626
  634    HG3  GLN  87           HG3      GLN  87   2.383  -6.153   8.164
  635   HE21  GLN  87          HE21      GLN  87   0.774  -6.418   9.728
  636   HE22  GLN  87          HE22      GLN  87   1.130  -6.415  11.426
  637    H    ALA  88           H        ALA  88   5.264  -8.959   6.076
  638    HA   ALA  88           HA       ALA  88   6.469  -6.467   5.685
  639    HB1  ALA  88           HB1      ALA  88   7.181  -9.046   4.295
  640    HB2  ALA  88           HB2      ALA  88   7.698  -8.600   5.921
  641    HB3  ALA  88           HB3      ALA  88   8.232  -7.651   4.533
  642    H    GLU  89           H        GLU  89   4.658  -8.526   3.500
  643    HA   GLU  89           HA       GLU  89   5.255  -7.144   1.109
  644    HB2  GLU  89           HB2      GLU  89   2.704  -8.669   1.606
  645    HB3  GLU  89           HB3      GLU  89   3.584  -8.476   0.097
  646    HG2  GLU  89           HG2      GLU  89   4.452 -10.100   2.477
  647    HG3  GLU  89           HG3      GLU  89   3.836 -10.723   0.949
  648    H    MET  90           H        MET  90   2.890  -6.685   3.632
  649    HA   MET  90           HA       MET  90   1.095  -5.009   2.234
  650    HB2  MET  90           HB2      MET  90   0.442  -6.067   4.316
  651    HB3  MET  90           HB3      MET  90   1.709  -5.215   5.187
  652    HG2  MET  90           HG2      MET  90  -0.422  -4.196   5.629
  653    HG3  MET  90           HG3      MET  90   0.590  -3.086   4.709
  654    HE1  MET  90           HE1      MET  90  -1.417  -6.232   3.425
  655    HE2  MET  90           HE2      MET  90  -2.941  -5.478   2.953
  656    HE3  MET  90           HE3      MET  90  -2.461  -5.514   4.651
  657    H    ILE  91           H        ILE  91   3.742  -4.221   4.486
  658    HA   ILE  91           HA       ILE  91   3.401  -1.431   4.223
  659    HB   ILE  91           HB       ILE  91   5.855  -1.459   5.171
  660   HG12  ILE  91          HG12      ILE  91   4.901  -4.238   5.882
  661   HG13  ILE  91          HG13      ILE  91   6.131  -3.908   4.675
  662   HG21  ILE  91          HG21      ILE  91   3.431  -2.379   6.710
  663   HG22  ILE  91          HG22      ILE  91   3.897  -0.709   6.381
  664   HG23  ILE  91          HG23      ILE  91   4.901  -1.716   7.424
  665   HD11  ILE  91          HD11      ILE  91   7.544  -2.902   6.391
  666   HD12  ILE  91          HD12      ILE  91   7.122  -4.567   6.787
  667   HD13  ILE  91          HD13      ILE  91   6.305  -3.231   7.599
  668    H    ILE  92           H        ILE  92   5.574  -3.718   2.564
  669    HA   ILE  92           HA       ILE  92   7.019  -1.657   1.242
  670    HB   ILE  92           HB       ILE  92   7.890  -3.396  -0.240
  671   HG12  ILE  92          HG12      ILE  92   7.196  -5.828   0.629
  672   HG13  ILE  92          HG13      ILE  92   5.674  -4.998   0.927
  673   HG21  ILE  92          HG21      ILE  92   9.009  -4.742   1.488
  674   HG22  ILE  92          HG22      ILE  92   7.844  -4.154   2.674
  675   HG23  ILE  92          HG23      ILE  92   8.953  -3.027   1.895
  676   HD11  ILE  92          HD11      ILE  92   7.102  -5.161  -1.718
  677   HD12  ILE  92          HD12      ILE  92   5.569  -4.344  -1.416
  678   HD13  ILE  92          HD13      ILE  92   5.683  -6.095  -1.240
  679    H    PHE  93           H        PHE  93   4.060  -3.352   0.577
  680    HA   PHE  93           HA       PHE  93   3.699  -2.609  -2.105
  681    HD1  PHE  93           HD2      PHE  93   1.907  -3.421  -3.626
  682    HD2  PHE  93           HD1      PHE  93  -0.411  -2.398  -0.205
  683    HE1  PHE  93           HE2      PHE  93  -0.001  -2.887  -5.081
  684    HE2  PHE  93           HE1      PHE  93  -2.325  -1.865  -1.657
  685    HZ   PHE  93           HZ       PHE  93  -2.120  -2.112  -4.097
  686    HB2  PHE  93           HB2      PHE  93   2.308  -4.307  -1.109
  687    HB3  PHE  93           HB3      PHE  93   1.709  -3.179   0.099
  688    H    GLU  94           H        GLU  94   2.554  -1.044   0.900
  689    HA   GLU  94           HA       GLU  94   1.366   1.127  -0.494
  690    HB2  GLU  94           HB2      GLU  94   1.186   2.208   1.731
  691    HB3  GLU  94           HB3      GLU  94   0.522   0.583   1.679
  692    HG2  GLU  94           HG2      GLU  94   2.165  -0.280   3.020
  693    HG3  GLU  94           HG3      GLU  94   3.327   0.973   2.589
  694    H    LEU  95           H        LEU  95   4.564   0.601   0.871
  695    HA   LEU  95           HA       LEU  95   5.493   3.249   0.733
  696    HG   LEU  95           HG       LEU  95   6.139   0.941   2.662
  697    HB2  LEU  95           HB2      LEU  95   6.967   0.642   0.387
  698    HB3  LEU  95           HB3      LEU  95   7.767   2.200   0.456
  699   HD11  LEU  95          HD11      LEU  95   8.280   0.803   3.831
  700   HD12  LEU  95          HD12      LEU  95   9.101   1.439   2.405
  701   HD13  LEU  95          HD13      LEU  95   8.298  -0.129   2.334
  702   HD21  LEU  95          HD21      LEU  95   6.895   2.828   4.020
  703   HD22  LEU  95          HD22      LEU  95   5.898   3.361   2.666
  704   HD23  LEU  95          HD23      LEU  95   7.651   3.548   2.600
  705    H    SER  96           H        SER  96   5.487   0.659  -1.677
  706    HA   SER  96           HA       SER  96   6.781   2.127  -3.710
  707    HG   SER  96           HG       SER  96   6.398  -0.966  -2.722
  708    HB2  SER  96           HB2      SER  96   4.837  -0.173  -4.019
  709    HB3  SER  96           HB3      SER  96   6.048   0.348  -5.193
  710    H    LEU  97           H        LEU  97   3.539   2.107  -2.527
  711    HA   LEU  97           HA       LEU  97   2.357   3.332  -4.838
  712    HG   LEU  97           HG       LEU  97   1.533   0.929  -2.855
  713    HB2  LEU  97           HB2      LEU  97   1.341   3.198  -1.999
  714    HB3  LEU  97           HB3      LEU  97   0.402   3.676  -3.401
  715   HD11  LEU  97          HD11      LEU  97  -0.816   0.276  -2.689
  716   HD12  LEU  97          HD12      LEU  97  -1.300   1.959  -2.907
  717   HD13  LEU  97          HD13      LEU  97  -0.389   1.480  -1.474
  718   HD21  LEU  97          HD21      LEU  97  -0.117   1.924  -5.176
  719   HD22  LEU  97          HD22      LEU  97   0.324   0.245  -4.870
  720   HD23  LEU  97          HD23      LEU  97   1.575   1.432  -5.238
  721    H    ARG  98           H        ARG  98   3.958   4.415  -1.946
  722    HA   ARG  98           HA       ARG  98   2.854   6.994  -1.762
  723    HE   ARG  98           HE       ARG  98   3.722   4.302   2.669
  724    HB2  ARG  98           HB2      ARG  98   5.539   5.985  -0.833
  725    HB3  ARG  98           HB3      ARG  98   4.843   7.536  -0.385
  726    HG2  ARG  98           HG2      ARG  98   2.945   6.358   0.647
  727    HG3  ARG  98           HG3      ARG  98   3.713   4.820   0.253
  728    HD2  ARG  98           HD2      ARG  98   5.675   5.515   1.591
  729    HD3  ARG  98           HD3      ARG  98   4.801   6.970   2.063
  730   HH11  ARG  98          HH11      ARG  98   4.832   7.459   3.725
  731   HH12  ARG  98          HH12      ARG  98   4.291   7.219   5.362
  732   HH21  ARG  98          HH21      ARG  98   3.013   4.007   4.814
  733   HH22  ARG  98          HH22      ARG  98   3.265   5.290   5.970
  734    H    SER  99           H        SER  99   5.907   5.910  -3.254
  735    HA   SER  99           HA       SER  99   6.600   8.504  -4.185
  736    HG   SER  99           HG       SER  99   8.264   4.997  -4.120
  737    HB2  SER  99           HB2      SER  99   8.179   7.081  -5.692
  738    HB3  SER  99           HB3      SER  99   8.431   7.081  -3.946
  739    H    LEU 100           H        LEU 100   4.722   5.885  -5.466
  740    HA   LEU 100           HA       LEU 100   4.546   6.790  -8.142
  741    HG   LEU 100           HG       LEU 100   2.562   5.737  -9.376
  742    HB2  LEU 100           HB2      LEU 100   4.006   4.512  -7.502
  743    HB3  LEU 100           HB3      LEU 100   2.705   5.074  -6.476
  744   HD11  LEU 100          HD11      LEU 100   3.235   3.389  -9.383
  745   HD12  LEU 100          HD12      LEU 100   1.547   3.562  -9.865
  746   HD13  LEU 100          HD13      LEU 100   1.948   3.011  -8.238
  747   HD21  LEU 100          HD21      LEU 100   0.170   5.364  -8.979
  748   HD22  LEU 100          HD22      LEU 100   0.838   6.543  -7.851
  749   HD23  LEU 100          HD23      LEU 100   0.522   4.894  -7.315
  750    H    ALA 101           H        ALA 101   2.549   7.265  -5.274
  751    HA   ALA 101           HA       ALA 101   0.661   8.943  -6.658
  752    HB1  ALA 101           HB1      ALA 101   0.934   8.368  -3.708
  753    HB2  ALA 101           HB2      ALA 101  -0.050   7.451  -4.850
  754    HB3  ALA 101           HB3      ALA 101  -0.444   9.134  -4.501
  755    H    LEU 102           H        LEU 102   3.678   9.658  -6.042
  756    HA   LEU 102           HA       LEU 102   3.318  12.203  -4.705
  757    HG   LEU 102           HG       LEU 102   5.269  10.008  -3.852
  758    HB2  LEU 102           HB2      LEU 102   5.692  10.940  -6.061
  759    HB3  LEU 102           HB3      LEU 102   5.731  12.558  -5.393
  760   HD11  LEU 102          HD11      LEU 102   7.593  11.930  -3.868
  761   HD12  LEU 102          HD12      LEU 102   7.579  10.318  -4.585
  762   HD13  LEU 102          HD13      LEU 102   7.429  10.509  -2.837
  763   HD21  LEU 102          HD21      LEU 102   3.984  11.870  -2.916
  764   HD22  LEU 102          HD22      LEU 102   5.448  12.852  -2.861
  765   HD23  LEU 102          HD23      LEU 102   5.318  11.407  -1.859
  766    H    GLU 103           H        GLU 103   2.995  11.018  -7.861
  767    HA   GLU 103           HA       GLU 103   3.814  13.458  -9.184
  768    HB2  GLU 103           HB2      GLU 103   2.508  10.992 -10.337
  769    HB3  GLU 103           HB3      GLU 103   3.238  12.304 -11.254
  770    HG2  GLU 103           HG2      GLU 103   5.406  11.771 -10.142
  771    HG3  GLU 103           HG3      GLU 103   4.627  10.358  -9.432
  772    H    HIS 104           H        HIS 104   2.086  14.541  -7.733
  773    HA   HIS 104           HA       HIS 104   0.323  15.783  -9.458
  774    HD1  HIS 104           HD1      HIS 104  -3.115  14.674  -6.680
  775    HD2  HIS 104           HD2      HIS 104   0.110  12.081  -7.111
  776    HE1  HIS 104           HE1      HIS 104  -3.219  13.125  -4.701
  777    HE2  HIS 104           HE2      HIS 104  -1.155  11.688  -4.895
  778    HB2  HIS 104           HB2      HIS 104  -1.889  15.058  -8.786
  779    HB3  HIS 104           HB3      HIS 104  -0.999  13.669  -9.394
  780    H    HIS 105           H        HIS 105  -0.215  17.704  -8.587
  781    HA   HIS 105           HA       HIS 105   0.750  18.374  -6.003
  782    HD1  HIS 105           HD1      HIS 105  -2.624  21.133  -6.456
  783    HD2  HIS 105           HD2      HIS 105  -1.214  19.431  -9.982
  784    HE1  HIS 105           HE1      HIS 105  -4.489  21.387  -8.126
  785    HE2  HIS 105           HE2      HIS 105  -3.680  20.193 -10.193
  786    HB2  HIS 105           HB2      HIS 105  -0.140  20.594  -6.396
  787    HB3  HIS 105           HB3      HIS 105   0.611  20.006  -7.872
  788    H    HIS 106           H        HIS 106  -0.364  18.925  -4.112
  789    HA   HIS 106           HA       HIS 106  -3.204  18.275  -3.978
  790    HD1  HIS 106           HD1      HIS 106  -1.221  17.402  -0.165
  791    HD2  HIS 106           HD2      HIS 106   0.594  15.814  -3.558
  792    HE1  HIS 106           HE1      HIS 106   1.138  16.858   0.514
  793    HE2  HIS 106           HE2      HIS 106   2.144  15.709  -1.486
  794    HB2  HIS 106           HB2      HIS 106  -2.873  16.735  -2.058
  795    HB3  HIS 106           HB3      HIS 106  -2.188  16.110  -3.553
  796    H    HIS 107           H        HIS 107  -4.280  19.366  -2.433
  797    HA   HIS 107           HA       HIS 107  -3.230  20.370  -0.035
  798    HD1  HIS 107           HD1      HIS 107  -4.432  24.512  -1.182
  799    HD2  HIS 107           HD2      HIS 107  -1.865  22.485   1.389
  800    HE1  HIS 107           HE1      HIS 107  -4.228  25.966   0.861
  801    HE2  HIS 107           HE2      HIS 107  -2.511  24.821   2.303
  802    HB2  HIS 107           HB2      HIS 107  -2.001  21.909  -1.546
  803    HB3  HIS 107           HB3      HIS 107  -3.535  22.457  -2.213
  804    H    HIS 108           H        HIS 108  -4.972  20.341   1.208
  805    HA   HIS 108           HA       HIS 108  -7.440  21.610   0.462
  806    HD1  HIS 108           HD1      HIS 108  -9.562  18.337   2.161
  807    HD2  HIS 108           HD2      HIS 108 -10.059  20.832  -1.136
  808    HE1  HIS 108           HE1      HIS 108 -12.037  18.751   1.986
  809    HE2  HIS 108           HE2      HIS 108 -12.321  20.037  -0.165
  810    HB2  HIS 108           HB2      HIS 108  -7.591  19.419  -0.758
  811    HB3  HIS 108           HB3      HIS 108  -7.459  18.594   0.789
  812    H    HIS 109           H        HIS 109  -7.986  22.565   2.315
  813    HA   HIS 109           HA       HIS 109  -7.934  21.059   4.805
  814    HD1  HIS 109           HD1      HIS 109  -6.770  24.858   6.639
  815    HD2  HIS 109           HD2      HIS 109  -6.129  20.784   7.193
  816    HE1  HIS 109           HE1      HIS 109  -6.598  24.530   9.126
  817    HE2  HIS 109           HE2      HIS 109  -5.994  22.100   9.419
  818    HB2  HIS 109           HB2      HIS 109  -5.666  22.064   4.598
  819    HB3  HIS 109           HB3      HIS 109  -6.406  23.655   4.492
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1  25.016   1.225  33.271
    2    H1   MET   1           H1       MET   1  24.424   4.119  33.368
    3    H2   MET   1           H2       MET   1  25.947   3.456  33.026
    4    H3   MET   1           H3       MET   1  25.236   3.200  34.544
    5    HB2  MET   1           HB2      MET   1  23.124   1.775  34.700
    6    HB3  MET   1           HB3      MET   1  22.427   2.784  33.442
    7    HG2  MET   1           HG2      MET   1  21.274   0.659  33.592
    8    HG3  MET   1           HG3      MET   1  22.092   0.820  32.039
    9    HE1  MET   1           HE1      MET   1  22.229  -0.803  35.610
   10    HE2  MET   1           HE2      MET   1  23.814  -0.036  35.497
   11    HE3  MET   1           HE3      MET   1  23.687  -1.792  35.502
   12    H    ALA   2           H        ALA   2  25.737   0.773  31.307
   13    HA   ALA   2           HA       ALA   2  24.274   1.918  29.016
   14    HB1  ALA   2           HB1      ALA   2  26.321   2.003  27.728
   15    HB2  ALA   2           HB2      ALA   2  27.236   1.350  29.087
   16    HB3  ALA   2           HB3      ALA   2  26.506   2.951  29.204
   17    H    MET   3           H        MET   3  23.051   0.266  28.408
   18    HA   MET   3           HA       MET   3  24.426  -2.277  27.855
   19    HB2  MET   3           HB2      MET   3  22.461  -3.522  28.488
   20    HB3  MET   3           HB3      MET   3  22.927  -2.477  29.820
   21    HG2  MET   3           HG2      MET   3  20.741  -1.843  27.853
   22    HG3  MET   3           HG3      MET   3  20.482  -2.612  29.417
   23    HE1  MET   3           HE1      MET   3  18.955   0.017  28.515
   24    HE2  MET   3           HE2      MET   3  19.048   0.978  29.992
   25    HE3  MET   3           HE3      MET   3  18.730  -0.755  30.085
   26    H    LYS   4           H        LYS   4  22.585   0.299  26.649
   27    HA   LYS   4           HA       LYS   4  21.944  -1.289  24.256
   28    HB2  LYS   4           HB2      LYS   4  20.115   0.428  23.839
   29    HB3  LYS   4           HB3      LYS   4  19.845  -0.726  25.135
   30    HG2  LYS   4           HG2      LYS   4  20.186   0.876  26.795
   31    HG3  LYS   4           HG3      LYS   4  20.977   1.993  25.681
   32    HD2  LYS   4           HD2      LYS   4  18.673   2.682  26.281
   33    HD3  LYS   4           HD3      LYS   4  18.891   2.416  24.552
   34    HE2  LYS   4           HE2      LYS   4  17.843   0.231  24.733
   35    HE3  LYS   4           HE3      LYS   4  17.684   0.437  26.479
   36    HZ1  LYS   4           HZ1      LYS   4  16.443   2.265  24.498
   37    HZ2  LYS   4           HZ2      LYS   4  16.157   2.207  26.168
   38    HZ3  LYS   4           HZ3      LYS   4  15.636   0.934  25.173
   39    H    ASP   5           H        ASP   5  23.837  -0.832  23.181
   40    HA   ASP   5           HA       ASP   5  23.733   1.823  21.917
   41    HB2  ASP   5           HB2      ASP   5  25.776   1.721  23.288
   42    HB3  ASP   5           HB3      ASP   5  26.244   0.222  22.489
   43    H    VAL   6           H        VAL   6  22.493   1.098  20.239
   44    HA   VAL   6           HA       VAL   6  23.655  -1.060  18.607
   45    HB   VAL   6           HB       VAL   6  21.502  -1.722  19.545
   46   HG11  VAL   6          HG11      VAL   6  20.496   0.466  19.857
   47   HG12  VAL   6          HG12      VAL   6  19.431  -0.577  18.918
   48   HG13  VAL   6          HG13      VAL   6  20.372   0.676  18.112
   49   HG21  VAL   6          HG21      VAL   6  22.084  -2.582  17.358
   50   HG22  VAL   6          HG22      VAL   6  21.369  -1.169  16.585
   51   HG23  VAL   6          HG23      VAL   6  20.343  -2.307  17.459
   52    H    VAL   7           H        VAL   7  24.265  -0.580  16.620
   53    HA   VAL   7           HA       VAL   7  22.968   1.584  15.180
   54    HB   VAL   7           HB       VAL   7  24.904   2.648  16.241
   55   HG11  VAL   7          HG11      VAL   7  26.549   0.594  14.775
   56   HG12  VAL   7          HG12      VAL   7  26.383   0.768  16.523
   57   HG13  VAL   7          HG13      VAL   7  27.196   2.021  15.585
   58   HG21  VAL   7          HG21      VAL   7  24.190   3.470  14.076
   59   HG22  VAL   7          HG22      VAL   7  25.213   2.286  13.263
   60   HG23  VAL   7          HG23      VAL   7  25.945   3.580  14.214
   61    H    ASP   8           H        ASP   8  22.495   0.960  13.203
   62    HA   ASP   8           HA       ASP   8  24.255  -0.941  11.830
   63    HB2  ASP   8           HB2      ASP   8  22.373  -2.220  10.974
   64    HB3  ASP   8           HB3      ASP   8  22.335  -2.229  12.732
   65    H    LYS   9           H        LYS   9  24.546  -0.523   9.694
   66    HA   LYS   9           HA       LYS   9  23.404   2.015   8.788
   67    HB2  LYS   9           HB2      LYS   9  25.855   1.830   8.778
   68    HB3  LYS   9           HB3      LYS   9  25.745   0.458   7.683
   69    HG2  LYS   9           HG2      LYS   9  24.834   1.836   5.945
   70    HG3  LYS   9           HG3      LYS   9  24.726   3.213   7.041
   71    HD2  LYS   9           HD2      LYS   9  27.284   1.854   6.199
   72    HD3  LYS   9           HD3      LYS   9  26.661   3.362   5.526
   73    HE2  LYS   9           HE2      LYS   9  26.722   4.314   7.840
   74    HE3  LYS   9           HE3      LYS   9  27.549   2.846   8.359
   75    HZ1  LYS   9           HZ1      LYS   9  29.294   3.350   6.707
   76    HZ2  LYS   9           HZ2      LYS   9  29.160   4.535   7.912
   77    HZ3  LYS   9           HZ3      LYS   9  28.518   4.822   6.369
   78    H    CYS  10           H        CYS  10  21.414   1.293   8.177
   79    HA   CYS  10           HA       CYS  10  21.422  -0.086   5.580
   80    HG   CYS  10           HG       CYS  10  18.287  -2.521   6.088
   81    HB2  CYS  10           HB2      CYS  10  20.364  -1.488   7.351
   82    HB3  CYS  10           HB3      CYS  10  19.213  -0.192   7.655
   83    H    SER  11           H        SER  11  21.692   1.984   4.650
   84    HA   SER  11           HA       SER  11  19.331   3.728   4.860
   85    HG   SER  11           HG       SER  11  20.304   4.602   6.819
   86    HB2  SER  11           HB2      SER  11  22.226   4.613   4.730
   87    HB3  SER  11           HB3      SER  11  20.823   5.681   4.765
   88    H    THR  12           H        THR  12  19.031   5.159   3.052
   89    HA   THR  12           HA       THR  12  18.848   5.686   0.866
   90    HB   THR  12           HB       THR  12  21.569   4.434   0.499
   91    HG1  THR  12           HG1      THR  12  22.191   5.951   1.837
   92   HG21  THR  12          HG21      THR  12  21.781   6.043  -1.329
   93   HG22  THR  12          HG22      THR  12  20.159   6.651  -0.998
   94   HG23  THR  12          HG23      THR  12  20.381   5.000  -1.575
   95    H    LYS  13           H        LYS  13  17.157   4.012   0.827
   96    HA   LYS  13           HA       LYS  13  17.886   1.844  -1.016
   97    HB2  LYS  13           HB2      LYS  13  16.642   1.100   0.965
   98    HB3  LYS  13           HB3      LYS  13  15.347   2.230   0.593
   99    HG2  LYS  13           HG2      LYS  13  14.821   1.026  -1.433
  100    HG3  LYS  13           HG3      LYS  13  16.191  -0.054  -1.181
  101    HD2  LYS  13           HD2      LYS  13  13.835   0.203   0.689
  102    HD3  LYS  13           HD3      LYS  13  14.017  -1.054  -0.533
  103    HE2  LYS  13           HE2      LYS  13  16.164  -1.700   0.577
  104    HE3  LYS  13           HE3      LYS  13  15.767  -0.570   1.867
  105    HZ1  LYS  13           HZ1      LYS  13  15.132  -2.867   2.384
  106    HZ2  LYS  13           HZ2      LYS  13  14.081  -2.874   1.054
  107    HZ3  LYS  13           HZ3      LYS  13  13.789  -1.833   2.362
  108    H    GLY  14           H        GLY  14  18.038   2.963  -2.904
  109    HA2  GLY  14           HA2      GLY  14  17.388   4.191  -4.730
  110    HA3  GLY  14           HA3      GLY  14  15.726   3.843  -4.265
  111    H    CYS  15           H        CYS  15  14.541   5.541  -3.803
  112    HA   CYS  15           HA       CYS  15  15.669   7.701  -2.202
  113    HG   CYS  15           HG       CYS  15  17.396   7.901  -4.253
  114    HB2  CYS  15           HB2      CYS  15  14.190   8.175  -4.804
  115    HB3  CYS  15           HB3      CYS  15  14.646   9.428  -3.652
  116    H    ALA  16           H        ALA  16  12.892   6.060  -3.589
  117    HA   ALA  16           HA       ALA  16  11.070   7.373  -1.738
  118    HB1  ALA  16           HB1      ALA  16  10.530   5.248  -3.810
  119    HB2  ALA  16           HB2      ALA  16  10.332   6.986  -4.037
  120    HB3  ALA  16           HB3      ALA  16   9.314   6.126  -2.881
  121    H    ILE  17           H        ILE  17  11.917   6.590   0.222
  122    HA   ILE  17           HA       ILE  17  11.022   3.855   0.813
  123    HB   ILE  17           HB       ILE  17  13.424   3.746   0.824
  124   HG12  ILE  17          HG12      ILE  17  12.381   3.928   3.660
  125   HG13  ILE  17          HG13      ILE  17  12.260   2.524   2.605
  126   HG21  ILE  17          HG21      ILE  17  14.810   5.177   2.257
  127   HG22  ILE  17          HG22      ILE  17  13.378   6.113   2.690
  128   HG23  ILE  17          HG23      ILE  17  13.953   6.100   1.022
  129   HD11  ILE  17          HD11      ILE  17  14.042   2.231   4.201
  130   HD12  ILE  17          HD12      ILE  17  14.795   3.738   3.677
  131   HD13  ILE  17          HD13      ILE  17  14.710   2.364   2.573
  132    H    ASP  18           H        ASP  18   9.573   3.762   2.353
  133    HA   ASP  18           HA       ASP  18   8.192   4.266   4.065
  134    HB2  ASP  18           HB2      ASP  18  10.033   4.639   5.537
  135    HB3  ASP  18           HB3      ASP  18  10.377   6.210   4.814
  136    H    ILE  19           H        ILE  19   6.351   5.364   4.137
  137    HA   ILE  19           HA       ILE  19   6.106   7.717   2.427
  138    HB   ILE  19           HB       ILE  19   3.958   6.041   3.749
  139   HG12  ILE  19          HG12      ILE  19   5.193   4.797   2.025
  140   HG13  ILE  19          HG13      ILE  19   3.557   5.150   1.486
  141   HG21  ILE  19          HG21      ILE  19   3.732   8.234   1.689
  142   HG22  ILE  19          HG22      ILE  19   3.191   8.311   3.364
  143   HG23  ILE  19          HG23      ILE  19   2.408   7.206   2.236
  144   HD11  ILE  19          HD11      ILE  19   6.046   6.632   0.680
  145   HD12  ILE  19          HD12      ILE  19   4.408   7.005   0.146
  146   HD13  ILE  19          HD13      ILE  19   5.151   5.470  -0.301
  147    H    GLY  20           H        GLY  20   6.200   6.813   5.749
  148    HA2  GLY  20           HA2      GLY  20   6.286   8.279   7.578
  149    HA3  GLY  20           HA3      GLY  20   5.671   9.566   6.549
  150    H    THR  21           H        THR  21   3.969   6.658   6.287
  151    HA   THR  21           HA       THR  21   1.724   7.790   7.768
  152    HB   THR  21           HB       THR  21   1.771   5.309   6.040
  153    HG1  THR  21           HG1      THR  21   1.159   8.024   5.394
  154   HG21  THR  21          HG21      THR  21  -0.119   5.462   7.601
  155   HG22  THR  21          HG22      THR  21  -0.646   5.646   5.927
  156   HG23  THR  21          HG23      THR  21  -0.505   7.063   6.967
  157    H    VAL  22           H        VAL  22   1.439   7.197   9.813
  158    HA   VAL  22           HA       VAL  22   2.905   4.938  10.847
  159    HB   VAL  22           HB       VAL  22   1.896   5.644  13.070
  160   HG11  VAL  22          HG11      VAL  22   3.409   7.572  13.271
  161   HG12  VAL  22          HG12      VAL  22   3.545   7.642  11.514
  162   HG13  VAL  22          HG13      VAL  22   4.161   6.242  12.391
  163   HG21  VAL  22          HG21      VAL  22   0.961   7.905  13.186
  164   HG22  VAL  22          HG22      VAL  22  -0.047   6.854  12.192
  165   HG23  VAL  22          HG23      VAL  22   1.025   8.028  11.428
  166    H    ILE  23           H        ILE  23   1.901   3.216   9.841
  167    HA   ILE  23           HA       ILE  23  -0.678   2.480  11.056
  168    HB   ILE  23           HB       ILE  23   0.576   1.404   8.518
  169   HG12  ILE  23          HG12      ILE  23  -1.900   3.087   8.966
  170   HG13  ILE  23          HG13      ILE  23  -0.387   3.655   8.271
  171   HG21  ILE  23          HG21      ILE  23  -1.531   0.136   8.270
  172   HG22  ILE  23          HG22      ILE  23  -2.027   0.686   9.871
  173   HG23  ILE  23          HG23      ILE  23  -0.614  -0.352   9.696
  174   HD11  ILE  23          HD11      ILE  23  -0.697   2.156   6.375
  175   HD12  ILE  23          HD12      ILE  23  -2.063   3.257   6.563
  176   HD13  ILE  23          HD13      ILE  23  -2.206   1.578   7.081
  177    H    ASP  24           H        ASP  24  -0.652   0.858  12.487
  178    HA   ASP  24           HA       ASP  24   1.935  -0.473  12.909
  179    HB2  ASP  24           HB2      ASP  24   0.810   1.048  14.683
  180    HB3  ASP  24           HB3      ASP  24  -0.287  -0.306  14.934
  181    H    ASN  25           H        ASN  25   0.858  -2.472  14.672
  182    HA   ASN  25           HA       ASN  25   0.130  -4.374  12.646
  183    HB2  ASN  25           HB2      ASN  25   0.728  -4.586  15.583
  184    HB3  ASN  25           HB3      ASN  25   0.083  -5.955  14.680
  185   HD21  ASN  25          HD21      ASN  25   1.344  -6.970  13.157
  186   HD22  ASN  25          HD22      ASN  25   3.045  -6.674  13.001
  187    H    ASP  26           H        ASP  26  -1.852  -4.296  11.922
  188    HA   ASP  26           HA       ASP  26  -4.078  -4.458  13.852
  189    HB2  ASP  26           HB2      ASP  26  -4.295  -2.508  12.385
  190    HB3  ASP  26           HB3      ASP  26  -4.092  -3.524  10.963
  191    H    ASN  27           H        ASN  27  -3.678  -5.311  10.452
  192    HA   ASN  27           HA       ASN  27  -3.370  -8.094  10.960
  193    HB2  ASN  27           HB2      ASN  27  -5.392  -8.967  10.240
  194    HB3  ASN  27           HB3      ASN  27  -5.951  -7.530  11.089
  195   HD21  ASN  27          HD21      ASN  27  -6.591  -5.710   9.867
  196   HD22  ASN  27          HD22      ASN  27  -7.113  -5.900   8.225
  197    H    CYS  28           H        CYS  28  -3.258  -9.248   8.754
  198    HA   CYS  28           HA       CYS  28  -1.426  -7.674   7.211
  199    HG   CYS  28           HG       CYS  28  -3.976 -10.694   6.791
  200    HB2  CYS  28           HB2      CYS  28  -1.159  -9.822   5.920
  201    HB3  CYS  28           HB3      CYS  28  -0.817  -9.927   7.643
  202    H    THR  29           H        THR  29  -3.891  -6.514   6.919
  203    HA   THR  29           HA       THR  29  -4.385  -6.950   4.057
  204    HB   THR  29           HB       THR  29  -6.533  -6.398   6.123
  205    HG1  THR  29           HG1      THR  29  -6.114  -8.548   6.229
  206   HG21  THR  29          HG21      THR  29  -8.097  -6.680   4.227
  207   HG22  THR  29          HG22      THR  29  -6.718  -6.762   3.128
  208   HG23  THR  29          HG23      THR  29  -7.040  -5.283   4.032
  209    H    SER  30           H        SER  30  -4.055  -5.142   2.940
  210    HA   SER  30           HA       SER  30  -3.919  -2.610   4.406
  211    HG   SER  30           HG       SER  30  -1.770  -1.268   3.153
  212    HB2  SER  30           HB2      SER  30  -1.990  -3.367   2.954
  213    HB3  SER  30           HB3      SER  30  -3.042  -3.147   1.557
  214    H    LYS  31           H        LYS  31  -5.238  -0.905   3.955
  215    HA   LYS  31           HA       LYS  31  -7.550  -1.539   2.231
  216    HB2  LYS  31           HB2      LYS  31  -7.358   0.059   4.789
  217    HB3  LYS  31           HB3      LYS  31  -8.777   0.071   3.754
  218    HG2  LYS  31           HG2      LYS  31  -7.632  -2.407   5.018
  219    HG3  LYS  31           HG3      LYS  31  -8.936  -1.442   5.712
  220    HD2  LYS  31           HD2      LYS  31  -8.989  -2.816   3.028
  221    HD3  LYS  31           HD3      LYS  31  -9.804  -3.372   4.489
  222    HE2  LYS  31           HE2      LYS  31 -11.134  -1.295   4.512
  223    HE3  LYS  31           HE3      LYS  31 -10.347  -0.791   3.018
  224    HZ1  LYS  31           HZ1      LYS  31 -11.273  -2.749   1.929
  225    HZ2  LYS  31           HZ2      LYS  31 -12.501  -1.777   2.564
  226    HZ3  LYS  31           HZ3      LYS  31 -12.047  -3.203   3.363
  227    H    PHE  32           H        PHE  32  -8.258  -0.063   0.798
  228    HA   PHE  32           HA       PHE  32  -7.301   2.692   1.037
  229    HD1  PHE  32           HD1      PHE  32  -5.411   4.065  -0.592
  230    HD2  PHE  32           HD2      PHE  32  -8.725   2.697  -2.885
  231    HE1  PHE  32           HE1      PHE  32  -5.511   6.240  -1.737
  232    HE2  PHE  32           HE2      PHE  32  -8.829   4.870  -4.036
  233    HZ   PHE  32           HZ       PHE  32  -7.224   6.643  -3.461
  234    HB2  PHE  32           HB2      PHE  32  -5.974   1.662  -0.775
  235    HB3  PHE  32           HB3      PHE  32  -7.461   1.167  -1.580
  236    H    SER  33           H        SER  33  -9.010   3.940   1.282
  237    HA   SER  33           HA       SER  33 -11.463   3.288  -0.182
  238    HG   SER  33           HG       SER  33 -12.188   1.648   1.950
  239    HB2  SER  33           HB2      SER  33 -11.431   4.263   2.683
  240    HB3  SER  33           HB3      SER  33 -12.823   3.717   1.751
  241    H    ARG  34           H        ARG  34 -11.956   4.951  -1.466
  242    HA   ARG  34           HA       ARG  34 -11.734   7.661  -0.429
  243    HE   ARG  34           HE       ARG  34 -10.089  11.116  -3.715
  244    HB2  ARG  34           HB2      ARG  34  -9.545   7.281  -1.469
  245    HB3  ARG  34           HB3      ARG  34 -10.332   6.807  -2.969
  246    HG2  ARG  34           HG2      ARG  34 -11.341   9.091  -3.058
  247    HG3  ARG  34           HG3      ARG  34 -10.329   9.524  -1.682
  248    HD2  ARG  34           HD2      ARG  34  -8.335   9.128  -2.942
  249    HD3  ARG  34           HD3      ARG  34  -9.259   8.463  -4.289
  250   HH11  ARG  34          HH11      ARG  34  -7.512   9.291  -5.211
  251   HH12  ARG  34          HH12      ARG  34  -7.066  10.564  -6.312
  252   HH21  ARG  34          HH21      ARG  34  -9.515  12.798  -5.152
  253   HH22  ARG  34          HH22      ARG  34  -8.200  12.563  -6.265
  254    H    PHE  35           H        PHE  35 -13.039   9.150  -1.486
  255    HA   PHE  35           HA       PHE  35 -15.170   8.058  -3.113
  256    HD1  PHE  35           HD2      PHE  35 -16.993   8.400  -0.908
  257    HD2  PHE  35           HD1      PHE  35 -13.920  11.285  -0.339
  258    HE1  PHE  35           HE2      PHE  35 -17.184   8.121   1.528
  259    HE2  PHE  35           HE1      PHE  35 -14.102  11.012   2.098
  260    HZ   PHE  35           HZ       PHE  35 -15.738   9.426   3.033
  261    HB2  PHE  35           HB2      PHE  35 -14.830  10.972  -2.461
  262    HB3  PHE  35           HB3      PHE  35 -16.316  10.059  -2.690
  263    H    PHE  36           H        PHE  36 -14.984   7.977  -5.255
  264    HA   PHE  36           HA       PHE  36 -13.134   9.838  -6.579
  265    HD1  PHE  36           HD2      PHE  36 -12.840   6.169  -5.523
  266    HD2  PHE  36           HD1      PHE  36 -11.050   8.613  -8.510
  267    HE1  PHE  36           HE2      PHE  36 -10.615   5.377  -4.833
  268    HE2  PHE  36           HE1      PHE  36  -8.822   7.824  -7.829
  269    HZ   PHE  36           HZ       PHE  36  -8.603   6.205  -5.985
  270    HB2  PHE  36           HB2      PHE  36 -14.150   7.112  -7.358
  271    HB3  PHE  36           HB3      PHE  36 -13.403   8.188  -8.534
  272    H    ALA  37           H        ALA  37 -13.780  10.780  -8.612
  273    HA   ALA  37           HA       ALA  37 -16.270  12.040  -8.478
  274    HB1  ALA  37           HB1      ALA  37 -15.779  12.918 -10.682
  275    HB2  ALA  37           HB2      ALA  37 -14.527  11.695 -10.911
  276    HB3  ALA  37           HB3      ALA  37 -14.328  12.942  -9.680
  277    H    THR  38           H        THR  38 -15.220   9.337 -10.530
  278    HA   THR  38           HA       THR  38 -18.053   8.637 -10.899
  279    HB   THR  38           HB       THR  38 -16.178   8.152 -13.164
  280    HG1  THR  38           HG1      THR  38 -17.582  10.613 -13.042
  281   HG21  THR  38          HG21      THR  38 -18.211   8.471 -14.486
  282   HG22  THR  38          HG22      THR  38 -19.097   8.914 -13.028
  283   HG23  THR  38          HG23      THR  38 -18.470   7.278 -13.215
  284    H    ARG  39           H        ARG  39 -18.361   6.367 -11.523
  285    HA   ARG  39           HA       ARG  39 -16.914   4.567  -9.968
  286    HE   ARG  39           HE       ARG  39 -18.256  -0.094 -12.341
  287    HB2  ARG  39           HB2      ARG  39 -19.161   4.097 -10.714
  288    HB3  ARG  39           HB3      ARG  39 -18.650   4.090 -12.390
  289    HG2  ARG  39           HG2      ARG  39 -17.315   2.105 -12.009
  290    HG3  ARG  39           HG3      ARG  39 -17.745   2.129 -10.298
  291    HD2  ARG  39           HD2      ARG  39 -20.027   1.676 -10.784
  292    HD3  ARG  39           HD3      ARG  39 -19.769   1.924 -12.511
  293   HH11  ARG  39          HH11      ARG  39 -20.961   0.396 -10.148
  294   HH12  ARG  39          HH12      ARG  39 -21.261  -1.311  -9.952
  295   HH21  ARG  39          HH21      ARG  39 -18.673  -2.322 -12.096
  296   HH22  ARG  39          HH22      ARG  39 -19.957  -2.855 -11.047
  297    H    GLU  40           H        GLU  40 -16.478   5.568 -13.294
  298    HA   GLU  40           HA       GLU  40 -14.638   3.656 -14.138
  299    HB2  GLU  40           HB2      GLU  40 -14.816   6.582 -14.854
  300    HB3  GLU  40           HB3      GLU  40 -13.885   5.379 -15.733
  301    HG2  GLU  40           HG2      GLU  40 -15.957   4.149 -16.192
  302    HG3  GLU  40           HG3      GLU  40 -16.869   5.414 -15.372
  303    H    GLU  41           H        GLU  41 -14.095   6.806 -12.627
  304    HA   GLU  41           HA       GLU  41 -11.341   6.813 -12.418
  305    HB2  GLU  41           HB2      GLU  41 -13.317   7.804 -10.354
  306    HB3  GLU  41           HB3      GLU  41 -11.639   8.303 -10.491
  307    HG2  GLU  41           HG2      GLU  41 -13.746   8.765 -12.585
  308    HG3  GLU  41           HG3      GLU  41 -13.234   9.948 -11.385
  309    H    ALA  42           H        ALA  42 -13.722   5.113 -10.541
  310    HA   ALA  42           HA       ALA  42 -11.938   4.303  -8.448
  311    HB1  ALA  42           HB1      ALA  42 -14.347   4.582  -8.071
  312    HB2  ALA  42           HB2      ALA  42 -13.795   2.960  -7.652
  313    HB3  ALA  42           HB3      ALA  42 -14.666   3.233  -9.162
  314    H    GLU  43           H        GLU  43 -13.518   2.606 -11.161
  315    HA   GLU  43           HA       GLU  43 -12.284   0.122 -10.617
  316    HB2  GLU  43           HB2      GLU  43 -13.567   1.142 -13.151
  317    HB3  GLU  43           HB3      GLU  43 -13.067  -0.523 -12.890
  318    HG2  GLU  43           HG2      GLU  43 -14.584  -0.422 -10.814
  319    HG3  GLU  43           HG3      GLU  43 -15.271   1.008 -11.581
  320    H    SER  44           H        SER  44 -11.325   2.853 -12.619
  321    HA   SER  44           HA       SER  44  -9.216   1.564 -13.973
  322    HG   SER  44           HG       SER  44 -10.789   2.989 -14.966
  323    HB2  SER  44           HB2      SER  44  -9.485   4.468 -13.162
  324    HB3  SER  44           HB3      SER  44  -8.314   3.841 -14.323
  325    H    PHE  45           H        PHE  45  -9.453   3.008 -10.770
  326    HA   PHE  45           HA       PHE  45  -6.633   2.831 -10.251
  327    HD1  PHE  45           HD2      PHE  45  -5.847   5.107  -9.064
  328    HD2  PHE  45           HD1      PHE  45  -7.690   2.516  -6.233
  329    HE1  PHE  45           HE2      PHE  45  -4.030   5.562  -7.468
  330    HE2  PHE  45           HE1      PHE  45  -5.879   2.967  -4.634
  331    HZ   PHE  45           HZ       PHE  45  -4.045   4.492  -5.249
  332    HB2  PHE  45           HB2      PHE  45  -8.297   4.453  -9.165
  333    HB3  PHE  45           HB3      PHE  45  -8.827   3.086  -8.190
  334    H    MET  46           H        MET  46  -9.509   0.930  -9.595
  335    HA   MET  46           HA       MET  46  -8.371  -1.018  -7.926
  336    HB2  MET  46           HB2      MET  46 -10.794  -0.748  -8.270
  337    HB3  MET  46           HB3      MET  46 -10.624  -1.312  -9.923
  338    HG2  MET  46           HG2      MET  46 -11.410  -3.172  -8.811
  339    HG3  MET  46           HG3      MET  46  -9.672  -3.458  -8.874
  340    HE1  MET  46           HE1      MET  46  -8.108  -3.576  -6.774
  341    HE2  MET  46           HE2      MET  46  -8.528  -2.870  -5.213
  342    HE3  MET  46           HE3      MET  46  -8.351  -1.836  -6.631
  343    H    THR  47           H        THR  47  -8.463  -0.705 -11.428
  344    HA   THR  47           HA       THR  47  -7.636  -3.310 -12.084
  345    HB   THR  47           HB       THR  47  -7.169  -0.776 -13.674
  346    HG1  THR  47           HG1      THR  47  -9.369  -0.990 -13.269
  347   HG21  THR  47          HG21      THR  47  -7.149  -2.265 -15.614
  348   HG22  THR  47          HG22      THR  47  -7.361  -3.660 -14.560
  349   HG23  THR  47          HG23      THR  47  -5.877  -2.714 -14.479
  350    H    LYS  48           H        LYS  48  -5.709  -0.307 -11.797
  351    HA   LYS  48           HA       LYS  48  -3.253  -1.594 -12.338
  352    HB2  LYS  48           HB2      LYS  48  -2.213   0.469 -11.402
  353    HB3  LYS  48           HB3      LYS  48  -3.370   0.747 -12.696
  354    HG2  LYS  48           HG2      LYS  48  -5.042   1.444 -11.131
  355    HG3  LYS  48           HG3      LYS  48  -4.004   1.009  -9.769
  356    HD2  LYS  48           HD2      LYS  48  -3.318   3.080 -11.845
  357    HD3  LYS  48           HD3      LYS  48  -4.053   3.433 -10.285
  358    HE2  LYS  48           HE2      LYS  48  -2.133   2.521  -9.129
  359    HE3  LYS  48           HE3      LYS  48  -1.410   2.037 -10.661
  360    HZ1  LYS  48           HZ1      LYS  48  -2.004   4.852  -9.912
  361    HZ2  LYS  48           HZ2      LYS  48  -1.142   4.317 -11.274
  362    HZ3  LYS  48           HZ3      LYS  48  -0.493   4.109  -9.723
  363    H    LEU  49           H        LEU  49  -5.091  -1.118  -9.425
  364    HA   LEU  49           HA       LEU  49  -3.083  -1.733  -7.548
  365    HG   LEU  49           HG       LEU  49  -5.844  -0.275  -5.645
  366    HB2  LEU  49           HB2      LEU  49  -6.024  -1.598  -7.581
  367    HB3  LEU  49           HB3      LEU  49  -5.349  -2.668  -6.369
  368   HD11  LEU  49          HD11      LEU  49  -4.437  -1.815  -4.364
  369   HD12  LEU  49          HD12      LEU  49  -3.862  -0.151  -4.249
  370   HD13  LEU  49          HD13      LEU  49  -3.033  -1.301  -5.300
  371   HD21  LEU  49          HD21      LEU  49  -4.134   1.391  -6.156
  372   HD22  LEU  49          HD22      LEU  49  -4.953   0.857  -7.623
  373   HD23  LEU  49          HD23      LEU  49  -3.339   0.254  -7.246
  374    H    LYS  50           H        LYS  50  -5.211  -3.758  -9.494
  375    HA   LYS  50           HA       LYS  50  -4.673  -6.233  -8.306
  376    HB2  LYS  50           HB2      LYS  50  -5.288  -5.494 -11.167
  377    HB3  LYS  50           HB3      LYS  50  -5.288  -7.137 -10.555
  378    HG2  LYS  50           HG2      LYS  50  -7.214  -6.833  -9.336
  379    HG3  LYS  50           HG3      LYS  50  -7.000  -5.081  -9.234
  380    HD2  LYS  50           HD2      LYS  50  -7.902  -4.714 -11.284
  381    HD3  LYS  50           HD3      LYS  50  -7.309  -6.241 -11.929
  382    HE2  LYS  50           HE2      LYS  50  -9.056  -7.418 -10.614
  383    HE3  LYS  50           HE3      LYS  50  -9.677  -5.851 -10.096
  384    HZ1  LYS  50           HZ1      LYS  50 -10.160  -5.307 -12.395
  385    HZ2  LYS  50           HZ2      LYS  50 -10.920  -6.763 -11.977
  386    HZ3  LYS  50           HZ3      LYS  50  -9.506  -6.784 -12.913
  387    H    GLU  51           H        GLU  51  -3.039  -4.473 -10.896
  388    HA   GLU  51           HA       GLU  51  -1.108  -6.448 -11.491
  389    HB2  GLU  51           HB2      GLU  51  -0.840  -3.460 -11.856
  390    HB3  GLU  51           HB3      GLU  51   0.040  -4.710 -12.719
  391    HG2  GLU  51           HG2      GLU  51  -2.061  -5.470 -13.729
  392    HG3  GLU  51           HG3      GLU  51  -2.913  -4.170 -12.894
  393    H    LEU  52           H        LEU  52  -1.100  -3.646  -9.349
  394    HA   LEU  52           HA       LEU  52   1.612  -3.824  -8.584
  395    HG   LEU  52           HG       LEU  52  -0.200  -1.544  -9.377
  396    HB2  LEU  52           HB2      LEU  52  -0.758  -2.588  -7.191
  397    HB3  LEU  52           HB3      LEU  52   0.908  -2.364  -6.688
  398   HD11  LEU  52          HD11      LEU  52  -1.137  -0.194  -7.571
  399   HD12  LEU  52          HD12      LEU  52  -0.015   0.740  -8.559
  400   HD13  LEU  52          HD13      LEU  52   0.490   0.145  -6.977
  401   HD21  LEU  52          HD21      LEU  52   2.468  -1.006  -8.076
  402   HD22  LEU  52          HD22      LEU  52   1.920  -0.352  -9.620
  403   HD23  LEU  52          HD23      LEU  52   2.176  -2.087  -9.439
  404    H    ALA  53           H        ALA  53  -1.297  -5.362  -7.364
  405    HA   ALA  53           HA       ALA  53  -0.220  -6.398  -4.972
  406    HB1  ALA  53           HB1      ALA  53  -2.396  -7.553  -6.713
  407    HB2  ALA  53           HB2      ALA  53  -2.619  -6.363  -5.431
  408    HB3  ALA  53           HB3      ALA  53  -2.068  -7.992  -5.037
  409    H    ALA  54           H        ALA  54  -0.125  -7.497  -8.295
  410    HA   ALA  54           HA       ALA  54   1.008 -10.054  -7.757
  411    HB1  ALA  54           HB1      ALA  54   1.460 -10.139 -10.150
  412    HB2  ALA  54           HB2      ALA  54   1.083  -8.423 -10.293
  413    HB3  ALA  54           HB3      ALA  54  -0.178  -9.568  -9.839
  414    H    ALA  55           H        ALA  55   2.298  -6.841  -8.221
  415    HA   ALA  55           HA       ALA  55   5.018  -7.719  -8.512
  416    HB1  ALA  55           HB1      ALA  55   5.586  -5.346  -8.339
  417    HB2  ALA  55           HB2      ALA  55   3.920  -4.980  -7.890
  418    HB3  ALA  55           HB3      ALA  55   4.281  -5.613  -9.496
  419    H    ALA  56           H        ALA  56   2.927  -6.789  -5.873
  420    HA   ALA  56           HA       ALA  56   5.065  -6.466  -3.980
  421    HB1  ALA  56           HB1      ALA  56   2.093  -6.682  -3.542
  422    HB2  ALA  56           HB2      ALA  56   3.013  -5.191  -3.755
  423    HB3  ALA  56           HB3      ALA  56   3.283  -6.200  -2.333
  424    H    SER  57           H        SER  57   2.475  -8.891  -4.400
  425    HA   SER  57           HA       SER  57   4.040 -10.671  -2.653
  426    HG   SER  57           HG       SER  57   2.734  -9.420  -1.291
  427    HB2  SER  57           HB2      SER  57   1.055 -10.600  -3.111
  428    HB3  SER  57           HB3      SER  57   1.895 -11.745  -2.067
  429    H    SER  58           H        SER  58   2.361 -10.389  -5.649
  430    HA   SER  58           HA       SER  58   2.264 -11.618  -7.537
  431    HG   SER  58           HG       SER  58   4.497 -10.942  -7.410
  432    HB2  SER  58           HB2      SER  58   4.324 -13.421  -6.225
  433    HB3  SER  58           HB3      SER  58   3.890 -13.406  -7.934
  434    H    ALA  59           H        ALA  59   2.851 -14.055  -5.070
  435    HA   ALA  59           HA       ALA  59   1.759 -15.968  -4.475
  436    HB1  ALA  59           HB1      ALA  59   0.450 -14.236  -3.344
  437    HB2  ALA  59           HB2      ALA  59  -0.521 -15.649  -3.755
  438    HB3  ALA  59           HB3      ALA  59  -0.649 -14.180  -4.723
  439    H    ASP  60           H        ASP  60   1.890 -15.360  -7.487
  440    HA   ASP  60           HA       ASP  60   1.324 -16.346  -9.437
  441    HB2  ASP  60           HB2      ASP  60   0.128 -18.388  -7.576
  442    HB3  ASP  60           HB3      ASP  60  -0.002 -18.536  -9.326
  443    H    GLU  61           H        GLU  61  -1.541 -16.741  -7.362
  444    HA   GLU  61           HA       GLU  61  -3.275 -15.927  -9.543
  445    HB2  GLU  61           HB2      GLU  61  -3.885 -17.785  -8.022
  446    HB3  GLU  61           HB3      GLU  61  -3.924 -16.652  -6.679
  447    HG2  GLU  61           HG2      GLU  61  -5.767 -15.458  -7.716
  448    HG3  GLU  61           HG3      GLU  61  -5.711 -16.551  -9.099
  449    H    GLY  62           H        GLY  62  -1.802 -14.565  -6.738
  450    HA2  GLY  62           HA2      GLY  62  -1.622 -12.115  -6.731
  451    HA3  GLY  62           HA3      GLY  62  -3.323 -12.073  -7.175
  452    H    ALA  63           H        ALA  63  -2.630 -10.602  -5.067
  453    HA   ALA  63           HA       ALA  63  -2.927 -12.009  -2.590
  454    HB1  ALA  63           HB1      ALA  63  -3.060  -9.801  -1.581
  455    HB2  ALA  63           HB2      ALA  63  -3.234  -9.065  -3.174
  456    HB3  ALA  63           HB3      ALA  63  -1.727  -9.870  -2.734
  457    H    SER  64           H        SER  64  -4.734 -11.891  -1.175
  458    HA   SER  64           HA       SER  64  -7.227 -12.260  -2.487
  459    HG   SER  64           HG       SER  64  -6.724 -14.159  -1.382
  460    HB2  SER  64           HB2      SER  64  -6.533 -12.021   0.449
  461    HB3  SER  64           HB3      SER  64  -8.108 -12.515  -0.172
  462    H    VAL  65           H        VAL  65  -8.181 -10.543  -3.397
  463    HA   VAL  65           HA       VAL  65  -8.164  -8.006  -1.955
  464    HB   VAL  65           HB       VAL  65  -7.322  -7.824  -4.203
  465   HG11  VAL  65          HG11      VAL  65  -8.698  -8.327  -6.170
  466   HG12  VAL  65          HG12      VAL  65  -9.947  -8.991  -5.118
  467   HG13  VAL  65          HG13      VAL  65  -8.367  -9.771  -5.211
  468   HG21  VAL  65          HG21      VAL  65  -8.611  -5.939  -3.378
  469   HG22  VAL  65          HG22      VAL  65 -10.098  -6.657  -4.003
  470   HG23  VAL  65          HG23      VAL  65  -8.838  -6.126  -5.117
  471    H    ALA  66           H        ALA  66  -9.835  -7.510  -0.808
  472    HA   ALA  66           HA       ALA  66 -12.522  -8.398  -1.618
  473    HB1  ALA  66           HB1      ALA  66 -11.570  -7.252   1.014
  474    HB2  ALA  66           HB2      ALA  66 -11.902  -8.953   0.687
  475    HB3  ALA  66           HB3      ALA  66 -13.216  -7.776   0.655
  476    H    TYR  67           H        TYR  67 -13.249  -6.933  -3.064
  477    HA   TYR  67           HA       TYR  67 -12.663  -4.102  -2.536
  478    HD1  TYR  67           HD2      TYR  67 -12.146  -7.358  -5.077
  479    HD2  TYR  67           HD1      TYR  67 -14.750  -4.200  -6.237
  480    HE1  TYR  67           HE2      TYR  67 -13.284  -8.878  -6.640
  481    HE2  TYR  67           HE1      TYR  67 -15.893  -5.709  -7.800
  482    HH   TYR  67           HH       TYR  67 -15.408  -9.103  -7.762
  483    HB2  TYR  67           HB2      TYR  67 -12.797  -3.732  -4.944
  484    HB3  TYR  67           HB3      TYR  67 -11.617  -4.984  -4.583
  485    H    LYS  68           H        LYS  68 -14.238  -2.565  -2.780
  486    HA   LYS  68           HA       LYS  68 -16.878  -3.430  -3.694
  487    HB2  LYS  68           HB2      LYS  68 -16.249  -1.838  -1.231
  488    HB3  LYS  68           HB3      LYS  68 -17.787  -1.646  -2.057
  489    HG2  LYS  68           HG2      LYS  68 -18.179  -4.063  -1.805
  490    HG3  LYS  68           HG3      LYS  68 -16.688  -4.174  -0.882
  491    HD2  LYS  68           HD2      LYS  68 -17.584  -2.650   0.793
  492    HD3  LYS  68           HD3      LYS  68 -19.061  -2.459  -0.154
  493    HE2  LYS  68           HE2      LYS  68 -19.479  -4.887   0.095
  494    HE3  LYS  68           HE3      LYS  68 -18.063  -4.994   1.138
  495    HZ1  LYS  68           HZ1      LYS  68 -20.494  -3.365   1.673
  496    HZ2  LYS  68           HZ2      LYS  68 -19.131  -3.458   2.675
  497    HZ3  LYS  68           HZ3      LYS  68 -20.094  -4.828   2.428
  498    H    ILE  69           H        ILE  69 -17.864  -2.124  -5.000
  499    HA   ILE  69           HA       ILE  69 -16.715   0.535  -5.546
  500    HB   ILE  69           HB       ILE  69 -17.768  -1.367  -7.659
  501   HG12  ILE  69          HG12      ILE  69 -14.902  -0.524  -7.147
  502   HG13  ILE  69          HG13      ILE  69 -15.577  -2.084  -6.689
  503   HG21  ILE  69          HG21      ILE  69 -16.448   1.337  -7.870
  504   HG22  ILE  69          HG22      ILE  69 -18.134   0.956  -8.222
  505   HG23  ILE  69          HG23      ILE  69 -16.852   0.297  -9.236
  506   HD11  ILE  69          HD11      ILE  69 -16.004  -2.582  -9.045
  507   HD12  ILE  69          HD12      ILE  69 -14.298  -2.250  -8.741
  508   HD13  ILE  69          HD13      ILE  69 -15.316  -1.022  -9.493
  509    H    LYS  70           H        LYS  70 -18.242   1.842  -4.765
  510    HA   LYS  70           HA       LYS  70 -21.046   1.013  -5.088
  511    HB2  LYS  70           HB2      LYS  70 -20.145   1.100  -2.778
  512    HB3  LYS  70           HB3      LYS  70 -19.877   2.823  -2.977
  513    HG2  LYS  70           HG2      LYS  70 -22.206   3.249  -3.105
  514    HG3  LYS  70           HG3      LYS  70 -22.575   1.526  -3.239
  515    HD2  LYS  70           HD2      LYS  70 -21.651   1.184  -0.978
  516    HD3  LYS  70           HD3      LYS  70 -21.370   2.920  -0.851
  517    HE2  LYS  70           HE2      LYS  70 -23.733   3.358  -0.993
  518    HE3  LYS  70           HE3      LYS  70 -24.068   1.656  -1.307
  519    HZ1  LYS  70           HZ1      LYS  70 -22.864   2.711   1.196
  520    HZ2  LYS  70           HZ2      LYS  70 -23.305   1.100   0.887
  521    HZ3  LYS  70           HZ3      LYS  70 -24.500   2.302   1.001
  522    H    ASP  71           H        ASP  71 -22.203   2.125  -6.398
  523    HA   ASP  71           HA       ASP  71 -21.260   4.615  -7.523
  524    HB2  ASP  71           HB2      ASP  71 -23.670   2.873  -8.077
  525    HB3  ASP  71           HB3      ASP  71 -23.389   4.402  -8.889
  526    H    LEU  72           H        LEU  72 -21.585   6.404  -6.353
  527    HA   LEU  72           HA       LEU  72 -24.112   6.689  -4.888
  528    HG   LEU  72           HG       LEU  72 -21.293   5.971  -3.754
  529    HB2  LEU  72           HB2      LEU  72 -21.566   8.291  -4.613
  530    HB3  LEU  72           HB3      LEU  72 -23.000   8.451  -3.617
  531   HD11  LEU  72          HD11      LEU  72 -21.389   8.147  -1.669
  532   HD12  LEU  72          HD12      LEU  72 -20.048   7.807  -2.762
  533   HD13  LEU  72          HD13      LEU  72 -20.501   6.630  -1.531
  534   HD21  LEU  72          HD21      LEU  72 -23.568   6.759  -1.943
  535   HD22  LEU  72          HD22      LEU  72 -22.548   5.338  -1.730
  536   HD23  LEU  72          HD23      LEU  72 -23.578   5.477  -3.153
  537    H    GLU  73           H        GLU  73 -24.589   9.229  -4.698
  538    HA   GLU  73           HA       GLU  73 -25.076  10.028  -7.452
  539    HB2  GLU  73           HB2      GLU  73 -26.123  11.040  -4.814
  540    HB3  GLU  73           HB3      GLU  73 -26.420  11.888  -6.325
  541    HG2  GLU  73           HG2      GLU  73 -28.318  10.554  -5.863
  542    HG3  GLU  73           HG3      GLU  73 -27.463   9.812  -7.210
  543    H    GLY  74           H        GLY  74 -23.368  10.954  -8.349
  544    HA2  GLY  74           HA2      GLY  74 -22.267  12.998  -8.843
  545    HA3  GLY  74           HA3      GLY  74 -22.451  13.474  -7.161
  546    H    GLN  75           H        GLN  75 -21.484  10.424  -6.897
  547    HA   GLN  75           HA       GLN  75 -18.722  10.536  -7.562
  548    HB2  GLN  75           HB2      GLN  75 -17.894  10.496  -5.182
  549    HB3  GLN  75           HB3      GLN  75 -18.496  12.053  -5.726
  550    HG2  GLN  75           HG2      GLN  75 -20.562  11.724  -4.532
  551    HG3  GLN  75           HG3      GLN  75 -20.072  10.093  -4.075
  552   HE21  GLN  75          HE21      GLN  75 -20.312  10.617  -1.889
  553   HE22  GLN  75          HE22      GLN  75 -19.135  11.582  -1.056
  554    H    VAL  76           H        VAL  76 -17.566   8.671  -6.208
  555    HA   VAL  76           HA       VAL  76 -19.493   6.538  -5.609
  556    HB   VAL  76           HB       VAL  76 -18.124   4.869  -6.791
  557   HG11  VAL  76          HG11      VAL  76 -18.788   5.477  -9.088
  558   HG12  VAL  76          HG12      VAL  76 -19.157   7.108  -8.522
  559   HG13  VAL  76          HG13      VAL  76 -20.075   5.733  -7.906
  560   HG21  VAL  76          HG21      VAL  76 -15.998   6.080  -6.765
  561   HG22  VAL  76          HG22      VAL  76 -16.645   7.237  -7.928
  562   HG23  VAL  76          HG23      VAL  76 -16.425   5.550  -8.392
  563    H    GLU  77           H        GLU  77 -18.622   4.834  -4.325
  564    HA   GLU  77           HA       GLU  77 -16.329   5.680  -2.690
  565    HB2  GLU  77           HB2      GLU  77 -18.435   5.251  -1.486
  566    HB3  GLU  77           HB3      GLU  77 -18.497   3.628  -2.155
  567    HG2  GLU  77           HG2      GLU  77 -17.688   3.267  -0.032
  568    HG3  GLU  77           HG3      GLU  77 -16.213   3.312  -0.994
  569    H    LEU  78           H        LEU  78 -14.451   4.796  -3.317
  570    HA   LEU  78           HA       LEU  78 -14.477   2.073  -4.422
  571    HG   LEU  78           HG       LEU  78 -11.516   2.761  -6.516
  572    HB2  LEU  78           HB2      LEU  78 -13.365   3.932  -5.713
  573    HB3  LEU  78           HB3      LEU  78 -12.200   4.062  -4.413
  574   HD11  LEU  78          HD11      LEU  78 -10.230   1.126  -5.241
  575   HD12  LEU  78          HD12      LEU  78 -11.241   1.422  -3.827
  576   HD13  LEU  78          HD13      LEU  78 -10.211   2.706  -4.459
  577   HD21  LEU  78          HD21      LEU  78 -12.149   0.369  -6.491
  578   HD22  LEU  78          HD22      LEU  78 -13.505   1.444  -6.831
  579   HD23  LEU  78          HD23      LEU  78 -13.329   0.723  -5.230
  580    H    ASP  79           H        ASP  79 -14.109   0.518  -3.026
  581    HA   ASP  79           HA       ASP  79 -12.391   1.105  -0.701
  582    HB2  ASP  79           HB2      ASP  79 -14.786   0.935  -0.087
  583    HB3  ASP  79           HB3      ASP  79 -14.824  -0.696  -0.750
  584    H    ALA  80           H        ALA  80 -10.566   0.051  -0.935
  585    HA   ALA  80           HA       ALA  80 -10.633  -2.649  -2.113
  586    HB1  ALA  80           HB1      ALA  80  -8.304  -2.292  -2.753
  587    HB2  ALA  80           HB2      ALA  80  -8.345  -0.686  -2.025
  588    HB3  ALA  80           HB3      ALA  80  -9.350  -1.043  -3.427
  589    H    ALA  81           H        ALA  81  -9.725  -4.320  -1.048
  590    HA   ALA  81           HA       ALA  81  -8.201  -3.838   1.400
  591    HB1  ALA  81           HB1      ALA  81 -10.527  -4.213   2.092
  592    HB2  ALA  81           HB2      ALA  81  -9.476  -5.533   2.609
  593    HB3  ALA  81           HB3      ALA  81 -10.537  -5.742   1.215
  594    H    PHE  82           H        PHE  82  -6.294  -4.720   0.845
  595    HA   PHE  82           HA       PHE  82  -6.319  -7.265  -0.629
  596    HD1  PHE  82           HD2      PHE  82  -5.655  -3.565  -1.487
  597    HD2  PHE  82           HD1      PHE  82  -4.526  -7.296  -3.193
  598    HE1  PHE  82           HE2      PHE  82  -6.354  -2.760  -3.704
  599    HE2  PHE  82           HE1      PHE  82  -5.218  -6.496  -5.412
  600    HZ   PHE  82           HZ       PHE  82  -6.135  -4.227  -5.670
  601    HB2  PHE  82           HB2      PHE  82  -4.198  -5.143  -0.300
  602    HB3  PHE  82           HB3      PHE  82  -3.853  -6.726  -0.984
  603    H    THR  83           H        THR  83  -6.224  -8.971   0.626
  604    HA   THR  83           HA       THR  83  -4.751  -8.889   3.142
  605    HB   THR  83           HB       THR  83  -6.444 -11.079   1.911
  606    HG1  THR  83           HG1      THR  83  -6.920  -9.119   3.932
  607   HG21  THR  83          HG21      THR  83  -5.206 -10.884   4.662
  608   HG22  THR  83          HG22      THR  83  -4.731 -12.008   3.388
  609   HG23  THR  83          HG23      THR  83  -6.328 -12.136   4.126
  610    H    PHE  84           H        PHE  84  -2.737  -9.539   3.289
  611    HA   PHE  84           HA       PHE  84  -1.579 -11.057   1.044
  612    HD1  PHE  84           HD1      PHE  84  -0.171  -9.272  -0.597
  613    HD2  PHE  84           HD2      PHE  84  -1.202  -7.253   3.007
  614    HE1  PHE  84           HE1      PHE  84  -0.666  -7.237  -1.885
  615    HE2  PHE  84           HE2      PHE  84  -1.700  -5.215   1.724
  616    HZ   PHE  84           HZ       PHE  84  -1.429  -5.207  -0.723
  617    HB2  PHE  84           HB2      PHE  84  -0.160  -9.346   3.100
  618    HB3  PHE  84           HB3      PHE  84   0.554 -10.078   1.668
  619    H    SER  85           H        SER  85   0.620 -12.109   2.037
  620    HA   SER  85           HA       SER  85  -0.234 -14.188   3.756
  621    HG   SER  85           HG       SER  85   0.662 -14.777   1.559
  622    HB2  SER  85           HB2      SER  85   2.620 -13.430   3.114
  623    HB3  SER  85           HB3      SER  85   2.003 -15.022   3.561
  624    H    CYS  86           H        CYS  86   1.814 -11.331   4.202
  625    HA   CYS  86           HA       CYS  86   1.193 -11.349   7.044
  626    HG   CYS  86           HG       CYS  86   4.559 -12.064   8.944
  627    HB2  CYS  86           HB2      CYS  86   3.282 -12.718   6.757
  628    HB3  CYS  86           HB3      CYS  86   4.063 -11.295   6.077
  629    H    GLN  87           H        GLN  87   2.510  -9.305   8.008
  630    HA   GLN  87           HA       GLN  87   1.486  -7.079   6.521
  631    HB2  GLN  87           HB2      GLN  87   1.344  -7.051   8.936
  632    HB3  GLN  87           HB3      GLN  87   3.092  -7.180   9.079
  633    HG2  GLN  87           HG2      GLN  87   3.418  -4.993   8.258
  634    HG3  GLN  87           HG3      GLN  87   1.750  -4.870   7.708
  635   HE21  GLN  87          HE21      GLN  87   0.131  -4.444   9.187
  636   HE22  GLN  87          HE22      GLN  87   0.470  -3.868  10.780
  637    H    ALA  88           H        ALA  88   4.475  -8.714   6.575
  638    HA   ALA  88           HA       ALA  88   6.288  -6.665   5.999
  639    HB1  ALA  88           HB1      ALA  88   7.677  -8.419   4.996
  640    HB2  ALA  88           HB2      ALA  88   6.300  -9.522   5.032
  641    HB3  ALA  88           HB3      ALA  88   6.994  -8.928   6.541
  642    H    GLU  89           H        GLU  89   4.456  -8.750   3.763
  643    HA   GLU  89           HA       GLU  89   5.176  -7.178   1.483
  644    HB2  GLU  89           HB2      GLU  89   3.150  -8.520   0.469
  645    HB3  GLU  89           HB3      GLU  89   4.683  -9.306   0.794
  646    HG2  GLU  89           HG2      GLU  89   2.521  -9.342   2.848
  647    HG3  GLU  89           HG3      GLU  89   2.470 -10.452   1.478
  648    H    MET  90           H        MET  90   2.648  -7.068   3.830
  649    HA   MET  90           HA       MET  90   0.741  -5.537   2.460
  650    HB2  MET  90           HB2      MET  90   0.160  -6.518   4.565
  651    HB3  MET  90           HB3      MET  90   1.459  -5.664   5.385
  652    HG2  MET  90           HG2      MET  90   0.292  -3.523   4.847
  653    HG3  MET  90           HG3      MET  90  -1.057  -4.477   4.234
  654    HE1  MET  90           HE1      MET  90  -2.282  -2.952   7.672
  655    HE2  MET  90           HE2      MET  90  -2.578  -3.023   5.934
  656    HE3  MET  90           HE3      MET  90  -1.139  -2.213   6.551
  657    H    ILE  91           H        ILE  91   3.329  -4.415   4.659
  658    HA   ILE  91           HA       ILE  91   2.724  -1.693   4.357
  659    HB   ILE  91           HB       ILE  91   5.052  -1.327   5.281
  660   HG12  ILE  91          HG12      ILE  91   5.011  -4.332   5.589
  661   HG13  ILE  91          HG13      ILE  91   5.979  -3.482   4.393
  662   HG21  ILE  91          HG21      ILE  91   4.435  -2.161   7.510
  663   HG22  ILE  91          HG22      ILE  91   3.154  -3.126   6.777
  664   HG23  ILE  91          HG23      ILE  91   3.090  -1.364   6.694
  665   HD11  ILE  91          HD11      ILE  91   7.337  -4.066   6.293
  666   HD12  ILE  91          HD12      ILE  91   6.213  -3.259   7.385
  667   HD13  ILE  91          HD13      ILE  91   7.148  -2.313   6.226
  668    H    ILE  92           H        ILE  92   5.154  -3.714   2.695
  669    HA   ILE  92           HA       ILE  92   6.349  -1.558   1.332
  670    HB   ILE  92           HB       ILE  92   7.322  -3.249  -0.186
  671   HG12  ILE  92          HG12      ILE  92   6.912  -5.694   0.824
  672   HG13  ILE  92          HG13      ILE  92   5.328  -5.000   1.149
  673   HG21  ILE  92          HG21      ILE  92   7.487  -3.845   2.757
  674   HG22  ILE  92          HG22      ILE  92   8.463  -2.691   1.848
  675   HG23  ILE  92          HG23      ILE  92   8.632  -4.420   1.545
  676   HD11  ILE  92          HD11      ILE  92   6.662  -5.159  -1.543
  677   HD12  ILE  92          HD12      ILE  92   5.068  -4.475  -1.217
  678   HD13  ILE  92          HD13      ILE  92   5.361  -6.195  -0.963
  679    H    PHE  93           H        PHE  93   3.532  -3.471   0.675
  680    HA   PHE  93           HA       PHE  93   3.198  -2.856  -2.055
  681    HD1  PHE  93           HD2      PHE  93   1.521  -4.134  -3.575
  682    HD2  PHE  93           HD1      PHE  93  -0.922  -2.869  -0.334
  683    HE1  PHE  93           HE2      PHE  93  -0.383  -3.889  -5.111
  684    HE2  PHE  93           HE1      PHE  93  -2.835  -2.626  -1.862
  685    HZ   PHE  93           HZ       PHE  93  -2.567  -3.135  -4.253
  686    HB2  PHE  93           HB2      PHE  93   1.979  -4.677  -1.039
  687    HB3  PHE  93           HB3      PHE  93   1.208  -3.584   0.101
  688    H    GLU  94           H        GLU  94   1.813  -1.366   0.871
  689    HA   GLU  94           HA       GLU  94   0.446   0.632  -0.634
  690    HB2  GLU  94           HB2      GLU  94   0.085   1.684   1.653
  691    HB3  GLU  94           HB3      GLU  94  -0.596   0.089   1.375
  692    HG2  GLU  94           HG2      GLU  94   1.188  -0.937   2.620
  693    HG3  GLU  94           HG3      GLU  94   1.989   0.623   2.816
  694    H    LEU  95           H        LEU  95   3.597   0.467   0.886
  695    HA   LEU  95           HA       LEU  95   4.289   3.174   0.827
  696    HG   LEU  95           HG       LEU  95   5.174   0.676   2.489
  697    HB2  LEU  95           HB2      LEU  95   6.018   0.780   0.174
  698    HB3  LEU  95           HB3      LEU  95   6.624   2.396   0.472
  699   HD11  LEU  95          HD11      LEU  95   7.365  -0.213   2.002
  700   HD12  LEU  95          HD12      LEU  95   7.378   0.562   3.589
  701   HD13  LEU  95          HD13      LEU  95   8.091   1.383   2.200
  702   HD21  LEU  95          HD21      LEU  95   5.833   2.379   4.107
  703   HD22  LEU  95          HD22      LEU  95   4.801   3.067   2.853
  704   HD23  LEU  95          HD23      LEU  95   6.541   3.348   2.815
  705    H    SER  96           H        SER  96   4.601   0.713  -1.698
  706    HA   SER  96           HA       SER  96   5.563   2.401  -3.722
  707    HG   SER  96           HG       SER  96   6.753   0.114  -4.340
  708    HB2  SER  96           HB2      SER  96   3.985  -0.168  -3.938
  709    HB3  SER  96           HB3      SER  96   4.858   0.602  -5.265
  710    H    LEU  97           H        LEU  97   2.262   1.504  -2.799
  711    HA   LEU  97           HA       LEU  97   0.850   2.491  -4.967
  712    HG   LEU  97           HG       LEU  97   0.460   0.322  -2.642
  713    HB2  LEU  97           HB2      LEU  97   0.053   2.643  -2.059
  714    HB3  LEU  97           HB3      LEU  97  -1.038   2.817  -3.418
  715   HD11  LEU  97          HD11      LEU  97  -1.397   0.842  -1.167
  716   HD12  LEU  97          HD12      LEU  97  -1.771  -0.558  -2.173
  717   HD13  LEU  97          HD13      LEU  97  -2.470   1.016  -2.556
  718   HD21  LEU  97          HD21      LEU  97  -1.468   0.801  -4.906
  719   HD22  LEU  97          HD22      LEU  97  -0.816  -0.765  -4.422
  720   HD23  LEU  97          HD23      LEU  97   0.259   0.480  -5.059
  721    H    ARG  98           H        ARG  98   1.949   4.216  -2.083
  722    HA   ARG  98           HA       ARG  98   0.562   6.613  -2.816
  723    HE   ARG  98           HE       ARG  98  -1.295   5.256   1.798
  724    HB2  ARG  98           HB2      ARG  98   2.531   6.054  -0.598
  725    HB3  ARG  98           HB3      ARG  98   1.581   7.528  -0.759
  726    HG2  ARG  98           HG2      ARG  98  -0.458   6.352  -0.425
  727    HG3  ARG  98           HG3      ARG  98   0.348   4.790  -0.552
  728    HD2  ARG  98           HD2      ARG  98   1.637   5.374   1.493
  729    HD3  ARG  98           HD3      ARG  98   0.654   6.829   1.643
  730   HH11  ARG  98          HH11      ARG  98   1.919   4.219   2.725
  731   HH12  ARG  98          HH12      ARG  98   1.344   2.999   3.823
  732   HH21  ARG  98          HH21      ARG  98  -2.037   3.616   3.261
  733   HH22  ARG  98          HH22      ARG  98  -0.854   2.660   4.115
  734    H    SER  99           H        SER  99   3.938   5.525  -2.917
  735    HA   SER  99           HA       SER  99   4.956   8.083  -3.706
  736    HG   SER  99           HG       SER  99   6.817   7.372  -2.051
  737    HB2  SER  99           HB2      SER  99   6.199   5.331  -3.897
  738    HB3  SER  99           HB3      SER  99   7.055   6.846  -4.175
  739    H    LEU 100           H        LEU 100   3.462   5.483  -5.376
  740    HA   LEU 100           HA       LEU 100   4.672   6.065  -7.935
  741    HG   LEU 100           HG       LEU 100   3.013   4.568  -9.827
  742    HB2  LEU 100           HB2      LEU 100   3.804   3.814  -7.010
  743    HB3  LEU 100           HB3      LEU 100   2.232   4.387  -7.516
  744   HD11  LEU 100          HD11      LEU 100   5.353   5.053  -9.441
  745   HD12  LEU 100          HD12      LEU 100   5.196   3.615 -10.450
  746   HD13  LEU 100          HD13      LEU 100   5.596   3.454  -8.739
  747   HD21  LEU 100          HD21      LEU 100   1.986   2.493  -9.060
  748   HD22  LEU 100          HD22      LEU 100   3.570   1.877  -8.588
  749   HD23  LEU 100          HD23      LEU 100   3.213   2.186 -10.289
  750    H    ALA 101           H        ALA 101   1.470   6.402  -6.458
  751    HA   ALA 101           HA       ALA 101   0.376   7.713  -8.761
  752    HB1  ALA 101           HB1      ALA 101  -0.742   7.509  -5.965
  753    HB2  ALA 101           HB2      ALA 101  -1.018   6.348  -7.264
  754    HB3  ALA 101           HB3      ALA 101  -1.627   7.997  -7.410
  755    H    LEU 102           H        LEU 102   1.576   8.676  -5.594
  756    HA   LEU 102           HA       LEU 102   1.762  10.707  -4.544
  757    HG   LEU 102           HG       LEU 102   4.172   9.692  -6.010
  758    HB2  LEU 102           HB2      LEU 102   2.809  11.264  -7.307
  759    HB3  LEU 102           HB3      LEU 102   2.916  12.436  -6.010
  760   HD11  LEU 102          HD11      LEU 102   5.406  12.431  -6.238
  761   HD12  LEU 102          HD12      LEU 102   5.269  11.245  -7.535
  762   HD13  LEU 102          HD13      LEU 102   6.282  10.905  -6.132
  763   HD21  LEU 102          HD21      LEU 102   4.330  11.919  -3.980
  764   HD22  LEU 102          HD22      LEU 102   5.255  10.419  -3.939
  765   HD23  LEU 102          HD23      LEU 102   3.501  10.378  -3.768
  766    H    GLU 103           H        GLU 103  -0.882  10.284  -5.536
  767    HA   GLU 103           HA       GLU 103  -1.704  12.886  -6.566
  768    HB2  GLU 103           HB2      GLU 103  -2.605  10.570  -7.377
  769    HB3  GLU 103           HB3      GLU 103  -3.603  10.637  -5.929
  770    HG2  GLU 103           HG2      GLU 103  -4.515  12.797  -6.703
  771    HG3  GLU 103           HG3      GLU 103  -3.571  12.638  -8.181
  772    H    HIS 104           H        HIS 104  -3.995  13.524  -5.471
  773    HA   HIS 104           HA       HIS 104  -3.193  14.361  -2.857
  774    HD1  HIS 104           HD1      HIS 104  -5.191  16.527  -6.198
  775    HD2  HIS 104           HD2      HIS 104  -2.751  16.937  -2.851
  776    HE1  HIS 104           HE1      HIS 104  -3.645  18.447  -6.708
  777    HE2  HIS 104           HE2      HIS 104  -2.032  18.504  -4.771
  778    HB2  HIS 104           HB2      HIS 104  -5.703  14.836  -4.463
  779    HB3  HIS 104           HB3      HIS 104  -5.465  15.489  -2.843
  780    H    HIS 105           H        HIS 105  -3.530  13.397  -1.015
  781    HA   HIS 105           HA       HIS 105  -5.194  11.038  -0.876
  782    HD1  HIS 105           HD1      HIS 105  -4.340  11.822   3.466
  783    HD2  HIS 105           HD2      HIS 105  -4.679   8.643   0.797
  784    HE1  HIS 105           HE1      HIS 105  -5.183   9.877   4.826
  785    HE2  HIS 105           HE2      HIS 105  -5.352   7.953   3.204
  786    HB2  HIS 105           HB2      HIS 105  -3.004  11.049   0.222
  787    HB3  HIS 105           HB3      HIS 105  -3.493  12.410   1.221
  788    H    HIS 106           H        HIS 106  -7.221  12.057  -1.254
  789    HA   HIS 106           HA       HIS 106  -8.210  13.851   0.822
  790    HD1  HIS 106           HD1      HIS 106 -11.480  14.951   0.183
  791    HD2  HIS 106           HD2      HIS 106  -8.002  16.280  -1.679
  792    HE1  HIS 106           HE1      HIS 106 -11.567  17.465   0.290
  793    HE2  HIS 106           HE2      HIS 106  -9.401  18.249  -0.744
  794    HB2  HIS 106           HB2      HIS 106  -8.718  13.586  -1.938
  795    HB3  HIS 106           HB3      HIS 106 -10.207  13.119  -1.122
  796    H    HIS 107           H        HIS 107  -8.879  12.903   2.603
  797    HA   HIS 107           HA       HIS 107 -11.098  11.198   2.709
  798    HD1  HIS 107           HD1      HIS 107  -9.180   7.744   4.806
  799    HD2  HIS 107           HD2      HIS 107 -12.284   8.885   2.271
  800    HE1  HIS 107           HE1      HIS 107 -11.063   6.126   5.247
  801    HE2  HIS 107           HE2      HIS 107 -12.833   6.707   3.544
  802    HB2  HIS 107           HB2      HIS 107  -9.327   9.577   1.808
  803    HB3  HIS 107           HB3      HIS 107  -8.567   9.692   3.391
  804    H    HIS 108           H        HIS 108  -8.229  12.503   4.119
  805    HA   HIS 108           HA       HIS 108  -7.744  13.415   6.123
  806    HD1  HIS 108           HD1      HIS 108 -10.895  13.878   9.195
  807    HD2  HIS 108           HD2      HIS 108  -7.815  15.864   7.234
  808    HE1  HIS 108           HE1      HIS 108  -9.954  15.491  10.872
  809    HE2  HIS 108           HE2      HIS 108  -7.939  16.493   9.738
  810    HB2  HIS 108           HB2      HIS 108 -10.057  14.411   5.791
  811    HB3  HIS 108           HB3      HIS 108 -10.663  13.138   6.846
  812    H    HIS 109           H        HIS 109  -8.195  10.398   5.674
  813    HA   HIS 109           HA       HIS 109  -7.379   9.637   8.318
  814    HD1  HIS 109           HD1      HIS 109  -9.477   5.932   7.877
  815    HD2  HIS 109           HD2      HIS 109  -8.666   8.675  10.904
  816    HE1  HIS 109           HE1      HIS 109  -9.082   4.564   9.949
  817    HE2  HIS 109           HE2      HIS 109  -8.774   6.245  11.800
  818    HB2  HIS 109           HB2      HIS 109  -9.894   9.538   8.421
  819    HB3  HIS 109           HB3      HIS 109  -9.840   8.318   7.153
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1  15.132 -23.624 -44.661
    2    H1   MET   1           H1       MET   1  13.026 -22.652 -44.205
    3    H2   MET   1           H2       MET   1  13.719 -21.136 -43.901
    4    H3   MET   1           H3       MET   1  14.023 -22.431 -42.848
    5    HB2  MET   1           HB2      MET   1  13.987 -22.513 -46.519
    6    HB3  MET   1           HB3      MET   1  14.750 -20.987 -46.097
    7    HG2  MET   1           HG2      MET   1  16.949 -21.978 -46.587
    8    HG3  MET   1           HG3      MET   1  16.144 -23.469 -47.074
    9    HE1  MET   1           HE1      MET   1  17.414 -23.373 -49.419
   10    HE2  MET   1           HE2      MET   1  18.213 -21.897 -48.878
   11    HE3  MET   1           HE3      MET   1  17.422 -21.944 -50.454
   12    H    ALA   2           H        ALA   2  16.894 -23.785 -43.494
   13    HA   ALA   2           HA       ALA   2  18.777 -23.307 -42.323
   14    HB1  ALA   2           HB1      ALA   2  20.434 -22.037 -43.533
   15    HB2  ALA   2           HB2      ALA   2  19.184 -21.347 -44.568
   16    HB3  ALA   2           HB3      ALA   2  19.533 -23.075 -44.638
   17    H    MET   3           H        MET   3  17.008 -22.219 -40.828
   18    HA   MET   3           HA       MET   3  18.345 -19.780 -39.964
   19    HB2  MET   3           HB2      MET   3  16.353 -19.037 -41.255
   20    HB3  MET   3           HB3      MET   3  15.332 -19.940 -40.146
   21    HG2  MET   3           HG2      MET   3  16.086 -18.546 -38.296
   22    HG3  MET   3           HG3      MET   3  17.140 -17.656 -39.391
   23    HE1  MET   3           HE1      MET   3  13.448 -18.457 -38.367
   24    HE2  MET   3           HE2      MET   3  13.493 -18.974 -40.052
   25    HE3  MET   3           HE3      MET   3  12.533 -17.569 -39.586
   26    H    LYS   4           H        LYS   4  19.260 -21.004 -38.362
   27    HA   LYS   4           HA       LYS   4  17.404 -21.805 -36.215
   28    HB2  LYS   4           HB2      LYS   4  20.167 -22.904 -36.781
   29    HB3  LYS   4           HB3      LYS   4  19.100 -23.410 -35.478
   30    HG2  LYS   4           HG2      LYS   4  17.504 -24.275 -37.081
   31    HG3  LYS   4           HG3      LYS   4  18.507 -23.706 -38.417
   32    HD2  LYS   4           HD2      LYS   4  20.309 -25.197 -37.681
   33    HD3  LYS   4           HD3      LYS   4  19.290 -25.767 -36.357
   34    HE2  LYS   4           HE2      LYS   4  18.675 -26.036 -39.297
   35    HE3  LYS   4           HE3      LYS   4  19.279 -27.320 -38.251
   36    HZ1  LYS   4           HZ1      LYS   4  17.275 -27.175 -36.935
   37    HZ2  LYS   4           HZ2      LYS   4  16.874 -27.444 -38.563
   38    HZ3  LYS   4           HZ3      LYS   4  16.692 -25.899 -37.889
   39    H    ASP   5           H        ASP   5  17.415 -19.685 -35.373
   40    HA   ASP   5           HA       ASP   5  19.974 -18.899 -34.146
   41    HB2  ASP   5           HB2      ASP   5  19.173 -17.425 -36.062
   42    HB3  ASP   5           HB3      ASP   5  17.832 -16.958 -35.019
   43    H    VAL   6           H        VAL   6  19.709 -19.591 -32.119
   44    HA   VAL   6           HA       VAL   6  17.154 -19.359 -30.772
   45    HB   VAL   6           HB       VAL   6  19.802 -20.291 -29.653
   46   HG11  VAL   6          HG11      VAL   6  18.450 -21.397 -27.957
   47   HG12  VAL   6          HG12      VAL   6  16.983 -20.741 -28.685
   48   HG13  VAL   6          HG13      VAL   6  18.167 -19.656 -27.953
   49   HG21  VAL   6          HG21      VAL   6  19.156 -21.649 -31.573
   50   HG22  VAL   6          HG22      VAL   6  17.563 -21.908 -30.863
   51   HG23  VAL   6          HG23      VAL   6  18.997 -22.565 -30.074
   52    H    VAL   7           H        VAL   7  16.549 -17.616 -29.663
   53    HA   VAL   7           HA       VAL   7  18.631 -15.966 -28.399
   54    HB   VAL   7           HB       VAL   7  17.896 -14.783 -30.403
   55   HG11  VAL   7          HG11      VAL   7  15.584 -14.003 -30.645
   56   HG12  VAL   7          HG12      VAL   7  15.127 -14.946 -29.225
   57   HG13  VAL   7          HG13      VAL   7  15.697 -15.763 -30.682
   58   HG21  VAL   7          HG21      VAL   7  17.196 -12.675 -29.369
   59   HG22  VAL   7          HG22      VAL   7  18.488 -13.458 -28.457
   60   HG23  VAL   7          HG23      VAL   7  16.825 -13.538 -27.875
   61    H    ASP   8           H        ASP   8  18.223 -15.315 -26.356
   62    HA   ASP   8           HA       ASP   8  15.596 -15.312 -25.207
   63    HB2  ASP   8           HB2      ASP   8  16.073 -17.735 -25.165
   64    HB3  ASP   8           HB3      ASP   8  17.561 -17.420 -24.276
   65    H    LYS   9           H        LYS   9  15.506 -14.006 -23.497
   66    HA   LYS   9           HA       LYS   9  18.083 -12.973 -22.538
   67    HB2  LYS   9           HB2      LYS   9  16.855 -10.760 -22.327
   68    HB3  LYS   9           HB3      LYS   9  17.276 -11.283 -23.941
   69    HG2  LYS   9           HG2      LYS   9  15.101 -10.388 -24.067
   70    HG3  LYS   9           HG3      LYS   9  14.917 -12.137 -24.158
   71    HD2  LYS   9           HD2      LYS   9  14.249 -12.224 -21.836
   72    HD3  LYS   9           HD3      LYS   9  14.550 -10.495 -21.653
   73    HE2  LYS   9           HE2      LYS   9  12.556 -11.632 -23.602
   74    HE3  LYS   9           HE3      LYS   9  12.136 -11.161 -21.956
   75    HZ1  LYS   9           HZ1      LYS   9  11.685  -9.423 -23.624
   76    HZ2  LYS   9           HZ2      LYS   9  13.344  -9.331 -23.970
   77    HZ3  LYS   9           HZ3      LYS   9  12.771  -8.915 -22.427
   78    H    CYS  10           H        CYS  10  18.015 -11.904 -20.448
   79    HA   CYS  10           HA       CYS  10  15.872 -12.926 -18.707
   80    HG   CYS  10           HG       CYS  10  19.591 -11.899 -19.307
   81    HB2  CYS  10           HB2      CYS  10  17.650 -13.057 -16.903
   82    HB3  CYS  10           HB3      CYS  10  17.780 -14.255 -18.187
   83    H    SER  11           H        SER  11  14.709 -11.064 -18.615
   84    HA   SER  11           HA       SER  11  15.765  -8.951 -16.978
   85    HG   SER  11           HG       SER  11  14.870  -6.297 -19.092
   86    HB2  SER  11           HB2      SER  11  16.575  -8.313 -19.254
   87    HB3  SER  11           HB3      SER  11  14.900  -8.269 -19.800
   88    H    THR  12           H        THR  12  14.093  -9.513 -15.611
   89    HA   THR  12           HA       THR  12  11.612  -8.163 -16.231
   90    HB   THR  12           HB       THR  12  11.227 -10.487 -17.065
   91    HG1  THR  12           HG1      THR  12   9.721  -9.382 -14.944
   92   HG21  THR  12          HG21      THR  12  11.519 -11.247 -14.158
   93   HG22  THR  12          HG22      THR  12  12.621 -11.695 -15.459
   94   HG23  THR  12          HG23      THR  12  10.967 -12.309 -15.453
   95    H    LYS  13           H        LYS  13  13.932  -9.431 -14.102
   96    HA   LYS  13           HA       LYS  13  12.453  -8.427 -11.759
   97    HB2  LYS  13           HB2      LYS  13  14.708 -10.442 -11.890
   98    HB3  LYS  13           HB3      LYS  13  13.883  -9.920 -10.428
   99    HG2  LYS  13           HG2      LYS  13  11.925 -11.055 -10.976
  100    HG3  LYS  13           HG3      LYS  13  12.368 -11.186 -12.680
  101    HD2  LYS  13           HD2      LYS  13  12.598 -13.337 -11.572
  102    HD3  LYS  13           HD3      LYS  13  14.174 -12.734 -12.082
  103    HE2  LYS  13           HE2      LYS  13  14.556 -11.914  -9.778
  104    HE3  LYS  13           HE3      LYS  13  13.025 -12.643  -9.298
  105    HZ1  LYS  13           HZ1      LYS  13  13.895 -14.804  -9.951
  106    HZ2  LYS  13           HZ2      LYS  13  14.881 -14.086  -8.774
  107    HZ3  LYS  13           HZ3      LYS  13  15.371 -14.095 -10.399
  108    H    GLY  14           H        GLY  14  13.413  -6.847 -10.518
  109    HA2  GLY  14           HA2      GLY  14  16.063  -6.315 -10.156
  110    HA3  GLY  14           HA3      GLY  14  15.693  -5.508 -11.668
  111    H    CYS  15           H        CYS  15  15.136  -5.590  -8.239
  112    HA   CYS  15           HA       CYS  15  14.487  -4.026  -6.736
  113    HG   CYS  15           HG       CYS  15  16.380  -0.474  -6.624
  114    HB2  CYS  15           HB2      CYS  15  16.454  -2.892  -7.770
  115    HB3  CYS  15           HB3      CYS  15  15.351  -2.047  -8.851
  116    H    ALA  16           H        ALA  16  12.279  -4.513  -6.754
  117    HA   ALA  16           HA       ALA  16  10.638  -2.509  -8.163
  118    HB1  ALA  16           HB1      ALA  16  10.401  -4.693  -9.242
  119    HB2  ALA  16           HB2      ALA  16   8.896  -4.181  -8.477
  120    HB3  ALA  16           HB3      ALA  16   9.910  -5.400  -7.703
  121    H    ILE  17           H        ILE  17  10.395  -4.953  -5.565
  122    HA   ILE  17           HA       ILE  17   8.560  -3.124  -4.191
  123    HB   ILE  17           HB       ILE  17   7.935  -5.166  -2.838
  124   HG12  ILE  17          HG12      ILE  17   9.383  -6.597  -5.083
  125   HG13  ILE  17          HG13      ILE  17   9.942  -6.514  -3.415
  126   HG21  ILE  17          HG21      ILE  17   6.525  -4.258  -4.592
  127   HG22  ILE  17          HG22      ILE  17   6.452  -6.018  -4.591
  128   HG23  ILE  17          HG23      ILE  17   7.413  -5.179  -5.808
  129   HD11  ILE  17          HD11      ILE  17   8.877  -8.643  -3.883
  130   HD12  ILE  17          HD12      ILE  17   7.396  -7.812  -4.361
  131   HD13  ILE  17          HD13      ILE  17   7.954  -7.730  -2.691
  132    H    ASP  18           H        ASP  18  10.443  -1.897  -3.507
  133    HA   ASP  18           HA       ASP  18  10.812  -2.232  -0.761
  134    HB2  ASP  18           HB2      ASP  18  12.438  -3.990  -1.411
  135    HB3  ASP  18           HB3      ASP  18  13.337  -2.791  -2.341
  136    H    ILE  19           H        ILE  19  10.463  -0.154  -0.386
  137    HA   ILE  19           HA       ILE  19  11.622   1.877  -2.118
  138    HB   ILE  19           HB       ILE  19   9.694   2.139   0.196
  139   HG12  ILE  19          HG12      ILE  19   9.238   2.252  -2.795
  140   HG13  ILE  19          HG13      ILE  19   8.745   0.944  -1.727
  141   HG21  ILE  19          HG21      ILE  19  10.625   4.191  -1.805
  142   HG22  ILE  19          HG22      ILE  19  10.979   4.173  -0.078
  143   HG23  ILE  19          HG23      ILE  19   9.325   4.427  -0.636
  144   HD11  ILE  19          HD11      ILE  19   6.876   2.375  -2.298
  145   HD12  ILE  19          HD12      ILE  19   7.729   3.773  -1.643
  146   HD13  ILE  19          HD13      ILE  19   7.230   2.463  -0.573
  147    H    GLY  20           H        GLY  20  11.340   1.406   1.406
  148    HA2  GLY  20           HA2      GLY  20  13.474   1.452   2.685
  149    HA3  GLY  20           HA3      GLY  20  13.923   2.821   1.674
  150    H    THR  21           H        THR  21  10.706   2.302   2.927
  151    HA   THR  21           HA       THR  21  11.109   4.541   4.795
  152    HB   THR  21           HB       THR  21   8.581   4.007   3.212
  153    HG1  THR  21           HG1      THR  21  10.790   5.723   2.754
  154   HG21  THR  21          HG21      THR  21   7.938   6.250   3.997
  155   HG22  THR  21          HG22      THR  21   9.422   6.333   4.946
  156   HG23  THR  21          HG23      THR  21   8.189   5.135   5.340
  157    H    VAL  22           H        VAL  22  10.732   3.980   6.825
  158    HA   VAL  22           HA       VAL  22   9.343   1.494   7.405
  159    HB   VAL  22           HB       VAL  22  10.034   1.869   9.738
  160   HG11  VAL  22          HG11      VAL  22  12.445   1.634   9.401
  161   HG12  VAL  22          HG12      VAL  22  12.270   2.225   7.749
  162   HG13  VAL  22          HG13      VAL  22  11.535   0.693   8.218
  163   HG21  VAL  22          HG21      VAL  22   9.932   4.308   9.794
  164   HG22  VAL  22          HG22      VAL  22  11.304   4.398   8.690
  165   HG23  VAL  22          HG23      VAL  22  11.519   3.735  10.310
  166    H    ILE  23           H        ILE  23   7.539   1.331   8.778
  167    HA   ILE  23           HA       ILE  23   6.176   3.669   9.706
  168    HB   ILE  23           HB       ILE  23   5.450   3.848   7.428
  169   HG12  ILE  23          HG12      ILE  23   3.244   2.591   9.071
  170   HG13  ILE  23          HG13      ILE  23   3.767   4.268   9.183
  171   HG21  ILE  23          HG21      ILE  23   4.275   2.056   6.247
  172   HG22  ILE  23          HG22      ILE  23   4.569   0.973   7.607
  173   HG23  ILE  23          HG23      ILE  23   5.925   1.593   6.664
  174   HD11  ILE  23          HD11      ILE  23   2.553   2.961   6.759
  175   HD12  ILE  23          HD12      ILE  23   3.066   4.644   6.880
  176   HD13  ILE  23          HD13      ILE  23   1.733   4.054   7.873
  177    H    ASP  24           H        ASP  24   5.787   0.253   8.858
  178    HA   ASP  24           HA       ASP  24   5.233  -1.568  10.064
  179    HB2  ASP  24           HB2      ASP  24   5.659   0.296  12.396
  180    HB3  ASP  24           HB3      ASP  24   5.266  -1.410  12.583
  181    H    ASN  25           H        ASN  25   3.271  -2.210   9.622
  182    HA   ASN  25           HA       ASN  25   0.959  -0.593  10.199
  183    HB2  ASN  25           HB2      ASN  25   1.346  -3.275   8.885
  184    HB3  ASN  25           HB3      ASN  25  -0.256  -2.645   9.241
  185   HD21  ASN  25          HD21      ASN  25  -1.063  -0.951   8.050
  186   HD22  ASN  25          HD22      ASN  25  -0.306  -0.400   6.583
  187    H    ASP  26           H        ASP  26  -0.907  -1.398  11.321
  188    HA   ASP  26           HA       ASP  26  -0.220  -2.780  13.777
  189    HB2  ASP  26           HB2      ASP  26  -2.523  -2.181  14.461
  190    HB3  ASP  26           HB3      ASP  26  -1.621  -0.777  13.898
  191    H    ASN  27           H        ASN  27  -1.541  -3.514  10.728
  192    HA   ASN  27           HA       ASN  27  -1.959  -6.258  11.494
  193    HB2  ASN  27           HB2      ASN  27  -4.261  -6.441  10.868
  194    HB3  ASN  27           HB3      ASN  27  -4.151  -5.111  12.014
  195   HD21  ASN  27          HD21      ASN  27  -4.450  -2.978  11.267
  196   HD22  ASN  27          HD22      ASN  27  -5.181  -2.663   9.722
  197    H    CYS  28           H        CYS  28  -2.637  -7.559   9.459
  198    HA   CYS  28           HA       CYS  28  -0.933  -6.554   7.295
  199    HG   CYS  28           HG       CYS  28   0.530 -10.218   8.647
  200    HB2  CYS  28           HB2      CYS  28  -1.955  -9.345   7.846
  201    HB3  CYS  28           HB3      CYS  28  -0.830  -8.903   6.566
  202    H    THR  29           H        THR  29  -3.977  -6.110   7.862
  203    HA   THR  29           HA       THR  29  -5.000  -6.937   5.238
  204    HB   THR  29           HB       THR  29  -6.509  -5.743   7.581
  205    HG1  THR  29           HG1      THR  29  -5.966  -7.768   8.212
  206   HG21  THR  29          HG21      THR  29  -8.515  -6.463   6.383
  207   HG22  THR  29          HG22      THR  29  -7.521  -7.061   5.055
  208   HG23  THR  29          HG23      THR  29  -7.580  -5.334   5.404
  209    H    SER  30           H        SER  30  -5.086  -5.497   3.636
  210    HA   SER  30           HA       SER  30  -4.488  -2.707   4.284
  211    HG   SER  30           HG       SER  30  -2.712  -1.999   2.015
  212    HB2  SER  30           HB2      SER  30  -3.038  -3.958   2.651
  213    HB3  SER  30           HB3      SER  30  -4.427  -4.043   1.570
  214    H    LYS  31           H        LYS  31  -6.337  -1.660   4.693
  215    HA   LYS  31           HA       LYS  31  -8.555  -1.916   2.780
  216    HB2  LYS  31           HB2      LYS  31  -8.336  -0.830   5.572
  217    HB3  LYS  31           HB3      LYS  31  -9.615  -0.251   4.519
  218    HG2  LYS  31           HG2      LYS  31  -9.145  -3.094   5.383
  219    HG3  LYS  31           HG3      LYS  31 -10.434  -2.022   5.929
  220    HD2  LYS  31           HD2      LYS  31 -10.043  -3.205   3.189
  221    HD3  LYS  31           HD3      LYS  31 -11.381  -3.474   4.303
  222    HE2  LYS  31           HE2      LYS  31 -10.729  -0.853   2.958
  223    HE3  LYS  31           HE3      LYS  31 -11.968  -1.984   2.426
  224    HZ1  LYS  31           HZ1      LYS  31 -13.041  -1.673   4.627
  225    HZ2  LYS  31           HZ2      LYS  31 -12.997  -0.272   3.674
  226    HZ3  LYS  31           HZ3      LYS  31 -11.915  -0.446   4.967
  227    H    PHE  32           H        PHE  32  -8.651  -0.508   1.191
  228    HA   PHE  32           HA       PHE  32  -7.730   2.242   1.710
  229    HD1  PHE  32           HD2      PHE  32  -5.505   3.372   0.686
  230    HD2  PHE  32           HD1      PHE  32  -8.205   2.486  -2.481
  231    HE1  PHE  32           HE2      PHE  32  -5.030   5.563  -0.326
  232    HE2  PHE  32           HE1      PHE  32  -7.734   4.674  -3.497
  233    HZ   PHE  32           HZ       PHE  32  -6.147   6.216  -2.422
  234    HB2  PHE  32           HB2      PHE  32  -6.237   1.016   0.112
  235    HB3  PHE  32           HB3      PHE  32  -7.621   0.813  -0.959
  236    H    SER  33           H        SER  33  -9.382   3.589   1.726
  237    HA   SER  33           HA       SER  33 -11.708   3.001   0.022
  238    HG   SER  33           HG       SER  33 -12.887   1.690   2.297
  239    HB2  SER  33           HB2      SER  33 -11.822   4.211   2.796
  240    HB3  SER  33           HB3      SER  33 -13.188   3.737   1.787
  241    H    ARG  34           H        ARG  34 -11.671   4.489  -1.529
  242    HA   ARG  34           HA       ARG  34 -11.123   7.290  -0.790
  243    HE   ARG  34           HE       ARG  34  -7.831   9.912  -3.073
  244    HB2  ARG  34           HB2      ARG  34  -9.275   5.769  -2.039
  245    HB3  ARG  34           HB3      ARG  34 -10.162   6.346  -3.433
  246    HG2  ARG  34           HG2      ARG  34  -9.127   8.242  -1.362
  247    HG3  ARG  34           HG3      ARG  34  -8.091   7.639  -2.653
  248    HD2  ARG  34           HD2      ARG  34  -9.867   8.457  -4.268
  249    HD3  ARG  34           HD3      ARG  34 -10.591   9.295  -2.894
  250   HH11  ARG  34          HH11      ARG  34 -10.901  10.619  -4.617
  251   HH12  ARG  34          HH12      ARG  34 -10.377  12.162  -5.234
  252   HH21  ARG  34          HH21      ARG  34  -7.144  11.926  -3.889
  253   HH22  ARG  34          HH22      ARG  34  -8.239  12.897  -4.829
  254    H    PHE  35           H        PHE  35 -12.272   8.801  -1.945
  255    HA   PHE  35           HA       PHE  35 -14.510   7.736  -3.506
  256    HD1  PHE  35           HD1      PHE  35 -16.753   8.013  -2.148
  257    HD2  PHE  35           HD2      PHE  35 -13.858  10.410  -0.151
  258    HE1  PHE  35           HE1      PHE  35 -17.681   7.320   0.023
  259    HE2  PHE  35           HE2      PHE  35 -14.782   9.719   2.023
  260    HZ   PHE  35           HZ       PHE  35 -16.696   8.171   2.111
  261    HB2  PHE  35           HB2      PHE  35 -14.042  10.535  -2.459
  262    HB3  PHE  35           HB3      PHE  35 -15.502   9.971  -3.260
  263    H    PHE  36           H        PHE  36 -14.692   8.008  -5.647
  264    HA   PHE  36           HA       PHE  36 -12.682   9.726  -6.956
  265    HD1  PHE  36           HD2      PHE  36 -10.465   8.795  -8.200
  266    HD2  PHE  36           HD1      PHE  36 -12.548   5.642  -6.253
  267    HE1  PHE  36           HE2      PHE  36  -8.337   7.951  -7.303
  268    HE2  PHE  36           HE1      PHE  36 -10.422   4.790  -5.349
  269    HZ   PHE  36           HZ       PHE  36  -8.315   5.945  -5.875
  270    HB2  PHE  36           HB2      PHE  36 -13.672   6.999  -7.784
  271    HB3  PHE  36           HB3      PHE  36 -12.786   8.067  -8.868
  272    H    ALA  37           H        ALA  37 -13.278  10.571  -9.046
  273    HA   ALA  37           HA       ALA  37 -15.632  11.991  -9.015
  274    HB1  ALA  37           HB1      ALA  37 -15.189  12.559 -11.332
  275    HB2  ALA  37           HB2      ALA  37 -14.074  11.198 -11.471
  276    HB3  ALA  37           HB3      ALA  37 -13.689  12.549 -10.404
  277    H    THR  38           H        THR  38 -15.008   9.012 -10.865
  278    HA   THR  38           HA       THR  38 -17.906   8.549 -10.904
  279    HB   THR  38           HB       THR  38 -17.611   7.561 -13.220
  280    HG1  THR  38           HG1      THR  38 -15.626   9.062 -14.082
  281   HG21  THR  38          HG21      THR  38 -17.784   9.723 -14.370
  282   HG22  THR  38          HG22      THR  38 -17.180  10.537 -12.927
  283   HG23  THR  38          HG23      THR  38 -18.736   9.706 -12.886
  284    H    ARG  39           H        ARG  39 -18.396   6.217 -11.511
  285    HA   ARG  39           HA       ARG  39 -16.877   4.461  -9.887
  286    HE   ARG  39           HE       ARG  39 -21.083   4.851 -11.941
  287    HB2  ARG  39           HB2      ARG  39 -18.383   2.760 -10.558
  288    HB3  ARG  39           HB3      ARG  39 -19.324   4.239 -10.494
  289    HG2  ARG  39           HG2      ARG  39 -18.981   4.427 -12.983
  290    HG3  ARG  39           HG3      ARG  39 -18.334   2.784 -12.924
  291    HD2  ARG  39           HD2      ARG  39 -20.652   2.655 -13.491
  292    HD3  ARG  39           HD3      ARG  39 -20.454   2.059 -11.843
  293   HH11  ARG  39          HH11      ARG  39 -22.449   1.617 -11.919
  294   HH12  ARG  39          HH12      ARG  39 -24.048   2.162 -11.496
  295   HH21  ARG  39          HH21      ARG  39 -23.148   5.558 -11.323
  296   HH22  ARG  39          HH22      ARG  39 -24.441   4.407 -11.145
  297    H    GLU  40           H        GLU  40 -16.607   5.508 -13.125
  298    HA   GLU  40           HA       GLU  40 -15.052   3.488 -14.281
  299    HB2  GLU  40           HB2      GLU  40 -14.906   6.463 -14.709
  300    HB3  GLU  40           HB3      GLU  40 -14.263   5.233 -15.782
  301    HG2  GLU  40           HG2      GLU  40 -17.170   5.424 -15.068
  302    HG3  GLU  40           HG3      GLU  40 -16.449   6.258 -16.433
  303    H    GLU  41           H        GLU  41 -14.176   6.431 -12.544
  304    HA   GLU  41           HA       GLU  41 -11.401   6.202 -12.596
  305    HB2  GLU  41           HB2      GLU  41 -13.254   7.483 -10.589
  306    HB3  GLU  41           HB3      GLU  41 -11.509   7.677 -10.551
  307    HG2  GLU  41           HG2      GLU  41 -13.262   8.449 -12.870
  308    HG3  GLU  41           HG3      GLU  41 -12.701   9.558 -11.620
  309    H    ALA  42           H        ALA  42 -13.778   4.646 -10.607
  310    HA   ALA  42           HA       ALA  42 -12.025   3.783  -8.530
  311    HB1  ALA  42           HB1      ALA  42 -13.845   2.246  -7.919
  312    HB2  ALA  42           HB2      ALA  42 -14.686   2.664  -9.411
  313    HB3  ALA  42           HB3      ALA  42 -14.427   3.891  -8.172
  314    H    GLU  43           H        GLU  43 -13.389   2.173 -11.389
  315    HA   GLU  43           HA       GLU  43 -11.917  -0.210 -11.179
  316    HB2  GLU  43           HB2      GLU  43 -13.349   1.194 -13.394
  317    HB3  GLU  43           HB3      GLU  43 -12.301  -0.163 -13.784
  318    HG2  GLU  43           HG2      GLU  43 -14.577  -0.273 -11.820
  319    HG3  GLU  43           HG3      GLU  43 -14.665  -0.790 -13.504
  320    H    SER  44           H        SER  44 -11.197   2.885 -12.717
  321    HA   SER  44           HA       SER  44  -8.876   2.112 -14.074
  322    HG   SER  44           HG       SER  44 -10.460   3.387 -15.061
  323    HB2  SER  44           HB2      SER  44  -9.623   4.797 -12.902
  324    HB3  SER  44           HB3      SER  44  -8.295   4.529 -14.033
  325    H    PHE  45           H        PHE  45  -9.358   3.165 -10.726
  326    HA   PHE  45           HA       PHE  45  -6.569   3.285 -10.136
  327    HD1  PHE  45           HD2      PHE  45  -6.079   5.368  -8.434
  328    HD2  PHE  45           HD1      PHE  45  -7.696   2.046  -6.320
  329    HE1  PHE  45           HE2      PHE  45  -4.395   5.678  -6.668
  330    HE2  PHE  45           HE1      PHE  45  -6.015   2.350  -4.551
  331    HZ   PHE  45           HZ       PHE  45  -4.364   4.168  -4.721
  332    HB2  PHE  45           HB2      PHE  45  -8.399   4.479  -8.857
  333    HB3  PHE  45           HB3      PHE  45  -8.842   2.918  -8.173
  334    H    MET  46           H        MET  46  -9.106   0.874  -9.827
  335    HA   MET  46           HA       MET  46  -7.570  -1.036  -8.405
  336    HB2  MET  46           HB2      MET  46 -10.034  -1.055  -8.485
  337    HB3  MET  46           HB3      MET  46  -9.972  -1.454 -10.196
  338    HG2  MET  46           HG2      MET  46 -10.448  -3.397  -8.784
  339    HG3  MET  46           HG3      MET  46  -8.962  -3.583  -9.710
  340    HE1  MET  46           HE1      MET  46  -9.407  -1.351  -6.511
  341    HE2  MET  46           HE2      MET  46  -8.991  -2.481  -5.223
  342    HE3  MET  46           HE3      MET  46 -10.465  -2.717  -6.160
  343    H    THR  47           H        THR  47  -7.873  -0.268 -11.800
  344    HA   THR  47           HA       THR  47  -6.895  -2.637 -12.922
  345    HB   THR  47           HB       THR  47  -6.503   0.178 -13.956
  346    HG1  THR  47           HG1      THR  47  -8.732  -0.461 -13.573
  347   HG21  THR  47          HG21      THR  47  -5.063  -1.475 -15.068
  348   HG22  THR  47          HG22      THR  47  -6.315  -0.875 -16.155
  349   HG23  THR  47          HG23      THR  47  -6.478  -2.468 -15.414
  350    H    LYS  48           H        LYS  48  -5.108   0.293 -11.923
  351    HA   LYS  48           HA       LYS  48  -2.577  -0.850 -12.563
  352    HB2  LYS  48           HB2      LYS  48  -1.649   1.118 -11.342
  353    HB3  LYS  48           HB3      LYS  48  -2.740   1.509 -12.662
  354    HG2  LYS  48           HG2      LYS  48  -4.553   1.749 -10.936
  355    HG3  LYS  48           HG3      LYS  48  -3.282   1.645  -9.716
  356    HD2  LYS  48           HD2      LYS  48  -3.415   3.671 -11.947
  357    HD3  LYS  48           HD3      LYS  48  -3.844   3.960 -10.267
  358    HE2  LYS  48           HE2      LYS  48  -1.576   3.552  -9.564
  359    HE3  LYS  48           HE3      LYS  48  -1.119   3.087 -11.203
  360    HZ1  LYS  48           HZ1      LYS  48  -0.431   5.346 -10.713
  361    HZ2  LYS  48           HZ2      LYS  48  -2.031   5.786 -10.350
  362    HZ3  LYS  48           HZ3      LYS  48  -1.608   5.344 -11.933
  363    H    LEU  49           H        LEU  49  -4.615  -0.803  -9.778
  364    HA   LEU  49           HA       LEU  49  -2.783  -1.645  -7.817
  365    HG   LEU  49           HG       LEU  49  -5.827  -0.459  -6.152
  366    HB2  LEU  49           HB2      LEU  49  -5.720  -1.632  -8.154
  367    HB3  LEU  49           HB3      LEU  49  -5.090  -2.790  -7.002
  368   HD11  LEU  49          HD11      LEU  49  -4.082  -0.491  -4.439
  369   HD12  LEU  49          HD12      LEU  49  -3.127  -1.590  -5.433
  370   HD13  LEU  49          HD13      LEU  49  -4.680  -2.113  -4.783
  371   HD21  LEU  49          HD21      LEU  49  -4.087   1.245  -6.187
  372   HD22  LEU  49          HD22      LEU  49  -4.598   0.851  -7.828
  373   HD23  LEU  49          HD23      LEU  49  -3.078   0.214  -7.200
  374    H    LYS  50           H        LYS  50  -4.629  -3.415 -10.245
  375    HA   LYS  50           HA       LYS  50  -4.232  -6.034  -9.424
  376    HB2  LYS  50           HB2      LYS  50  -4.742  -4.679 -11.982
  377    HB3  LYS  50           HB3      LYS  50  -3.933  -6.225 -12.146
  378    HG2  LYS  50           HG2      LYS  50  -6.330  -6.478 -12.350
  379    HG3  LYS  50           HG3      LYS  50  -5.741  -7.308 -10.911
  380    HD2  LYS  50           HD2      LYS  50  -6.538  -5.547  -9.495
  381    HD3  LYS  50           HD3      LYS  50  -6.944  -4.546 -10.890
  382    HE2  LYS  50           HE2      LYS  50  -8.196  -7.224 -10.307
  383    HE3  LYS  50           HE3      LYS  50  -8.894  -5.683  -9.815
  384    HZ1  LYS  50           HZ1      LYS  50  -9.043  -5.036 -12.134
  385    HZ2  LYS  50           HZ2      LYS  50  -9.857  -6.501 -11.883
  386    HZ3  LYS  50           HZ3      LYS  50  -8.331  -6.498 -12.624
  387    H    GLU  51           H        GLU  51  -2.121  -4.031 -11.442
  388    HA   GLU  51           HA       GLU  51  -0.072  -5.898 -11.850
  389    HB2  GLU  51           HB2      GLU  51   0.263  -2.903 -11.632
  390    HB3  GLU  51           HB3      GLU  51   1.293  -4.023 -12.510
  391    HG2  GLU  51           HG2      GLU  51  -0.446  -4.447 -14.111
  392    HG3  GLU  51           HG3      GLU  51  -1.582  -3.461 -13.189
  393    H    LEU  52           H        LEU  52  -0.480  -3.387  -9.405
  394    HA   LEU  52           HA       LEU  52   2.004  -3.699  -8.133
  395    HG   LEU  52           HG       LEU  52   0.217  -1.310  -8.945
  396    HB2  LEU  52           HB2      LEU  52  -0.607  -2.656  -7.045
  397    HB3  LEU  52           HB3      LEU  52   0.947  -2.475  -6.259
  398   HD11  LEU  52          HD11      LEU  52   0.236   0.835  -7.783
  399   HD12  LEU  52          HD12      LEU  52   0.525   0.008  -6.253
  400   HD13  LEU  52          HD13      LEU  52  -0.991  -0.243  -7.117
  401   HD21  LEU  52          HD21      LEU  52   2.321  -0.079  -8.726
  402   HD22  LEU  52          HD22      LEU  52   2.592  -1.820  -8.772
  403   HD23  LEU  52          HD23      LEU  52   2.679  -0.956  -7.237
  404    H    ALA  53           H        ALA  53  -1.206  -4.983  -7.290
  405    HA   ALA  53           HA       ALA  53  -0.465  -6.276  -4.924
  406    HB1  ALA  53           HB1      ALA  53  -2.791  -5.867  -5.584
  407    HB2  ALA  53           HB2      ALA  53  -2.519  -7.560  -5.173
  408    HB3  ALA  53           HB3      ALA  53  -2.635  -7.071  -6.863
  409    H    ALA  54           H        ALA  54  -0.317  -7.350  -8.272
  410    HA   ALA  54           HA       ALA  54   0.241 -10.074  -7.711
  411    HB1  ALA  54           HB1      ALA  54   0.903 -10.210 -10.074
  412    HB2  ALA  54           HB2      ALA  54   0.812  -8.451 -10.188
  413    HB3  ALA  54           HB3      ALA  54  -0.644  -9.392  -9.859
  414    H    ALA  55           H        ALA  55   2.258  -7.231  -8.115
  415    HA   ALA  55           HA       ALA  55   4.692  -8.794  -8.200
  416    HB1  ALA  55           HB1      ALA  55   4.315  -5.806  -8.094
  417    HB2  ALA  55           HB2      ALA  55   4.478  -6.776  -9.559
  418    HB3  ALA  55           HB3      ALA  55   5.825  -6.656  -8.425
  419    H    ALA  56           H        ALA  56   2.837  -7.021  -5.858
  420    HA   ALA  56           HA       ALA  56   4.988  -6.677  -3.991
  421    HB1  ALA  56           HB1      ALA  56   2.022  -6.373  -3.553
  422    HB2  ALA  56           HB2      ALA  56   3.103  -5.106  -4.134
  423    HB3  ALA  56           HB3      ALA  56   3.307  -5.764  -2.509
  424    H    SER  57           H        SER  57   2.103  -8.761  -4.071
  425    HA   SER  57           HA       SER  57   2.768  -9.947  -1.552
  426    HG   SER  57           HG       SER  57   0.899 -11.376  -0.825
  427    HB2  SER  57           HB2      SER  57   0.428  -9.611  -2.197
  428    HB3  SER  57           HB3      SER  57   0.643 -10.687  -3.577
  429    H    SER  58           H        SER  58   3.603 -11.903  -1.139
  430    HA   SER  58           HA       SER  58   5.093 -13.252  -3.170
  431    HG   SER  58           HG       SER  58   4.038 -13.058   0.230
  432    HB2  SER  58           HB2      SER  58   5.532 -14.924  -1.324
  433    HB3  SER  58           HB3      SER  58   5.988 -13.264  -0.947
  434    H    ALA  59           H        ALA  59   1.862 -13.377  -2.175
  435    HA   ALA  59           HA       ALA  59   1.312 -16.080  -2.950
  436    HB1  ALA  59           HB1      ALA  59  -0.582 -13.736  -2.740
  437    HB2  ALA  59           HB2      ALA  59  -0.164 -14.830  -1.422
  438    HB3  ALA  59           HB3      ALA  59  -1.032 -15.441  -2.830
  439    H    ASP  60           H        ASP  60   2.006 -13.211  -4.573
  440    HA   ASP  60           HA       ASP  60   2.410 -12.770  -6.748
  441    HB2  ASP  60           HB2      ASP  60   3.154 -15.081  -6.974
  442    HB3  ASP  60           HB3      ASP  60   1.498 -15.601  -7.261
  443    H    GLU  61           H        GLU  61  -0.675 -14.337  -6.094
  444    HA   GLU  61           HA       GLU  61  -1.937 -13.033  -8.349
  445    HB2  GLU  61           HB2      GLU  61  -3.014 -14.802  -6.159
  446    HB3  GLU  61           HB3      GLU  61  -4.007 -14.129  -7.445
  447    HG2  GLU  61           HG2      GLU  61  -2.773 -15.325  -9.108
  448    HG3  GLU  61           HG3      GLU  61  -1.611 -15.885  -7.905
  449    H    GLY  62           H        GLY  62  -0.940 -11.838  -5.536
  450    HA2  GLY  62           HA2      GLY  62  -1.410  -9.639  -4.828
  451    HA3  GLY  62           HA3      GLY  62  -2.985  -9.754  -5.595
  452    H    ALA  63           H        ALA  63  -2.340 -12.496  -3.801
  453    HA   ALA  63           HA       ALA  63  -3.083 -13.351  -1.837
  454    HB1  ALA  63           HB1      ALA  63  -1.662 -11.613  -0.847
  455    HB2  ALA  63           HB2      ALA  63  -3.090 -11.948   0.133
  456    HB3  ALA  63           HB3      ALA  63  -3.028 -10.499  -0.871
  457    H    SER  64           H        SER  64  -4.930 -12.353   0.037
  458    HA   SER  64           HA       SER  64  -7.378 -12.812  -1.300
  459    HG   SER  64           HG       SER  64  -6.912 -13.697   2.187
  460    HB2  SER  64           HB2      SER  64  -6.933 -11.612   1.446
  461    HB3  SER  64           HB3      SER  64  -8.414 -12.373   0.862
  462    H    VAL  65           H        VAL  65  -8.214 -11.412  -2.704
  463    HA   VAL  65           HA       VAL  65  -8.065  -8.549  -2.058
  464    HB   VAL  65           HB       VAL  65  -6.705  -8.958  -3.992
  465   HG11  VAL  65          HG11      VAL  65  -7.620  -9.941  -6.065
  466   HG12  VAL  65          HG12      VAL  65  -9.100 -10.342  -5.193
  467   HG13  VAL  65          HG13      VAL  65  -7.572 -11.086  -4.724
  468   HG21  VAL  65          HG21      VAL  65  -7.827  -7.562  -5.678
  469   HG22  VAL  65          HG22      VAL  65  -7.999  -6.914  -4.047
  470   HG23  VAL  65          HG23      VAL  65  -9.349  -7.758  -4.806
  471    H    ALA  66           H        ALA  66  -9.910  -7.608  -1.666
  472    HA   ALA  66           HA       ALA  66 -12.287  -8.372  -3.198
  473    HB1  ALA  66           HB1      ALA  66 -12.268  -7.976  -0.202
  474    HB2  ALA  66           HB2      ALA  66 -12.480  -9.514  -1.035
  475    HB3  ALA  66           HB3      ALA  66 -13.696  -8.248  -1.201
  476    H    TYR  67           H        TYR  67 -13.625  -6.602  -3.681
  477    HA   TYR  67           HA       TYR  67 -13.121  -4.072  -2.377
  478    HD1  TYR  67           HD1      TYR  67 -11.942  -6.143  -5.894
  479    HD2  TYR  67           HD2      TYR  67 -13.647  -2.243  -6.088
  480    HE1  TYR  67           HE1      TYR  67 -12.575  -6.536  -8.239
  481    HE2  TYR  67           HE2      TYR  67 -14.282  -2.631  -8.429
  482    HH   TYR  67           HH       TYR  67 -13.667  -4.013 -10.303
  483    HB2  TYR  67           HB2      TYR  67 -12.339  -2.840  -4.228
  484    HB3  TYR  67           HB3      TYR  67 -11.368  -4.306  -4.224
  485    H    LYS  68           H        LYS  68 -14.687  -2.498  -2.805
  486    HA   LYS  68           HA       LYS  68 -16.938  -3.332  -4.502
  487    HB2  LYS  68           HB2      LYS  68 -17.105  -2.150  -1.729
  488    HB3  LYS  68           HB3      LYS  68 -18.468  -2.230  -2.835
  489    HG2  LYS  68           HG2      LYS  68 -18.316  -4.661  -2.854
  490    HG3  LYS  68           HG3      LYS  68 -16.939  -4.575  -1.759
  491    HD2  LYS  68           HD2      LYS  68 -19.743  -3.626  -1.177
  492    HD3  LYS  68           HD3      LYS  68 -18.973  -5.071  -0.521
  493    HE2  LYS  68           HE2      LYS  68 -17.371  -3.745   0.676
  494    HE3  LYS  68           HE3      LYS  68 -17.947  -2.270  -0.100
  495    HZ1  LYS  68           HZ1      LYS  68 -18.816  -2.473   2.134
  496    HZ2  LYS  68           HZ2      LYS  68 -19.511  -3.977   1.762
  497    HZ3  LYS  68           HZ3      LYS  68 -20.077  -2.568   1.004
  498    H    ILE  69           H        ILE  69 -18.271  -1.596  -5.195
  499    HA   ILE  69           HA       ILE  69 -17.044   1.072  -5.083
  500    HB   ILE  69           HB       ILE  69 -18.241  -0.163  -7.578
  501   HG12  ILE  69          HG12      ILE  69 -15.358   0.542  -6.968
  502   HG13  ILE  69          HG13      ILE  69 -16.011  -1.093  -7.020
  503   HG21  ILE  69          HG21      ILE  69 -16.897   2.506  -7.157
  504   HG22  ILE  69          HG22      ILE  69 -18.628   2.247  -7.372
  505   HG23  ILE  69          HG23      ILE  69 -17.512   1.881  -8.689
  506   HD11  ILE  69          HD11      ILE  69 -16.514  -0.821  -9.384
  507   HD12  ILE  69          HD12      ILE  69 -14.806  -0.533  -9.059
  508   HD13  ILE  69          HD13      ILE  69 -15.892   0.828  -9.333
  509    H    LYS  70           H        LYS  70 -18.514   2.121  -3.853
  510    HA   LYS  70           HA       LYS  70 -21.355   1.621  -4.365
  511    HB2  LYS  70           HB2      LYS  70 -20.675   1.448  -2.030
  512    HB3  LYS  70           HB3      LYS  70 -20.009   3.074  -2.084
  513    HG2  LYS  70           HG2      LYS  70 -22.165   4.043  -2.292
  514    HG3  LYS  70           HG3      LYS  70 -22.912   2.468  -2.566
  515    HD2  LYS  70           HD2      LYS  70 -22.419   1.790  -0.308
  516    HD3  LYS  70           HD3      LYS  70 -21.505   3.272  -0.022
  517    HE2  LYS  70           HE2      LYS  70 -23.732   3.382   0.974
  518    HE3  LYS  70           HE3      LYS  70 -23.528   4.593  -0.289
  519    HZ1  LYS  70           HZ1      LYS  70 -24.945   1.997  -0.602
  520    HZ2  LYS  70           HZ2      LYS  70 -24.760   3.174  -1.809
  521    HZ3  LYS  70           HZ3      LYS  70 -25.679   3.512  -0.426
  522    H    ASP  71           H        ASP  71 -22.515   2.996  -5.478
  523    HA   ASP  71           HA       ASP  71 -21.294   5.323  -6.606
  524    HB2  ASP  71           HB2      ASP  71 -23.346   5.516  -7.889
  525    HB3  ASP  71           HB3      ASP  71 -22.821   3.841  -7.884
  526    H    LEU  72           H        LEU  72 -21.497   7.374  -5.973
  527    HA   LEU  72           HA       LEU  72 -23.633   8.083  -4.074
  528    HG   LEU  72           HG       LEU  72 -20.895   6.922  -3.065
  529    HB2  LEU  72           HB2      LEU  72 -20.809   9.160  -4.115
  530    HB3  LEU  72           HB3      LEU  72 -22.086   9.695  -3.040
  531   HD11  LEU  72          HD11      LEU  72 -20.494   9.214  -1.146
  532   HD12  LEU  72          HD12      LEU  72 -19.295   8.575  -2.271
  533   HD13  LEU  72          HD13      LEU  72 -19.875   7.576  -0.940
  534   HD21  LEU  72          HD21      LEU  72 -23.224   6.952  -2.341
  535   HD22  LEU  72          HD22      LEU  72 -22.853   8.224  -1.174
  536   HD23  LEU  72          HD23      LEU  72 -22.142   6.620  -0.987
  537    H    GLU  73           H        GLU  73 -23.382  10.766  -4.012
  538    HA   GLU  73           HA       GLU  73 -24.257  11.455  -6.686
  539    HB2  GLU  73           HB2      GLU  73 -25.265  12.178  -4.356
  540    HB3  GLU  73           HB3      GLU  73 -24.060  13.452  -4.468
  541    HG2  GLU  73           HG2      GLU  73 -26.214  12.891  -6.496
  542    HG3  GLU  73           HG3      GLU  73 -26.249  14.169  -5.284
  543    H    GLY  74           H        GLY  74 -22.675  11.784  -8.088
  544    HA2  GLY  74           HA2      GLY  74 -21.176  13.198  -9.165
  545    HA3  GLY  74           HA3      GLY  74 -20.969  14.089  -7.667
  546    H    GLN  75           H        GLN  75 -20.599  10.958  -6.831
  547    HA   GLN  75           HA       GLN  75 -17.965  10.447  -7.789
  548    HB2  GLN  75           HB2      GLN  75 -16.851  10.561  -5.557
  549    HB3  GLN  75           HB3      GLN  75 -17.295  12.131  -6.208
  550    HG2  GLN  75           HG2      GLN  75 -19.229  12.213  -4.741
  551    HG3  GLN  75           HG3      GLN  75 -18.841  10.607  -4.121
  552   HE21  GLN  75          HE21      GLN  75 -18.685  11.426  -2.027
  553   HE22  GLN  75          HE22      GLN  75 -17.310  12.332  -1.506
  554    H    VAL  76           H        VAL  76 -17.023   8.516  -6.587
  555    HA   VAL  76           HA       VAL  76 -19.158   6.838  -5.446
  556    HB   VAL  76           HB       VAL  76 -18.208   4.874  -6.571
  557   HG11  VAL  76          HG11      VAL  76 -19.024   7.065  -8.471
  558   HG12  VAL  76          HG12      VAL  76 -20.109   5.992  -7.587
  559   HG13  VAL  76          HG13      VAL  76 -19.039   5.337  -8.827
  560   HG21  VAL  76          HG21      VAL  76 -15.934   5.613  -6.887
  561   HG22  VAL  76          HG22      VAL  76 -16.465   6.870  -8.005
  562   HG23  VAL  76          HG23      VAL  76 -16.634   5.169  -8.442
  563    H    GLU  77           H        GLU  77 -18.359   5.066  -4.136
  564    HA   GLU  77           HA       GLU  77 -15.829   5.758  -2.816
  565    HB2  GLU  77           HB2      GLU  77 -17.687   5.668  -1.295
  566    HB3  GLU  77           HB3      GLU  77 -18.192   4.103  -1.913
  567    HG2  GLU  77           HG2      GLU  77 -16.118   3.112  -1.035
  568    HG3  GLU  77           HG3      GLU  77 -15.672   4.683  -0.374
  569    H    LEU  78           H        LEU  78 -14.142   4.691  -3.551
  570    HA   LEU  78           HA       LEU  78 -14.437   1.916  -4.423
  571    HG   LEU  78           HG       LEU  78 -11.403   2.209  -6.519
  572    HB2  LEU  78           HB2      LEU  78 -13.139   3.581  -5.800
  573    HB3  LEU  78           HB3      LEU  78 -11.982   3.686  -4.493
  574   HD11  LEU  78          HD11      LEU  78 -10.242   0.573  -5.127
  575   HD12  LEU  78          HD12      LEU  78 -11.229   1.042  -3.744
  576   HD13  LEU  78          HD13      LEU  78 -10.106   2.199  -4.459
  577   HD21  LEU  78          HD21      LEU  78 -12.219  -0.101  -6.392
  578   HD22  LEU  78          HD22      LEU  78 -13.520   1.044  -6.714
  579   HD23  LEU  78          HD23      LEU  78 -13.322   0.366  -5.098
  580    H    ASP  79           H        ASP  79 -14.299   0.445  -2.901
  581    HA   ASP  79           HA       ASP  79 -12.580   0.994  -0.561
  582    HB2  ASP  79           HB2      ASP  79 -15.031   1.039  -0.059
  583    HB3  ASP  79           HB3      ASP  79 -15.134  -0.634  -0.591
  584    H    ALA  80           H        ALA  80 -10.808  -0.177  -0.825
  585    HA   ALA  80           HA       ALA  80 -11.067  -2.899  -1.916
  586    HB1  ALA  80           HB1      ALA  80  -8.709  -2.718  -2.528
  587    HB2  ALA  80           HB2      ALA  80  -8.648  -1.103  -1.825
  588    HB3  ALA  80           HB3      ALA  80  -9.659  -1.413  -3.236
  589    H    ALA  81           H        ALA  81 -10.463  -4.607  -0.773
  590    HA   ALA  81           HA       ALA  81  -9.067  -4.211   1.781
  591    HB1  ALA  81           HB1      ALA  81 -11.287  -6.182   1.233
  592    HB2  ALA  81           HB2      ALA  81 -11.444  -4.693   2.167
  593    HB3  ALA  81           HB3      ALA  81 -10.410  -5.997   2.752
  594    H    PHE  82           H        PHE  82  -7.093  -5.012   1.475
  595    HA   PHE  82           HA       PHE  82  -6.815  -7.585   0.059
  596    HD1  PHE  82           HD2      PHE  82  -6.041  -3.711  -0.480
  597    HD2  PHE  82           HD1      PHE  82  -4.935  -7.315  -2.452
  598    HE1  PHE  82           HE2      PHE  82  -6.528  -2.666  -2.653
  599    HE2  PHE  82           HE1      PHE  82  -5.418  -6.276  -4.629
  600    HZ   PHE  82           HZ       PHE  82  -6.218  -3.948  -4.733
  601    HB2  PHE  82           HB2      PHE  82  -4.740  -5.460   0.651
  602    HB3  PHE  82           HB3      PHE  82  -4.412  -6.990  -0.151
  603    H    THR  83           H        THR  83  -5.545  -9.245   1.046
  604    HA   THR  83           HA       THR  83  -4.616  -8.692   3.773
  605    HB   THR  83           HB       THR  83  -6.189 -11.175   3.041
  606    HG1  THR  83           HG1      THR  83  -6.999  -8.710   3.798
  607   HG21  THR  83          HG21      THR  83  -5.123 -10.194   5.696
  608   HG22  THR  83          HG22      THR  83  -4.481 -11.546   4.764
  609   HG23  THR  83          HG23      THR  83  -6.104 -11.639   5.448
  610    H    PHE  84           H        PHE  84  -2.497  -8.922   3.551
  611    HA   PHE  84           HA       PHE  84  -1.455 -10.681   1.487
  612    HD1  PHE  84           HD2      PHE  84   0.027  -9.276  -0.388
  613    HD2  PHE  84           HD1      PHE  84  -1.415  -6.710   2.681
  614    HE1  PHE  84           HE2      PHE  84  -0.652  -7.639  -2.089
  615    HE2  PHE  84           HE1      PHE  84  -2.103  -5.063   0.985
  616    HZ   PHE  84           HZ       PHE  84  -1.720  -5.530  -1.403
  617    HB2  PHE  84           HB2      PHE  84  -0.124  -8.607   3.233
  618    HB3  PHE  84           HB3      PHE  84   0.704  -9.540   1.989
  619    H    SER  85           H        SER  85   0.504 -11.950   1.928
  620    HA   SER  85           HA       SER  85  -0.040 -13.797   4.016
  621    HG   SER  85           HG       SER  85   0.333 -15.425   1.873
  622    HB2  SER  85           HB2      SER  85   2.389 -13.553   2.223
  623    HB3  SER  85           HB3      SER  85   1.969 -14.962   3.199
  624    H    CYS  86           H        CYS  86   2.168 -11.112   3.643
  625    HA   CYS  86           HA       CYS  86   2.898 -11.375   6.457
  626    HG   CYS  86           HG       CYS  86   7.043 -11.385   6.075
  627    HB2  CYS  86           HB2      CYS  86   4.677 -12.559   5.249
  628    HB3  CYS  86           HB3      CYS  86   4.942 -11.147   4.233
  629    H    GLN  87           H        GLN  87   3.708  -9.414   7.374
  630    HA   GLN  87           HA       GLN  87   2.540  -7.070   6.301
  631    HB2  GLN  87           HB2      GLN  87   2.815  -7.317   8.684
  632    HB3  GLN  87           HB3      GLN  87   4.559  -7.448   8.511
  633    HG2  GLN  87           HG2      GLN  87   4.784  -5.180   7.958
  634    HG3  GLN  87           HG3      GLN  87   3.057  -4.993   7.665
  635   HE21  GLN  87          HE21      GLN  87   2.306  -6.491  10.037
  636   HE22  GLN  87          HE22      GLN  87   2.629  -5.459  11.386
  637    H    ALA  88           H        ALA  88   5.603  -8.583   5.835
  638    HA   ALA  88           HA       ALA  88   7.203  -6.446   5.031
  639    HB1  ALA  88           HB1      ALA  88   7.163  -9.229   3.866
  640    HB2  ALA  88           HB2      ALA  88   8.028  -8.744   5.324
  641    HB3  ALA  88           HB3      ALA  88   8.488  -8.073   3.759
  642    H    GLU  89           H        GLU  89   4.901  -8.382   3.141
  643    HA   GLU  89           HA       GLU  89   5.298  -6.747   0.796
  644    HB2  GLU  89           HB2      GLU  89   3.346  -8.154  -0.083
  645    HB3  GLU  89           HB3      GLU  89   4.851  -8.987   0.267
  646    HG2  GLU  89           HG2      GLU  89   3.889  -9.660   2.456
  647    HG3  GLU  89           HG3      GLU  89   2.358  -8.949   1.945
  648    H    MET  90           H        MET  90   3.153  -6.873   3.496
  649    HA   MET  90           HA       MET  90   1.016  -5.338   2.517
  650    HB2  MET  90           HB2      MET  90   0.730  -6.516   4.559
  651    HB3  MET  90           HB3      MET  90   2.136  -5.752   5.285
  652    HG2  MET  90           HG2      MET  90   0.135  -4.843   6.238
  653    HG3  MET  90           HG3      MET  90   0.948  -3.606   5.284
  654    HE1  MET  90           HE1      MET  90  -2.049  -3.397   6.311
  655    HE2  MET  90           HE2      MET  90  -2.832  -2.726   4.882
  656    HE3  MET  90           HE3      MET  90  -1.242  -2.143   5.371
  657    H    ILE  91           H        ILE  91   3.845  -4.280   4.441
  658    HA   ILE  91           HA       ILE  91   3.175  -1.571   4.489
  659    HB   ILE  91           HB       ILE  91   5.603  -1.186   4.999
  660   HG12  ILE  91          HG12      ILE  91   5.776  -4.202   4.893
  661   HG13  ILE  91          HG13      ILE  91   6.454  -3.127   3.680
  662   HG21  ILE  91          HG21      ILE  91   4.208  -3.302   6.619
  663   HG22  ILE  91          HG22      ILE  91   3.955  -1.563   6.744
  664   HG23  ILE  91          HG23      ILE  91   5.515  -2.260   7.184
  665   HD11  ILE  91          HD11      ILE  91   7.250  -3.272   6.575
  666   HD12  ILE  91          HD12      ILE  91   7.903  -2.136   5.395
  667   HD13  ILE  91          HD13      ILE  91   8.175  -3.867   5.196
  668    H    ILE  92           H        ILE  92   5.279  -3.355   2.237
  669    HA   ILE  92           HA       ILE  92   6.126  -1.017   0.879
  670    HB   ILE  92           HB       ILE  92   6.964  -2.569  -0.882
  671   HG12  ILE  92          HG12      ILE  92   6.986  -5.057   0.072
  672   HG13  ILE  92          HG13      ILE  92   5.441  -4.546   0.742
  673   HG21  ILE  92          HG21      ILE  92   8.361  -1.910   0.981
  674   HG22  ILE  92          HG22      ILE  92   8.692  -3.581   0.524
  675   HG23  ILE  92          HG23      ILE  92   7.720  -3.236   1.953
  676   HD11  ILE  92          HD11      ILE  92   5.131  -5.659  -1.377
  677   HD12  ILE  92          HD12      ILE  92   6.219  -4.516  -2.162
  678   HD13  ILE  92          HD13      ILE  92   4.678  -3.960  -1.510
  679    H    PHE  93           H        PHE  93   3.388  -3.130   0.540
  680    HA   PHE  93           HA       PHE  93   2.672  -2.421  -2.099
  681    HD1  PHE  93           HD1      PHE  93   1.027  -4.174  -3.423
  682    HD2  PHE  93           HD2      PHE  93  -1.181  -2.525  -0.181
  683    HE1  PHE  93           HE1      PHE  93  -0.976  -4.062  -4.847
  684    HE2  PHE  93           HE2      PHE  93  -3.187  -2.414  -1.597
  685    HZ   PHE  93           HZ       PHE  93  -3.084  -3.185  -3.933
  686    HB2  PHE  93           HB2      PHE  93   1.747  -4.396  -1.014
  687    HB3  PHE  93           HB3      PHE  93   0.955  -3.392   0.196
  688    H    GLU  94           H        GLU  94   1.499  -1.215   1.056
  689    HA   GLU  94           HA       GLU  94  -0.171   0.734  -0.194
  690    HB2  GLU  94           HB2      GLU  94  -0.440   1.645   2.124
  691    HB3  GLU  94           HB3      GLU  94  -0.893  -0.037   1.921
  692    HG2  GLU  94           HG2      GLU  94   0.914  -0.808   3.140
  693    HG3  GLU  94           HG3      GLU  94   1.834   0.680   2.916
  694    H    LEU  95           H        LEU  95   3.099   0.737   1.042
  695    HA   LEU  95           HA       LEU  95   3.521   3.531   0.916
  696    HG   LEU  95           HG       LEU  95   4.520   1.698   2.951
  697    HB2  LEU  95           HB2      LEU  95   5.385   1.180   0.657
  698    HB3  LEU  95           HB3      LEU  95   5.953   2.834   0.549
  699   HD11  LEU  95          HD11      LEU  95   6.702   1.644   4.023
  700   HD12  LEU  95          HD12      LEU  95   7.465   2.186   2.529
  701   HD13  LEU  95          HD13      LEU  95   6.689   0.603   2.598
  702   HD21  LEU  95          HD21      LEU  95   5.322   3.715   4.063
  703   HD22  LEU  95          HD22      LEU  95   4.301   4.121   2.682
  704   HD23  LEU  95          HD23      LEU  95   6.054   4.264   2.556
  705    H    SER  96           H        SER  96   4.005   0.931  -1.446
  706    HA   SER  96           HA       SER  96   4.957   2.589  -3.519
  707    HG   SER  96           HG       SER  96   4.229   1.313  -5.715
  708    HB2  SER  96           HB2      SER  96   5.227   0.088  -3.367
  709    HB3  SER  96           HB3      SER  96   3.539  -0.058  -3.849
  710    H    LEU  97           H        LEU  97   1.730   1.900  -2.388
  711    HA   LEU  97           HA       LEU  97   0.281   2.680  -4.671
  712    HG   LEU  97           HG       LEU  97  -0.239   0.675  -2.300
  713    HB2  LEU  97           HB2      LEU  97  -0.408   3.043  -1.750
  714    HB3  LEU  97           HB3      LEU  97  -1.532   3.291  -3.071
  715   HD11  LEU  97          HD11      LEU  97  -2.517   0.009  -1.715
  716   HD12  LEU  97          HD12      LEU  97  -3.091   1.634  -2.096
  717   HD13  LEU  97          HD13      LEU  97  -1.976   1.384  -0.752
  718   HD21  LEU  97          HD21      LEU  97  -1.691  -0.312  -4.003
  719   HD22  LEU  97          HD22      LEU  97  -0.540   0.824  -4.710
  720   HD23  LEU  97          HD23      LEU  97  -2.224   1.298  -4.482
  721    H    ARG  98           H        ARG  98   1.390   4.552  -1.892
  722    HA   ARG  98           HA       ARG  98   0.556   7.067  -2.929
  723    HE   ARG  98           HE       ARG  98  -1.199   7.748   1.609
  724    HB2  ARG  98           HB2      ARG  98   2.404   6.282  -0.681
  725    HB3  ARG  98           HB3      ARG  98   2.026   7.956  -1.067
  726    HG2  ARG  98           HG2      ARG  98  -0.264   7.652  -0.537
  727    HG3  ARG  98           HG3      ARG  98  -0.071   5.901  -0.430
  728    HD2  ARG  98           HD2      ARG  98   1.192   6.066   1.557
  729    HD3  ARG  98           HD3      ARG  98   1.406   7.806   1.371
  730   HH11  ARG  98          HH11      ARG  98   1.087   5.750   3.366
  731   HH12  ARG  98          HH12      ARG  98   0.110   5.677   4.793
  732   HH21  ARG  98          HH21      ARG  98  -2.490   7.640   3.481
  733   HH22  ARG  98          HH22      ARG  98  -1.927   6.753   4.869
  734    H    SER  99           H        SER  99   3.417   5.130  -3.201
  735    HA   SER  99           HA       SER  99   4.985   7.385  -4.192
  736    HG   SER  99           HG       SER  99   5.290   5.350  -1.667
  737    HB2  SER  99           HB2      SER  99   5.883   4.563  -3.607
  738    HB3  SER  99           HB3      SER  99   6.912   5.969  -3.882
  739    H    LEU 100           H        LEU 100   2.882   5.410  -5.633
  740    HA   LEU 100           HA       LEU 100   4.521   4.687  -7.920
  741    HG   LEU 100           HG       LEU 100   2.350   4.205  -9.974
  742    HB2  LEU 100           HB2      LEU 100   2.622   3.259  -7.114
  743    HB3  LEU 100           HB3      LEU 100   1.521   4.507  -7.663
  744   HD11  LEU 100          HD11      LEU 100   4.592   3.396  -9.447
  745   HD12  LEU 100          HD12      LEU 100   3.744   2.276 -10.514
  746   HD13  LEU 100          HD13      LEU 100   3.909   1.908  -8.797
  747   HD21  LEU 100          HD21      LEU 100   0.366   3.011  -9.224
  748   HD22  LEU 100          HD22      LEU 100   1.372   1.683  -8.647
  749   HD23  LEU 100          HD23      LEU 100   1.290   2.039 -10.372
  750    H    ALA 101           H        ALA 101   2.315   7.172  -6.937
  751    HA   ALA 101           HA       ALA 101   2.317   8.411  -9.567
  752    HB1  ALA 101           HB1      ALA 101   0.971  10.170  -8.507
  753    HB2  ALA 101           HB2      ALA 101   1.198   9.395  -6.939
  754    HB3  ALA 101           HB3      ALA 101   0.293   8.569  -8.208
  755    H    LEU 102           H        LEU 102   4.121   8.375  -6.695
  756    HA   LEU 102           HA       LEU 102   5.724  10.666  -7.596
  757    HG   LEU 102           HG       LEU 102   3.152  11.113  -5.803
  758    HB2  LEU 102           HB2      LEU 102   5.069   9.974  -4.731
  759    HB3  LEU 102           HB3      LEU 102   6.118  11.275  -5.254
  760   HD11  LEU 102          HD11      LEU 102   3.643  11.468  -3.441
  761   HD12  LEU 102          HD12      LEU 102   2.970  12.922  -4.178
  762   HD13  LEU 102          HD13      LEU 102   4.703  12.815  -3.857
  763   HD21  LEU 102          HD21      LEU 102   5.155  13.309  -6.315
  764   HD22  LEU 102          HD22      LEU 102   3.413  13.430  -6.552
  765   HD23  LEU 102          HD23      LEU 102   4.361  12.319  -7.540
  766    H    GLU 103           H        GLU 103   7.170   9.204  -8.573
  767    HA   GLU 103           HA       GLU 103   8.231   6.995  -7.082
  768    HB2  GLU 103           HB2      GLU 103   8.836   8.093  -9.812
  769    HB3  GLU 103           HB3      GLU 103   9.769   6.779  -9.107
  770    HG2  GLU 103           HG2      GLU 103   7.614   5.537  -8.809
  771    HG3  GLU 103           HG3      GLU 103   6.839   6.802  -9.763
  772    H    HIS 104           H        HIS 104   8.832  10.110  -6.601
  773    HA   HIS 104           HA       HIS 104  11.683   9.995  -6.289
  774    HD1  HIS 104           HD1      HIS 104  12.845  11.696  -7.166
  775    HD2  HIS 104           HD2      HIS 104   9.358  13.951  -6.913
  776    HE1  HIS 104           HE1      HIS 104  13.017  13.423  -8.989
  777    HE2  HIS 104           HE2      HIS 104  10.999  14.900  -8.672
  778    HB2  HIS 104           HB2      HIS 104   9.567  11.853  -5.225
  779    HB3  HIS 104           HB3      HIS 104  11.220  11.934  -4.629
  780    H    HIS 105           H        HIS 105   9.050   8.609  -4.712
  781    HA   HIS 105           HA       HIS 105  10.721   7.951  -2.379
  782    HD1  HIS 105           HD1      HIS 105   6.480   9.696  -2.058
  783    HD2  HIS 105           HD2      HIS 105  10.283   9.579  -0.366
  784    HE1  HIS 105           HE1      HIS 105   6.706  11.829  -0.741
  785    HE2  HIS 105           HE2      HIS 105   8.948  11.664   0.398
  786    HB2  HIS 105           HB2      HIS 105   7.728   7.695  -2.749
  787    HB3  HIS 105           HB3      HIS 105   8.607   7.094  -1.351
  788    H    HIS 106           H        HIS 106  11.871   6.584  -4.029
  789    HA   HIS 106           HA       HIS 106  10.878   3.877  -3.720
  790    HD1  HIS 106           HD1      HIS 106  11.346   2.963  -8.253
  791    HD2  HIS 106           HD2      HIS 106  10.223   1.790  -4.422
  792    HE1  HIS 106           HE1      HIS 106  10.982   0.475  -8.383
  793    HE2  HIS 106           HE2      HIS 106  10.076  -0.159  -6.117
  794    HB2  HIS 106           HB2      HIS 106  10.007   4.785  -5.958
  795    HB3  HIS 106           HB3      HIS 106  11.685   4.781  -6.488
  796    H    HIS 107           H        HIS 107  13.365   6.125  -4.731
  797    HA   HIS 107           HA       HIS 107  15.441   4.145  -4.188
  798    HD1  HIS 107           HD1      HIS 107  17.885   4.187  -6.036
  799    HD2  HIS 107           HD2      HIS 107  14.554   6.002  -7.739
  800    HE1  HIS 107           HE1      HIS 107  17.791   3.340  -8.404
  801    HE2  HIS 107           HE2      HIS 107  15.652   4.288  -9.344
  802    HB2  HIS 107           HB2      HIS 107  15.482   6.949  -5.278
  803    HB3  HIS 107           HB3      HIS 107  16.957   6.190  -4.687
  804    H    HIS 108           H        HIS 108  16.921   4.352  -2.537
  805    HA   HIS 108           HA       HIS 108  17.013   6.297  -0.546
  806    HD1  HIS 108           HD1      HIS 108  16.139   3.542   2.551
  807    HD2  HIS 108           HD2      HIS 108  15.285   7.551   1.814
  808    HE1  HIS 108           HE1      HIS 108  16.287   4.696   4.783
  809    HE2  HIS 108           HE2      HIS 108  15.877   7.135   4.299
  810    HB2  HIS 108           HB2      HIS 108  14.637   5.591  -0.146
  811    HB3  HIS 108           HB3      HIS 108  15.218   3.971   0.213
  812    H    HIS 109           H        HIS 109  17.312   3.078  -1.645
  813    HA   HIS 109           HA       HIS 109  19.577   2.601   0.154
  814    HD1  HIS 109           HD1      HIS 109  18.394  -0.929  -2.512
  815    HD2  HIS 109           HD2      HIS 109  15.481   1.450  -0.733
  816    HE1  HIS 109           HE1      HIS 109  16.274  -1.371  -3.793
  817    HE2  HIS 109           HE2      HIS 109  14.488  -0.111  -2.537
  818    HB2  HIS 109           HB2      HIS 109  19.172   0.145  -0.360
  819    HB3  HIS 109           HB3      HIS 109  17.958   0.924   0.643
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1  49.322  21.515 -20.327
    2    H1   MET   1           H1       MET   1  52.142  21.093 -21.129
    3    H2   MET   1           H2       MET   1  51.548  21.080 -19.540
    4    H3   MET   1           H3       MET   1  51.501  22.509 -20.451
    5    HB2  MET   1           HB2      MET   1  50.677  21.406 -23.024
    6    HB3  MET   1           HB3      MET   1  48.948  21.169 -22.825
    7    HG2  MET   1           HG2      MET   1  49.307  23.426 -23.466
    8    HG3  MET   1           HG3      MET   1  48.822  23.419 -21.773
    9    HE1  MET   1           HE1      MET   1  52.344  22.640 -23.434
   10    HE2  MET   1           HE2      MET   1  53.101  24.227 -23.303
   11    HE3  MET   1           HE3      MET   1  51.692  24.005 -24.340
   12    H    ALA   2           H        ALA   2  48.790  19.691 -19.347
   13    HA   ALA   2           HA       ALA   2  48.547  17.287 -20.822
   14    HB1  ALA   2           HB1      ALA   2  49.996  15.837 -19.488
   15    HB2  ALA   2           HB2      ALA   2  50.600  17.242 -18.608
   16    HB3  ALA   2           HB3      ALA   2  50.935  17.069 -20.332
   17    H    MET   3           H        MET   3  46.417  17.820 -20.092
   18    HA   MET   3           HA       MET   3  45.889  16.700 -17.453
   19    HB2  MET   3           HB2      MET   3  44.198  18.525 -17.012
   20    HB3  MET   3           HB3      MET   3  45.883  18.999 -16.885
   21    HG2  MET   3           HG2      MET   3  44.358  19.438 -19.421
   22    HG3  MET   3           HG3      MET   3  44.221  20.565 -18.074
   23    HE1  MET   3           HE1      MET   3  47.866  21.882 -17.686
   24    HE2  MET   3           HE2      MET   3  47.124  20.539 -16.821
   25    HE3  MET   3           HE3      MET   3  46.197  22.006 -17.131
   26    H    LYS   4           H        LYS   4  44.822  14.963 -18.045
   27    HA   LYS   4           HA       LYS   4  42.331  15.349 -19.567
   28    HB2  LYS   4           HB2      LYS   4  44.279  13.040 -19.787
   29    HB3  LYS   4           HB3      LYS   4  42.662  13.034 -20.479
   30    HG2  LYS   4           HG2      LYS   4  43.234  14.887 -21.920
   31    HG3  LYS   4           HG3      LYS   4  44.828  15.003 -21.175
   32    HD2  LYS   4           HD2      LYS   4  44.963  13.852 -23.311
   33    HD3  LYS   4           HD3      LYS   4  45.363  12.754 -21.990
   34    HE2  LYS   4           HE2      LYS   4  43.930  11.682 -23.659
   35    HE3  LYS   4           HE3      LYS   4  43.133  11.792 -22.090
   36    HZ1  LYS   4           HZ1      LYS   4  41.748  13.505 -22.843
   37    HZ2  LYS   4           HZ2      LYS   4  41.768  12.391 -24.120
   38    HZ3  LYS   4           HZ3      LYS   4  42.696  13.808 -24.216
   39    H    ASP   5           H        ASP   5  42.748  15.467 -16.772
   40    HA   ASP   5           HA       ASP   5  42.124  12.878 -15.653
   41    HB2  ASP   5           HB2      ASP   5  42.271  13.993 -13.470
   42    HB3  ASP   5           HB3      ASP   5  43.687  14.321 -14.459
   43    H    VAL   6           H        VAL   6  40.161  12.242 -16.154
   44    HA   VAL   6           HA       VAL   6  37.941  13.630 -14.848
   45    HB   VAL   6           HB       VAL   6  36.469  12.904 -16.790
   46   HG11  VAL   6          HG11      VAL   6  36.897  14.938 -18.076
   47   HG12  VAL   6          HG12      VAL   6  38.469  15.102 -17.297
   48   HG13  VAL   6          HG13      VAL   6  36.992  15.245 -16.343
   49   HG21  VAL   6          HG21      VAL   6  38.035  11.432 -17.915
   50   HG22  VAL   6          HG22      VAL   6  39.126  12.785 -18.208
   51   HG23  VAL   6          HG23      VAL   6  37.547  12.740 -18.993
   52    H    VAL   7           H        VAL   7  39.458  11.495 -13.981
   53    HA   VAL   7           HA       VAL   7  38.226   9.004 -14.812
   54    HB   VAL   7           HB       VAL   7  40.411   9.439 -12.771
   55   HG11  VAL   7          HG11      VAL   7  40.915   7.071 -13.148
   56   HG12  VAL   7          HG12      VAL   7  39.535   6.955 -14.241
   57   HG13  VAL   7          HG13      VAL   7  39.277   7.296 -12.530
   58   HG21  VAL   7          HG21      VAL   7  41.092  10.284 -14.950
   59   HG22  VAL   7          HG22      VAL   7  40.633   8.754 -15.698
   60   HG23  VAL   7          HG23      VAL   7  41.969   8.807 -14.547
   61    H    ASP   8           H        ASP   8  36.154   9.106 -13.963
   62    HA   ASP   8           HA       ASP   8  36.089   8.198 -11.203
   63    HB2  ASP   8           HB2      ASP   8  34.390   9.635 -10.444
   64    HB3  ASP   8           HB3      ASP   8  35.483  10.714 -11.302
   65    H    LYS   9           H        LYS   9  34.371   6.838 -10.756
   66    HA   LYS   9           HA       LYS   9  32.866   5.964 -13.111
   67    HB2  LYS   9           HB2      LYS   9  33.289   3.602 -12.407
   68    HB3  LYS   9           HB3      LYS   9  34.698   4.448 -13.009
   69    HG2  LYS   9           HG2      LYS   9  35.396   4.842 -10.657
   70    HG3  LYS   9           HG3      LYS   9  34.042   3.832 -10.137
   71    HD2  LYS   9           HD2      LYS   9  35.997   2.455 -10.196
   72    HD3  LYS   9           HD3      LYS   9  34.981   1.996 -11.566
   73    HE2  LYS   9           HE2      LYS   9  36.366   3.540 -12.978
   74    HE3  LYS   9           HE3      LYS   9  37.454   3.718 -11.603
   75    HZ1  LYS   9           HZ1      LYS   9  38.298   2.050 -13.068
   76    HZ2  LYS   9           HZ2      LYS   9  36.827   1.210 -13.056
   77    HZ3  LYS   9           HZ3      LYS   9  37.769   1.286 -11.648
   78    H    CYS  10           H        CYS  10  31.031   6.862 -12.398
   79    HA   CYS  10           HA       CYS  10  30.008   6.096  -9.767
   80    HG   CYS  10           HG       CYS  10  30.952   9.339 -12.056
   81    HB2  CYS  10           HB2      CYS  10  28.272   7.950 -10.527
   82    HB3  CYS  10           HB3      CYS  10  29.841   8.387  -9.854
   83    H    SER  11           H        SER  11  28.803   4.338  -9.799
   84    HA   SER  11           HA       SER  11  26.552   4.240 -11.644
   85    HG   SER  11           HG       SER  11  26.993   1.080 -12.992
   86    HB2  SER  11           HB2      SER  11  28.288   2.830 -12.687
   87    HB3  SER  11           HB3      SER  11  28.404   1.883 -11.205
   88    H    THR  12           H        THR  12  25.225   4.749  -9.936
   89    HA   THR  12           HA       THR  12  25.129   2.840  -7.719
   90    HB   THR  12           HB       THR  12  23.661   4.550  -6.606
   91    HG1  THR  12           HG1      THR  12  22.897   5.923  -8.065
   92   HG21  THR  12          HG21      THR  12  26.024   4.419  -6.056
   93   HG22  THR  12          HG22      THR  12  25.488   6.100  -6.055
   94   HG23  THR  12          HG23      THR  12  26.419   5.470  -7.416
   95    H    LYS  13           H        LYS  13  23.432   1.554  -7.458
   96    HA   LYS  13           HA       LYS  13  21.350   1.607  -9.502
   97    HB2  LYS  13           HB2      LYS  13  22.522  -0.511  -9.057
   98    HB3  LYS  13           HB3      LYS  13  21.988  -0.456  -7.384
   99    HG2  LYS  13           HG2      LYS  13  19.679  -0.676  -8.088
  100    HG3  LYS  13           HG3      LYS  13  20.178  -0.662  -9.780
  101    HD2  LYS  13           HD2      LYS  13  21.193  -2.706  -7.820
  102    HD3  LYS  13           HD3      LYS  13  19.696  -2.933  -8.722
  103    HE2  LYS  13           HE2      LYS  13  21.355  -4.059  -9.955
  104    HE3  LYS  13           HE3      LYS  13  21.064  -2.556 -10.822
  105    HZ1  LYS  13           HZ1      LYS  13  23.434  -3.172 -10.579
  106    HZ2  LYS  13           HZ2      LYS  13  23.300  -2.949  -8.907
  107    HZ3  LYS  13           HZ3      LYS  13  23.069  -1.640  -9.961
  108    H    GLY  14           H        GLY  14  21.709   1.538  -5.981
  109    HA2  GLY  14           HA2      GLY  14  20.404   2.925  -4.551
  110    HA3  GLY  14           HA3      GLY  14  19.144   2.957  -5.776
  111    H    CYS  15           H        CYS  15  17.406   1.809  -5.329
  112    HA   CYS  15           HA       CYS  15  16.015   0.176  -4.598
  113    HG   CYS  15           HG       CYS  15  16.126  -2.394  -2.755
  114    HB2  CYS  15           HB2      CYS  15  17.598  -1.391  -5.643
  115    HB3  CYS  15           HB3      CYS  15  18.547  -1.428  -4.162
  116    H    ALA  16           H        ALA  16  17.854   1.971  -2.720
  117    HA   ALA  16           HA       ALA  16  17.525   0.541  -0.212
  118    HB1  ALA  16           HB1      ALA  16  18.789   2.351   0.786
  119    HB2  ALA  16           HB2      ALA  16  18.709   3.267  -0.720
  120    HB3  ALA  16           HB3      ALA  16  19.615   1.754  -0.654
  121    H    ILE  17           H        ILE  17  15.390   0.499   0.271
  122    HA   ILE  17           HA       ILE  17  13.515   1.192   1.344
  123    HB   ILE  17           HB       ILE  17  14.731   3.957   1.468
  124   HG12  ILE  17          HG12      ILE  17  16.263   2.321   2.476
  125   HG13  ILE  17          HG13      ILE  17  15.536   3.348   3.705
  126   HG21  ILE  17          HG21      ILE  17  12.601   2.627   3.136
  127   HG22  ILE  17          HG22      ILE  17  12.349   3.900   1.942
  128   HG23  ILE  17          HG23      ILE  17  13.264   4.238   3.411
  129   HD11  ILE  17          HD11      ILE  17  13.970   1.550   4.267
  130   HD12  ILE  17          HD12      ILE  17  15.652   1.051   4.453
  131   HD13  ILE  17          HD13      ILE  17  14.728   0.524   3.047
  132    H    ASP  18           H        ASP  18  11.521   1.722   0.580
  133    HA   ASP  18           HA       ASP  18  11.286   2.626  -2.109
  134    HB2  ASP  18           HB2      ASP  18   9.685   1.053  -0.929
  135    HB3  ASP  18           HB3      ASP  18   9.036   2.459  -0.092
  136    H    ILE  19           H        ILE  19  10.252   4.083   0.973
  137    HA   ILE  19           HA       ILE  19  10.183   6.705  -0.378
  138    HB   ILE  19           HB       ILE  19   8.942   6.191   2.304
  139   HG12  ILE  19          HG12      ILE  19   7.530   5.786  -0.341
  140   HG13  ILE  19          HG13      ILE  19   8.026   4.489   0.745
  141   HG21  ILE  19          HG21      ILE  19   8.314   8.135   0.089
  142   HG22  ILE  19          HG22      ILE  19   9.206   8.491   1.569
  143   HG23  ILE  19          HG23      ILE  19   7.499   8.051   1.652
  144   HD11  ILE  19          HD11      ILE  19   6.565   5.430   2.484
  145   HD12  ILE  19          HD12      ILE  19   5.685   4.956   1.031
  146   HD13  ILE  19          HD13      ILE  19   6.031   6.659   1.337
  147    H    GLY  20           H        GLY  20  10.433   5.644   2.965
  148    HA2  GLY  20           HA2      GLY  20  12.898   6.133   3.817
  149    HA3  GLY  20           HA3      GLY  20  12.317   7.776   3.551
  150    H    THR  21           H        THR  21   9.584   7.104   4.181
  151    HA   THR  21           HA       THR  21   9.685   7.093   7.072
  152    HB   THR  21           HB       THR  21   7.142   6.979   5.481
  153    HG1  THR  21           HG1      THR  21   7.334   9.060   4.850
  154   HG21  THR  21          HG21      THR  21   7.013   6.997   7.915
  155   HG22  THR  21          HG22      THR  21   6.369   8.499   7.254
  156   HG23  THR  21          HG23      THR  21   7.981   8.469   7.970
  157    H    VAL  22           H        VAL  22   9.296   5.307   8.314
  158    HA   VAL  22           HA       VAL  22   8.200   2.939   6.956
  159    HB   VAL  22           HB       VAL  22   9.508   1.556   8.539
  160   HG11  VAL  22          HG11      VAL  22  11.114   3.425   6.809
  161   HG12  VAL  22          HG12      VAL  22  10.350   1.917   6.304
  162   HG13  VAL  22          HG13      VAL  22  11.691   1.888   7.449
  163   HG21  VAL  22          HG21      VAL  22   9.819   3.164  10.334
  164   HG22  VAL  22          HG22      VAL  22  10.816   4.169   9.282
  165   HG23  VAL  22          HG23      VAL  22  11.380   2.569   9.766
  166    H    ILE  23           H        ILE  23   7.500   1.290   8.724
  167    HA   ILE  23           HA       ILE  23   5.981   0.659  10.249
  168    HB   ILE  23           HB       ILE  23   6.587   3.296  11.586
  169   HG12  ILE  23          HG12      ILE  23   7.670   0.518  12.108
  170   HG13  ILE  23          HG13      ILE  23   8.547   1.808  11.292
  171   HG21  ILE  23          HG21      ILE  23   5.255   0.814  12.686
  172   HG22  ILE  23          HG22      ILE  23   4.446   2.339  12.326
  173   HG23  ILE  23          HG23      ILE  23   5.657   2.266  13.605
  174   HD11  ILE  23          HD11      ILE  23   7.604   1.840  14.150
  175   HD12  ILE  23          HD12      ILE  23   8.466   3.147  13.337
  176   HD13  ILE  23          HD13      ILE  23   9.259   1.593  13.597
  177    H    ASP  24           H        ASP  24   4.546   0.855   8.448
  178    HA   ASP  24           HA       ASP  24   2.322   2.668   9.096
  179    HB2  ASP  24           HB2      ASP  24   3.415   1.896   6.388
  180    HB3  ASP  24           HB3      ASP  24   1.742   2.406   6.578
  181    H    ASN  25           H        ASN  25   3.121  -0.089   9.854
  182    HA   ASN  25           HA       ASN  25   1.360  -1.847   8.389
  183    HB2  ASN  25           HB2      ASN  25   2.249  -3.594   9.943
  184    HB3  ASN  25           HB3      ASN  25   3.492  -2.750   9.024
  185   HD21  ASN  25          HD21      ASN  25   2.231  -3.453  12.144
  186   HD22  ASN  25          HD22      ASN  25   3.454  -2.633  13.052
  187    H    ASP  26           H        ASP  26  -0.128  -3.272   9.520
  188    HA   ASP  26           HA       ASP  26  -1.298  -2.363  11.995
  189    HB2  ASP  26           HB2      ASP  26  -2.369  -0.805  10.475
  190    HB3  ASP  26           HB3      ASP  26  -2.780  -2.109   9.365
  191    H    ASN  27           H        ASN  27  -2.332  -4.129   9.092
  192    HA   ASN  27           HA       ASN  27  -2.201  -6.650  10.568
  193    HB2  ASN  27           HB2      ASN  27  -4.648  -5.469   9.292
  194    HB3  ASN  27           HB3      ASN  27  -4.433  -7.216   9.292
  195   HD21  ASN  27          HD21      ASN  27  -5.019  -4.391  11.231
  196   HD22  ASN  27          HD22      ASN  27  -5.469  -5.245  12.676
  197    H    CYS  28           H        CYS  28  -3.005  -8.413   8.700
  198    HA   CYS  28           HA       CYS  28  -1.103  -8.048   6.539
  199    HG   CYS  28           HG       CYS  28  -1.673 -11.168   9.049
  200    HB2  CYS  28           HB2      CYS  28  -3.037 -10.320   7.063
  201    HB3  CYS  28           HB3      CYS  28  -1.729 -10.334   5.888
  202    H    THR  29           H        THR  29  -4.381  -7.497   7.143
  203    HA   THR  29           HA       THR  29  -4.997  -7.205   4.291
  204    HB   THR  29           HB       THR  29  -6.899  -7.065   6.642
  205    HG1  THR  29           HG1      THR  29  -7.537  -9.196   5.608
  206   HG21  THR  29          HG21      THR  29  -8.638  -7.343   4.919
  207   HG22  THR  29          HG22      THR  29  -7.397  -7.285   3.668
  208   HG23  THR  29          HG23      THR  29  -7.703  -5.868   4.673
  209    H    SER  30           H        SER  30  -4.836  -5.228   3.452
  210    HA   SER  30           HA       SER  30  -4.954  -2.921   5.271
  211    HG   SER  30           HG       SER  30  -2.992  -1.028   2.987
  212    HB2  SER  30           HB2      SER  30  -2.883  -3.275   3.852
  213    HB3  SER  30           HB3      SER  30  -3.888  -2.966   2.436
  214    H    LYS  31           H        LYS  31  -6.549  -1.450   5.065
  215    HA   LYS  31           HA       LYS  31  -8.530  -1.892   2.944
  216    HB2  LYS  31           HB2      LYS  31  -8.693  -0.287   5.505
  217    HB3  LYS  31           HB3      LYS  31  -9.990  -0.434   4.328
  218    HG2  LYS  31           HG2      LYS  31  -8.783  -2.707   5.892
  219    HG3  LYS  31           HG3      LYS  31 -10.310  -1.906   6.249
  220    HD2  LYS  31           HD2      LYS  31  -9.850  -3.114   3.554
  221    HD3  LYS  31           HD3      LYS  31 -10.303  -4.138   4.914
  222    HE2  LYS  31           HE2      LYS  31 -12.264  -3.479   3.628
  223    HE3  LYS  31           HE3      LYS  31 -12.322  -2.801   5.252
  224    HZ1  LYS  31           HZ1      LYS  31 -11.278  -1.234   2.979
  225    HZ2  LYS  31           HZ2      LYS  31 -11.869  -0.674   4.464
  226    HZ3  LYS  31           HZ3      LYS  31 -12.936  -1.300   3.300
  227    H    PHE  32           H        PHE  32  -8.284  -0.701   1.215
  228    HA   PHE  32           HA       PHE  32  -7.061   1.970   1.479
  229    HD1  PHE  32           HD2      PHE  32  -4.815   2.804   0.395
  230    HD2  PHE  32           HD1      PHE  32  -7.089   1.183  -2.813
  231    HE1  PHE  32           HE2      PHE  32  -4.005   4.601  -1.080
  232    HE2  PHE  32           HE1      PHE  32  -6.285   2.970  -4.293
  233    HZ   PHE  32           HZ       PHE  32  -4.745   4.686  -3.428
  234    HB2  PHE  32           HB2      PHE  32  -5.642   0.353   0.291
  235    HB3  PHE  32           HB3      PHE  32  -6.952   0.016  -0.834
  236    H    SER  33           H        SER  33  -8.421   3.593   1.069
  237    HA   SER  33           HA       SER  33 -10.689   3.075  -0.727
  238    HG   SER  33           HG       SER  33 -10.378   4.417   2.811
  239    HB2  SER  33           HB2      SER  33 -11.776   5.023   0.545
  240    HB3  SER  33           HB3      SER  33 -11.639   3.487   1.397
  241    H    ARG  34           H        ARG  34 -11.100   4.394  -2.355
  242    HA   ARG  34           HA       ARG  34  -9.697   6.955  -2.568
  243    HE   ARG  34           HE       ARG  34  -5.630   6.468  -2.698
  244    HB2  ARG  34           HB2      ARG  34  -9.618   4.685  -4.528
  245    HB3  ARG  34           HB3      ARG  34  -9.511   6.341  -5.099
  246    HG2  ARG  34           HG2      ARG  34  -7.663   5.123  -3.060
  247    HG3  ARG  34           HG3      ARG  34  -7.317   5.249  -4.787
  248    HD2  ARG  34           HD2      ARG  34  -7.444   7.660  -4.675
  249    HD3  ARG  34           HD3      ARG  34  -7.918   7.585  -2.980
  250   HH11  ARG  34          HH11      ARG  34  -6.315   8.911  -5.111
  251   HH12  ARG  34          HH12      ARG  34  -4.707   9.581  -5.077
  252   HH21  ARG  34          HH21      ARG  34  -3.512   7.340  -2.651
  253   HH22  ARG  34          HH22      ARG  34  -3.112   8.669  -3.690
  254    H    PHE  35           H        PHE  35 -10.845   8.520  -3.731
  255    HA   PHE  35           HA       PHE  35 -13.649   7.771  -4.229
  256    HD1  PHE  35           HD2      PHE  35 -11.430   9.494  -1.306
  257    HD2  PHE  35           HD1      PHE  35 -15.533   8.641  -2.044
  258    HE1  PHE  35           HE2      PHE  35 -11.661   8.635   0.988
  259    HE2  PHE  35           HE1      PHE  35 -15.770   7.781   0.248
  260    HZ   PHE  35           HZ       PHE  35 -13.831   7.779   1.768
  261    HB2  PHE  35           HB2      PHE  35 -12.577  10.418  -3.234
  262    HB3  PHE  35           HB3      PHE  35 -14.271  10.050  -3.543
  263    H    PHE  36           H        PHE  36 -14.492   8.220  -6.136
  264    HA   PHE  36           HA       PHE  36 -12.973   9.924  -7.984
  265    HD1  PHE  36           HD2      PHE  36 -11.115   8.960  -9.906
  266    HD2  PHE  36           HD1      PHE  36 -12.440   5.912  -7.248
  267    HE1  PHE  36           HE2      PHE  36  -8.793   8.190  -9.637
  268    HE2  PHE  36           HE1      PHE  36 -10.123   5.139  -6.976
  269    HZ   PHE  36           HZ       PHE  36  -8.295   6.274  -8.169
  270    HB2  PHE  36           HB2      PHE  36 -14.003   7.136  -8.537
  271    HB3  PHE  36           HB3      PHE  36 -13.484   8.248  -9.797
  272    H    ALA  37           H        ALA  37 -14.316  10.231 -10.064
  273    HA   ALA  37           HA       ALA  37 -16.759  11.476  -9.340
  274    HB1  ALA  37           HB1      ALA  37 -16.976  12.016 -11.684
  275    HB2  ALA  37           HB2      ALA  37 -15.755  10.815 -12.108
  276    HB3  ALA  37           HB3      ALA  37 -15.300  12.247 -11.183
  277    H    THR  38           H        THR  38 -16.135   8.679 -11.481
  278    HA   THR  38           HA       THR  38 -18.847   7.738 -10.817
  279    HB   THR  38           HB       THR  38 -18.933   6.701 -13.086
  280    HG1  THR  38           HG1      THR  38 -17.408   7.280 -14.615
  281   HG21  THR  38          HG21      THR  38 -19.387   8.780 -14.317
  282   HG22  THR  38          HG22      THR  38 -18.572   9.699 -13.051
  283   HG23  THR  38          HG23      THR  38 -20.058   8.824 -12.686
  284    H    ARG  39           H        ARG  39 -19.140   5.408 -10.928
  285    HA   ARG  39           HA       ARG  39 -17.193   3.885  -9.650
  286    HE   ARG  39           HE       ARG  39 -18.657  -1.091 -11.185
  287    HB2  ARG  39           HB2      ARG  39 -19.435   3.113  -9.623
  288    HB3  ARG  39           HB3      ARG  39 -19.537   3.101 -11.377
  289    HG2  ARG  39           HG2      ARG  39 -18.023   1.217 -11.484
  290    HG3  ARG  39           HG3      ARG  39 -17.797   1.271  -9.734
  291    HD2  ARG  39           HD2      ARG  39 -20.103   0.696  -9.368
  292    HD3  ARG  39           HD3      ARG  39 -20.446   0.802 -11.096
  293   HH11  ARG  39          HH11      ARG  39 -21.106  -0.636  -8.727
  294   HH12  ARG  39          HH12      ARG  39 -21.260  -2.331  -8.367
  295   HH21  ARG  39          HH21      ARG  39 -18.874  -3.335 -10.753
  296   HH22  ARG  39          HH22      ARG  39 -20.003  -3.871  -9.536
  297    H    GLU  40           H        GLU  40 -17.731   4.474 -13.039
  298    HA   GLU  40           HA       GLU  40 -16.024   2.660 -14.251
  299    HB2  GLU  40           HB2      GLU  40 -16.384   5.571 -14.967
  300    HB3  GLU  40           HB3      GLU  40 -15.836   4.293 -16.038
  301    HG2  GLU  40           HG2      GLU  40 -17.976   3.252 -16.007
  302    HG3  GLU  40           HG3      GLU  40 -18.539   4.333 -14.734
  303    H    GLU  41           H        GLU  41 -15.312   5.916 -13.067
  304    HA   GLU  41           HA       GLU  41 -12.556   5.919 -13.590
  305    HB2  GLU  41           HB2      GLU  41 -14.143   7.431 -11.504
  306    HB3  GLU  41           HB3      GLU  41 -12.502   7.820 -11.992
  307    HG2  GLU  41           HG2      GLU  41 -14.875   7.832 -13.836
  308    HG3  GLU  41           HG3      GLU  41 -14.227   9.258 -13.028
  309    H    ALA  42           H        ALA  42 -14.447   4.598 -11.007
  310    HA   ALA  42           HA       ALA  42 -12.283   4.357  -9.129
  311    HB1  ALA  42           HB1      ALA  42 -14.970   2.987  -9.130
  312    HB2  ALA  42           HB2      ALA  42 -14.618   4.546  -8.386
  313    HB3  ALA  42           HB3      ALA  42 -13.847   3.081  -7.774
  314    H    GLU  43           H        GLU  43 -14.052   2.089 -11.221
  315    HA   GLU  43           HA       GLU  43 -12.497  -0.171 -10.536
  316    HB2  GLU  43           HB2      GLU  43 -14.129   0.362 -13.026
  317    HB3  GLU  43           HB3      GLU  43 -13.501  -1.208 -12.539
  318    HG2  GLU  43           HG2      GLU  43 -14.813  -0.950 -10.411
  319    HG3  GLU  43           HG3      GLU  43 -15.580   0.455 -11.147
  320    H    SER  44           H        SER  44 -12.014   2.443 -12.754
  321    HA   SER  44           HA       SER  44 -10.042   1.271 -14.396
  322    HG   SER  44           HG       SER  44 -12.237   3.380 -14.670
  323    HB2  SER  44           HB2      SER  44 -10.410   4.178 -13.623
  324    HB3  SER  44           HB3      SER  44  -9.415   3.591 -14.958
  325    H    PHE  45           H        PHE  45  -9.945   2.609 -11.175
  326    HA   PHE  45           HA       PHE  45  -7.074   2.856 -11.127
  327    HD1  PHE  45           HD2      PHE  45  -6.255   5.037 -10.036
  328    HD2  PHE  45           HD1      PHE  45  -7.610   2.484  -6.915
  329    HE1  PHE  45           HE2      PHE  45  -4.306   5.677  -8.674
  330    HE2  PHE  45           HE1      PHE  45  -5.668   3.120  -5.547
  331    HZ   PHE  45           HZ       PHE  45  -4.015   4.718  -6.426
  332    HB2  PHE  45           HB2      PHE  45  -8.711   4.247  -9.760
  333    HB3  PHE  45           HB3      PHE  45  -8.956   2.820  -8.762
  334    H    MET  46           H        MET  46  -9.508   0.540 -10.200
  335    HA   MET  46           HA       MET  46  -7.897  -1.149  -8.617
  336    HB2  MET  46           HB2      MET  46 -10.326  -1.238  -8.524
  337    HB3  MET  46           HB3      MET  46 -10.399  -1.747 -10.204
  338    HG2  MET  46           HG2      MET  46 -10.771  -3.595  -8.644
  339    HG3  MET  46           HG3      MET  46  -9.355  -3.848  -9.659
  340    HE1  MET  46           HE1      MET  46 -10.585  -2.682  -6.101
  341    HE2  MET  46           HE2      MET  46  -9.498  -1.387  -6.602
  342    HE3  MET  46           HE3      MET  46  -9.049  -2.450  -5.268
  343    H    THR  47           H        THR  47  -8.505  -1.013 -12.077
  344    HA   THR  47           HA       THR  47  -7.558  -3.503 -12.853
  345    HB   THR  47           HB       THR  47  -7.222  -0.923 -14.394
  346    HG1  THR  47           HG1      THR  47  -9.322  -1.337 -15.153
  347   HG21  THR  47          HG21      THR  47  -6.036  -2.822 -15.376
  348   HG22  THR  47          HG22      THR  47  -7.426  -2.371 -16.364
  349   HG23  THR  47          HG23      THR  47  -7.512  -3.786 -15.317
  350    H    LYS  48           H        LYS  48  -5.705  -0.447 -12.624
  351    HA   LYS  48           HA       LYS  48  -3.248  -1.706 -13.308
  352    HB2  LYS  48           HB2      LYS  48  -2.216   0.450 -12.637
  353    HB3  LYS  48           HB3      LYS  48  -3.496   0.598 -13.833
  354    HG2  LYS  48           HG2      LYS  48  -5.052   1.283 -12.087
  355    HG3  LYS  48           HG3      LYS  48  -3.766   1.144 -10.887
  356    HD2  LYS  48           HD2      LYS  48  -4.023   3.437 -11.541
  357    HD3  LYS  48           HD3      LYS  48  -2.474   2.840 -12.125
  358    HE2  LYS  48           HE2      LYS  48  -3.531   4.175 -13.839
  359    HE3  LYS  48           HE3      LYS  48  -3.485   2.488 -14.344
  360    HZ1  LYS  48           HZ1      LYS  48  -5.622   3.503 -14.830
  361    HZ2  LYS  48           HZ2      LYS  48  -5.846   3.880 -13.192
  362    HZ3  LYS  48           HZ3      LYS  48  -5.797   2.261 -13.693
  363    H    LEU  49           H        LEU  49  -4.913  -1.087 -10.321
  364    HA   LEU  49           HA       LEU  49  -2.689  -1.463  -8.593
  365    HG   LEU  49           HG       LEU  49  -5.131   0.315  -6.541
  366    HB2  LEU  49           HB2      LEU  49  -5.614  -1.220  -8.301
  367    HB3  LEU  49           HB3      LEU  49  -4.802  -2.118  -7.032
  368   HD11  LEU  49          HD11      LEU  49  -2.894   0.659  -5.649
  369   HD12  LEU  49          HD12      LEU  49  -2.272  -0.631  -6.681
  370   HD13  LEU  49          HD13      LEU  49  -3.426  -1.003  -5.399
  371   HD21  LEU  49          HD21      LEU  49  -4.738   1.193  -8.787
  372   HD22  LEU  49          HD22      LEU  49  -3.053   0.675  -8.700
  373   HD23  LEU  49          HD23      LEU  49  -3.650   1.929  -7.611
  374    H    LYS  50           H        LYS  50  -4.840  -3.628 -10.235
  375    HA   LYS  50           HA       LYS  50  -4.506  -5.968  -8.762
  376    HB2  LYS  50           HB2      LYS  50  -5.428  -5.262 -11.392
  377    HB3  LYS  50           HB3      LYS  50  -4.430  -6.706 -11.487
  378    HG2  LYS  50           HG2      LYS  50  -6.706  -7.360 -11.218
  379    HG3  LYS  50           HG3      LYS  50  -5.836  -7.733  -9.728
  380    HD2  LYS  50           HD2      LYS  50  -6.729  -5.712  -8.695
  381    HD3  LYS  50           HD3      LYS  50  -7.564  -5.305 -10.195
  382    HE2  LYS  50           HE2      LYS  50  -8.068  -7.693  -8.423
  383    HE3  LYS  50           HE3      LYS  50  -9.138  -6.314  -8.681
  384    HZ1  LYS  50           HZ1      LYS  50  -9.162  -6.997 -11.092
  385    HZ2  LYS  50           HZ2      LYS  50  -9.959  -8.043 -10.022
  386    HZ3  LYS  50           HZ3      LYS  50  -8.424  -8.450 -10.612
  387    H    GLU  51           H        GLU  51  -2.483  -4.604 -11.308
  388    HA   GLU  51           HA       GLU  51  -0.560  -6.652 -11.416
  389    HB2  GLU  51           HB2      GLU  51  -0.236  -3.695 -11.971
  390    HB3  GLU  51           HB3      GLU  51   0.890  -4.952 -12.462
  391    HG2  GLU  51           HG2      GLU  51  -0.883  -5.953 -13.847
  392    HG3  GLU  51           HG3      GLU  51  -1.947  -4.620 -13.405
  393    H    LEU  52           H        LEU  52  -0.756  -3.674  -9.559
  394    HA   LEU  52           HA       LEU  52   1.792  -3.831  -8.373
  395    HG   LEU  52           HG       LEU  52  -0.048  -1.594  -9.593
  396    HB2  LEU  52           HB2      LEU  52  -0.691  -2.434  -7.375
  397    HB3  LEU  52           HB3      LEU  52   0.939  -2.150  -6.794
  398   HD11  LEU  52          HD11      LEU  52   0.260   0.761  -8.970
  399   HD12  LEU  52          HD12      LEU  52   0.626   0.263  -7.318
  400   HD13  LEU  52          HD13      LEU  52  -0.975  -0.034  -7.995
  401   HD21  LEU  52          HD21      LEU  52   2.625  -1.046  -8.308
  402   HD22  LEU  52          HD22      LEU  52   2.121  -0.512  -9.912
  403   HD23  LEU  52          HD23      LEU  52   2.300  -2.232  -9.571
  404    H    ALA  53           H        ALA  53  -1.397  -4.925  -7.277
  405    HA   ALA  53           HA       ALA  53  -0.651  -5.689  -4.680
  406    HB1  ALA  53           HB1      ALA  53  -2.688  -7.021  -4.663
  407    HB2  ALA  53           HB2      ALA  53  -2.811  -6.879  -6.416
  408    HB3  ALA  53           HB3      ALA  53  -2.982  -5.446  -5.403
  409    H    ALA  54           H        ALA  54  -0.649  -7.523  -7.720
  410    HA   ALA  54           HA       ALA  54   0.050 -10.011  -6.580
  411    HB1  ALA  54           HB1      ALA  54   0.568 -10.710  -8.847
  412    HB2  ALA  54           HB2      ALA  54   0.560  -9.032  -9.387
  413    HB3  ALA  54           HB3      ALA  54  -0.932  -9.784  -8.820
  414    H    ALA  55           H        ALA  55   1.987  -7.439  -8.055
  415    HA   ALA  55           HA       ALA  55   4.487  -8.726  -7.759
  416    HB1  ALA  55           HB1      ALA  55   3.934  -5.765  -7.896
  417    HB2  ALA  55           HB2      ALA  55   4.080  -6.834  -9.292
  418    HB3  ALA  55           HB3      ALA  55   5.467  -6.571  -8.233
  419    H    ALA  56           H        ALA  56   2.598  -6.625  -5.684
  420    HA   ALA  56           HA       ALA  56   4.546  -6.123  -3.723
  421    HB1  ALA  56           HB1      ALA  56   2.662  -5.525  -2.278
  422    HB2  ALA  56           HB2      ALA  56   1.545  -6.242  -3.440
  423    HB3  ALA  56           HB3      ALA  56   2.494  -4.824  -3.888
  424    H    SER  57           H        SER  57   1.987  -8.606  -3.884
  425    HA   SER  57           HA       SER  57   2.678  -9.854  -1.451
  426    HG   SER  57           HG       SER  57   1.351 -11.602  -1.003
  427    HB2  SER  57           HB2      SER  57   0.505 -10.164  -2.739
  428    HB3  SER  57           HB3      SER  57   1.398 -11.235  -3.817
  429    H    SER  58           H        SER  58   3.983 -10.003  -4.626
  430    HA   SER  58           HA       SER  58   5.937 -10.836  -5.435
  431    HG   SER  58           HG       SER  58   5.959  -9.336  -3.092
  432    HB2  SER  58           HB2      SER  58   6.567 -11.695  -2.608
  433    HB3  SER  58           HB3      SER  58   7.704 -11.384  -3.917
  434    H    ALA  59           H        ALA  59   3.484 -12.587  -4.549
  435    HA   ALA  59           HA       ALA  59   4.784 -15.209  -4.619
  436    HB1  ALA  59           HB1      ALA  59   2.674 -16.098  -3.807
  437    HB2  ALA  59           HB2      ALA  59   1.937 -14.500  -3.931
  438    HB3  ALA  59           HB3      ALA  59   3.235 -14.783  -2.772
  439    H    ASP  60           H        ASP  60   4.151 -13.292  -6.920
  440    HA   ASP  60           HA       ASP  60   3.741 -13.506  -9.144
  441    HB2  ASP  60           HB2      ASP  60   3.356 -16.454  -8.566
  442    HB3  ASP  60           HB3      ASP  60   3.575 -15.734 -10.156
  443    H    GLU  61           H        GLU  61   1.616 -16.022  -7.871
  444    HA   GLU  61           HA       GLU  61  -0.651 -14.784  -9.255
  445    HB2  GLU  61           HB2      GLU  61  -0.141 -17.131  -9.760
  446    HB3  GLU  61           HB3      GLU  61  -0.295 -17.538  -8.058
  447    HG2  GLU  61           HG2      GLU  61  -2.665 -16.883  -8.139
  448    HG3  GLU  61           HG3      GLU  61  -2.490 -16.560  -9.865
  449    H    GLY  62           H        GLY  62   0.677 -15.364  -6.156
  450    HA2  GLY  62           HA2      GLY  62  -1.657 -15.475  -4.579
  451    HA3  GLY  62           HA3      GLY  62  -0.059 -15.015  -4.015
  452    H    ALA  63           H        ALA  63  -3.157 -13.991  -4.413
  453    HA   ALA  63           HA       ALA  63  -2.656 -11.378  -3.475
  454    HB1  ALA  63           HB1      ALA  63  -3.563 -11.556  -6.355
  455    HB2  ALA  63           HB2      ALA  63  -1.989 -10.978  -5.808
  456    HB3  ALA  63           HB3      ALA  63  -3.450 -10.083  -5.391
  457    H    SER  64           H        SER  64  -4.357 -10.990  -2.229
  458    HA   SER  64           HA       SER  64  -7.001 -11.944  -3.114
  459    HG   SER  64           HG       SER  64  -5.921 -13.801  -0.233
  460    HB2  SER  64           HB2      SER  64  -5.944 -11.634  -0.290
  461    HB3  SER  64           HB3      SER  64  -7.602 -12.068  -0.704
  462    H    VAL  65           H        VAL  65  -8.322 -10.332  -3.648
  463    HA   VAL  65           HA       VAL  65  -8.120  -7.831  -2.133
  464    HB   VAL  65           HB       VAL  65  -6.937  -7.356  -4.162
  465   HG11  VAL  65          HG11      VAL  65  -7.754  -9.153  -5.569
  466   HG12  VAL  65          HG12      VAL  65  -7.958  -7.603  -6.385
  467   HG13  VAL  65          HG13      VAL  65  -9.347  -8.400  -5.645
  468   HG21  VAL  65          HG21      VAL  65  -8.361  -5.572  -3.357
  469   HG22  VAL  65          HG22      VAL  65  -9.725  -6.215  -4.275
  470   HG23  VAL  65          HG23      VAL  65  -8.323  -5.562  -5.121
  471    H    ALA  66           H        ALA  66  -9.968  -7.551  -1.143
  472    HA   ALA  66           HA       ALA  66 -12.459  -8.234  -2.557
  473    HB1  ALA  66           HB1      ALA  66 -12.011  -7.791   0.399
  474    HB2  ALA  66           HB2      ALA  66 -12.192  -9.356  -0.392
  475    HB3  ALA  66           HB3      ALA  66 -13.543  -8.222  -0.362
  476    H    TYR  67           H        TYR  67 -12.852  -6.420  -3.744
  477    HA   TYR  67           HA       TYR  67 -12.661  -3.858  -2.340
  478    HD1  TYR  67           HD2      TYR  67 -11.604  -6.250  -5.552
  479    HD2  TYR  67           HD1      TYR  67 -13.984  -2.799  -6.284
  480    HE1  TYR  67           HE2      TYR  67 -12.323  -7.205  -7.702
  481    HE2  TYR  67           HE1      TYR  67 -14.704  -3.745  -8.434
  482    HH   TYR  67           HH       TYR  67 -13.925  -5.366 -10.085
  483    HB2  TYR  67           HB2      TYR  67 -12.441  -2.788  -4.508
  484    HB3  TYR  67           HB3      TYR  67 -11.238  -4.058  -4.338
  485    H    LYS  68           H        LYS  68 -14.337  -2.598  -2.067
  486    HA   LYS  68           HA       LYS  68 -16.902  -3.379  -3.277
  487    HB2  LYS  68           HB2      LYS  68 -16.276  -1.964  -0.687
  488    HB3  LYS  68           HB3      LYS  68 -17.891  -2.026  -1.374
  489    HG2  LYS  68           HG2      LYS  68 -18.049  -4.342  -1.080
  490    HG3  LYS  68           HG3      LYS  68 -16.314  -4.500  -0.811
  491    HD2  LYS  68           HD2      LYS  68 -18.188  -3.007   1.020
  492    HD3  LYS  68           HD3      LYS  68 -17.696  -4.685   1.263
  493    HE2  LYS  68           HE2      LYS  68 -15.358  -3.974   1.409
  494    HE3  LYS  68           HE3      LYS  68 -15.849  -2.299   1.157
  495    HZ1  LYS  68           HZ1      LYS  68 -16.764  -3.975   3.433
  496    HZ2  LYS  68           HZ2      LYS  68 -17.032  -2.316   3.219
  497    HZ3  LYS  68           HZ3      LYS  68 -15.467  -2.884   3.519
  498    H    ILE  69           H        ILE  69 -18.033  -1.890  -4.371
  499    HA   ILE  69           HA       ILE  69 -16.816   0.780  -4.659
  500    HB   ILE  69           HB       ILE  69 -18.281  -0.664  -6.868
  501   HG12  ILE  69          HG12      ILE  69 -15.287  -0.365  -6.533
  502   HG13  ILE  69          HG13      ILE  69 -16.176  -1.853  -6.224
  503   HG21  ILE  69          HG21      ILE  69 -18.273   1.763  -7.014
  504   HG22  ILE  69          HG22      ILE  69 -17.241   1.071  -8.267
  505   HG23  ILE  69          HG23      ILE  69 -16.519   1.785  -6.825
  506   HD11  ILE  69          HD11      ILE  69 -15.089  -1.852  -8.410
  507   HD12  ILE  69          HD12      ILE  69 -16.032  -0.433  -8.868
  508   HD13  ILE  69          HD13      ILE  69 -16.845  -1.964  -8.544
  509    H    LYS  70           H        LYS  70 -18.147   2.127  -3.621
  510    HA   LYS  70           HA       LYS  70 -21.018   1.527  -3.723
  511    HB2  LYS  70           HB2      LYS  70 -19.827   1.816  -1.521
  512    HB3  LYS  70           HB3      LYS  70 -19.655   3.515  -1.920
  513    HG2  LYS  70           HG2      LYS  70 -21.538   3.293  -0.489
  514    HG3  LYS  70           HG3      LYS  70 -22.150   3.623  -2.115
  515    HD2  LYS  70           HD2      LYS  70 -22.630   1.271  -2.443
  516    HD3  LYS  70           HD3      LYS  70 -21.916   0.879  -0.876
  517    HE2  LYS  70           HE2      LYS  70 -23.641   2.277   0.212
  518    HE3  LYS  70           HE3      LYS  70 -24.377   2.551  -1.367
  519    HZ1  LYS  70           HZ1      LYS  70 -24.034  -0.097  -0.065
  520    HZ2  LYS  70           HZ2      LYS  70 -24.780   0.182  -1.561
  521    HZ3  LYS  70           HZ3      LYS  70 -25.483   0.778  -0.138
  522    H    ASP  71           H        ASP  71 -22.121   2.528  -5.156
  523    HA   ASP  71           HA       ASP  71 -21.244   4.936  -6.437
  524    HB2  ASP  71           HB2      ASP  71 -23.764   3.288  -6.613
  525    HB3  ASP  71           HB3      ASP  71 -23.598   4.820  -7.456
  526    H    LEU  72           H        LEU  72 -21.241   6.738  -5.282
  527    HA   LEU  72           HA       LEU  72 -23.289   7.121  -3.230
  528    HG   LEU  72           HG       LEU  72 -20.246   6.333  -2.966
  529    HB2  LEU  72           HB2      LEU  72 -20.733   8.656  -3.711
  530    HB3  LEU  72           HB3      LEU  72 -21.806   8.842  -2.338
  531   HD11  LEU  72          HD11      LEU  72 -18.840   6.974  -1.076
  532   HD12  LEU  72          HD12      LEU  72 -19.742   8.480  -0.910
  533   HD13  LEU  72          HD13      LEU  72 -18.777   8.186  -2.356
  534   HD21  LEU  72          HD21      LEU  72 -20.903   5.671  -0.704
  535   HD22  LEU  72          HD22      LEU  72 -22.307   5.903  -1.744
  536   HD23  LEU  72          HD23      LEU  72 -21.875   7.135  -0.559
  537    H    GLU  73           H        GLU  73 -23.308   9.777  -2.921
  538    HA   GLU  73           HA       GLU  73 -24.765  10.663  -5.267
  539    HB2  GLU  73           HB2      GLU  73 -25.323  12.611  -3.695
  540    HB3  GLU  73           HB3      GLU  73 -25.956  11.024  -3.280
  541    HG2  GLU  73           HG2      GLU  73 -23.939  10.761  -1.778
  542    HG3  GLU  73           HG3      GLU  73 -23.648  12.479  -2.033
  543    H    GLY  74           H        GLY  74 -23.399  11.334  -6.810
  544    HA2  GLY  74           HA2      GLY  74 -22.332  13.161  -7.840
  545    HA3  GLY  74           HA3      GLY  74 -21.931  13.794  -6.251
  546    H    GLN  75           H        GLN  75 -21.083  10.762  -5.851
  547    HA   GLN  75           HA       GLN  75 -18.591  10.683  -7.297
  548    HB2  GLN  75           HB2      GLN  75 -17.167  10.718  -5.298
  549    HB3  GLN  75           HB3      GLN  75 -18.025  12.241  -5.477
  550    HG2  GLN  75           HG2      GLN  75 -19.650  11.521  -3.798
  551    HG3  GLN  75           HG3      GLN  75 -18.782  10.000  -3.614
  552   HE21  GLN  75          HE21      GLN  75 -16.788   9.988  -2.572
  553   HE22  GLN  75          HE22      GLN  75 -16.260  11.307  -1.578
  554    H    VAL  76           H        VAL  76 -17.235   8.777  -6.280
  555    HA   VAL  76           HA       VAL  76 -18.997   6.743  -5.093
  556    HB   VAL  76           HB       VAL  76 -17.947   4.990  -6.490
  557   HG11  VAL  76          HG11      VAL  76 -19.155   5.502  -8.587
  558   HG12  VAL  76          HG12      VAL  76 -19.383   7.156  -8.020
  559   HG13  VAL  76          HG13      VAL  76 -20.119   5.816  -7.143
  560   HG21  VAL  76          HG21      VAL  76 -16.785   7.306  -8.031
  561   HG22  VAL  76          HG22      VAL  76 -16.715   5.610  -8.512
  562   HG23  VAL  76          HG23      VAL  76 -15.881   6.150  -7.053
  563    H    GLU  77           H        GLU  77 -17.868   5.144  -3.851
  564    HA   GLU  77           HA       GLU  77 -15.100   5.915  -3.249
  565    HB2  GLU  77           HB2      GLU  77 -15.353   5.016  -1.017
  566    HB3  GLU  77           HB3      GLU  77 -16.593   6.223  -1.318
  567    HG2  GLU  77           HG2      GLU  77 -18.189   4.421  -1.771
  568    HG3  GLU  77           HG3      GLU  77 -16.948   3.243  -1.382
  569    H    LEU  78           H        LEU  78 -13.612   4.590  -3.768
  570    HA   LEU  78           HA       LEU  78 -14.243   1.802  -4.391
  571    HG   LEU  78           HG       LEU  78 -11.446   1.655  -6.793
  572    HB2  LEU  78           HB2      LEU  78 -12.963   3.239  -6.026
  573    HB3  LEU  78           HB3      LEU  78 -11.664   3.321  -4.856
  574   HD11  LEU  78          HD11      LEU  78 -10.302   0.009  -5.411
  575   HD12  LEU  78          HD12      LEU  78 -11.097   0.656  -3.976
  576   HD13  LEU  78          HD13      LEU  78  -9.950   1.651  -4.872
  577   HD21  LEU  78          HD21      LEU  78 -13.678   0.708  -6.692
  578   HD22  LEU  78          HD22      LEU  78 -13.370   0.118  -5.057
  579   HD23  LEU  78          HD23      LEU  78 -12.462  -0.539  -6.418
  580    H    ASP  79           H        ASP  79 -14.124   0.515  -2.721
  581    HA   ASP  79           HA       ASP  79 -12.207   1.128  -0.562
  582    HB2  ASP  79           HB2      ASP  79 -14.621   1.381   0.042
  583    HB3  ASP  79           HB3      ASP  79 -14.863  -0.319  -0.342
  584    H    ALA  80           H        ALA  80 -10.506  -0.187  -0.984
  585    HA   ALA  80           HA       ALA  80 -11.110  -2.950  -1.803
  586    HB1  ALA  80           HB1      ALA  80  -9.850  -1.670  -3.439
  587    HB2  ALA  80           HB2      ALA  80  -8.875  -2.986  -2.784
  588    HB3  ALA  80           HB3      ALA  80  -8.607  -1.331  -2.236
  589    H    ALA  81           H        ALA  81 -10.786  -4.484  -0.385
  590    HA   ALA  81           HA       ALA  81  -8.905  -4.101   1.817
  591    HB1  ALA  81           HB1      ALA  81  -9.887  -6.136   2.749
  592    HB2  ALA  81           HB2      ALA  81 -10.878  -6.329   1.303
  593    HB3  ALA  81           HB3      ALA  81 -11.134  -4.948   2.370
  594    H    PHE  82           H        PHE  82  -6.883  -4.437   1.074
  595    HA   PHE  82           HA       PHE  82  -6.345  -6.673  -0.720
  596    HD1  PHE  82           HD2      PHE  82  -4.876  -5.963  -2.985
  597    HD2  PHE  82           HD1      PHE  82  -5.593  -2.579  -0.507
  598    HE1  PHE  82           HE2      PHE  82  -5.445  -4.632  -4.976
  599    HE2  PHE  82           HE1      PHE  82  -6.163  -1.241  -2.491
  600    HZ   PHE  82           HZ       PHE  82  -6.089  -2.268  -4.730
  601    HB2  PHE  82           HB2      PHE  82  -4.565  -4.488   0.385
  602    HB3  PHE  82           HB3      PHE  82  -3.985  -5.786  -0.651
  603    H    THR  83           H        THR  83  -5.893  -8.600   0.052
  604    HA   THR  83           HA       THR  83  -4.946  -8.795   2.832
  605    HB   THR  83           HB       THR  83  -6.340 -10.951   1.243
  606    HG1  THR  83           HG1      THR  83  -7.351  -8.670   2.191
  607   HG21  THR  83          HG21      THR  83  -5.063 -11.723   3.187
  608   HG22  THR  83          HG22      THR  83  -6.795 -11.888   3.472
  609   HG23  THR  83          HG23      THR  83  -5.907 -10.557   4.212
  610    H    PHE  84           H        PHE  84  -2.807  -9.000   2.772
  611    HA   PHE  84           HA       PHE  84  -1.576 -10.690   0.727
  612    HD1  PHE  84           HD2      PHE  84   0.379  -9.235  -0.823
  613    HD2  PHE  84           HD1      PHE  84  -1.537  -6.815   2.110
  614    HE1  PHE  84           HE2      PHE  84   0.085  -7.453  -2.490
  615    HE2  PHE  84           HE1      PHE  84  -1.833  -5.030   0.442
  616    HZ   PHE  84           HZ       PHE  84  -1.021  -5.348  -1.861
  617    HB2  PHE  84           HB2      PHE  84  -0.361  -8.794   2.748
  618    HB3  PHE  84           HB3      PHE  84   0.559  -9.733   1.576
  619    H    SER  85           H        SER  85   0.063 -12.254   1.398
  620    HA   SER  85           HA       SER  85  -0.971 -13.779   3.631
  621    HG   SER  85           HG       SER  85  -1.335 -14.265   1.239
  622    HB2  SER  85           HB2      SER  85   1.217 -14.429   1.642
  623    HB3  SER  85           HB3      SER  85   0.539 -15.554   2.818
  624    H    CYS  86           H        CYS  86   1.560 -11.599   3.014
  625    HA   CYS  86           HA       CYS  86   2.550 -12.049   5.744
  626    HG   CYS  86           HG       CYS  86   4.151 -13.594   2.441
  627    HB2  CYS  86           HB2      CYS  86   4.321 -11.205   3.445
  628    HB3  CYS  86           HB3      CYS  86   4.819 -11.635   5.078
  629    H    GLN  87           H        GLN  87   2.885 -10.158   6.910
  630    HA   GLN  87           HA       GLN  87   1.546  -7.835   6.005
  631    HB2  GLN  87           HB2      GLN  87   1.650  -8.264   8.363
  632    HB3  GLN  87           HB3      GLN  87   3.408  -8.274   8.337
  633    HG2  GLN  87           HG2      GLN  87   3.512  -5.951   7.976
  634    HG3  GLN  87           HG3      GLN  87   1.794  -5.853   7.605
  635   HE21  GLN  87          HE21      GLN  87   0.300  -5.970   9.294
  636   HE22  GLN  87          HE22      GLN  87   0.764  -5.706  10.944
  637    H    ALA  88           H        ALA  88   4.837  -8.910   5.847
  638    HA   ALA  88           HA       ALA  88   6.170  -6.549   5.236
  639    HB1  ALA  88           HB1      ALA  88   6.650  -9.290   4.068
  640    HB2  ALA  88           HB2      ALA  88   7.307  -8.689   5.591
  641    HB3  ALA  88           HB3      ALA  88   7.794  -7.949   4.065
  642    H    GLU  89           H        GLU  89   4.317  -8.720   3.155
  643    HA   GLU  89           HA       GLU  89   4.798  -7.389   0.703
  644    HB2  GLU  89           HB2      GLU  89   2.321  -8.965   1.437
  645    HB3  GLU  89           HB3      GLU  89   3.008  -8.736  -0.163
  646    HG2  GLU  89           HG2      GLU  89   4.811 -10.181   0.296
  647    HG3  GLU  89           HG3      GLU  89   4.456 -10.197   2.023
  648    H    MET  90           H        MET  90   2.534  -6.919   3.310
  649    HA   MET  90           HA       MET  90   0.725  -5.242   1.879
  650    HB2  MET  90           HB2      MET  90   0.125  -6.567   3.910
  651    HB3  MET  90           HB3      MET  90   1.120  -5.484   4.869
  652    HG2  MET  90           HG2      MET  90  -1.148  -4.449   3.208
  653    HG3  MET  90           HG3      MET  90  -1.419  -5.118   4.813
  654    HE1  MET  90           HE1      MET  90   0.609  -2.680   7.089
  655    HE2  MET  90           HE2      MET  90   1.137  -4.224   6.416
  656    HE3  MET  90           HE3      MET  90  -0.503  -4.048   7.045
  657    H    ILE  91           H        ILE  91   3.324  -4.607   4.242
  658    HA   ILE  91           HA       ILE  91   2.926  -1.808   4.218
  659    HB   ILE  91           HB       ILE  91   5.295  -1.760   5.201
  660   HG12  ILE  91          HG12      ILE  91   4.758  -4.722   5.439
  661   HG13  ILE  91          HG13      ILE  91   5.926  -4.017   4.333
  662   HG21  ILE  91          HG21      ILE  91   3.323  -1.475   6.531
  663   HG22  ILE  91          HG22      ILE  91   4.441  -2.542   7.381
  664   HG23  ILE  91          HG23      ILE  91   3.039  -3.214   6.549
  665   HD11  ILE  91          HD11      ILE  91   5.996  -3.869   7.335
  666   HD12  ILE  91          HD12      ILE  91   7.157  -3.103   6.249
  667   HD13  ILE  91          HD13      ILE  91   7.027  -4.862   6.304
  668    H    ILE  92           H        ILE  92   5.121  -3.908   2.363
  669    HA   ILE  92           HA       ILE  92   6.582  -1.780   1.210
  670    HB   ILE  92           HB       ILE  92   7.337  -3.394  -0.476
  671   HG12  ILE  92          HG12      ILE  92   6.525  -5.867   0.190
  672   HG13  ILE  92          HG13      ILE  92   5.047  -4.972   0.532
  673   HG21  ILE  92          HG21      ILE  92   8.440  -4.956   1.048
  674   HG22  ILE  92          HG22      ILE  92   7.325  -4.472   2.327
  675   HG23  ILE  92          HG23      ILE  92   8.460  -3.300   1.657
  676   HD11  ILE  92          HD11      ILE  92   4.997  -5.841  -1.712
  677   HD12  ILE  92          HD12      ILE  92   6.524  -5.047  -2.087
  678   HD13  ILE  92          HD13      ILE  92   5.086  -4.080  -1.755
  679    H    PHE  93           H        PHE  93   3.560  -3.308   0.449
  680    HA   PHE  93           HA       PHE  93   3.142  -2.131  -2.097
  681    HD1  PHE  93           HD2      PHE  93   1.542  -2.934  -3.740
  682    HD2  PHE  93           HD1      PHE  93  -0.998  -2.502  -0.351
  683    HE1  PHE  93           HE2      PHE  93  -0.343  -2.395  -5.224
  684    HE2  PHE  93           HE1      PHE  93  -2.888  -1.966  -1.832
  685    HZ   PHE  93           HZ       PHE  93  -2.561  -1.910  -4.271
  686    HB2  PHE  93           HB2      PHE  93   1.886  -4.089  -1.306
  687    HB3  PHE  93           HB3      PHE  93   1.168  -3.125  -0.024
  688    H    GLU  94           H        GLU  94   2.007  -1.303   1.161
  689    HA   GLU  94           HA       GLU  94   0.675   1.059   0.582
  690    HB2  GLU  94           HB2      GLU  94   2.188   0.238   3.053
  691    HB3  GLU  94           HB3      GLU  94   1.172   1.669   2.967
  692    HG2  GLU  94           HG2      GLU  94   0.210  -1.135   2.467
  693    HG3  GLU  94           HG3      GLU  94   0.069  -0.281   4.004
  694    H    LEU  95           H        LEU  95   4.118   0.537   1.198
  695    HA   LEU  95           HA       LEU  95   4.898   3.219   1.381
  696    HG   LEU  95           HG       LEU  95   5.872   0.545   2.683
  697    HB2  LEU  95           HB2      LEU  95   6.427   0.841   0.326
  698    HB3  LEU  95           HB3      LEU  95   7.148   2.403   0.668
  699   HD11  LEU  95          HD11      LEU  95   8.037  -0.227   1.899
  700   HD12  LEU  95          HD12      LEU  95   8.147   0.350   3.563
  701   HD13  LEU  95          HD13      LEU  95   8.741   1.354   2.240
  702   HD21  LEU  95          HD21      LEU  95   5.494   2.894   3.265
  703   HD22  LEU  95          HD22      LEU  95   7.223   3.212   3.103
  704   HD23  LEU  95          HD23      LEU  95   6.637   2.130   4.367
  705    H    SER  96           H        SER  96   4.904   1.087  -1.488
  706    HA   SER  96           HA       SER  96   5.777   3.038  -3.292
  707    HG   SER  96           HG       SER  96   6.779   0.937  -3.409
  708    HB2  SER  96           HB2      SER  96   4.012   0.649  -3.872
  709    HB3  SER  96           HB3      SER  96   5.010   1.523  -5.036
  710    H    LEU  97           H        LEU  97   2.551   2.223  -2.133
  711    HA   LEU  97           HA       LEU  97   1.064   3.786  -3.946
  712    HG   LEU  97           HG       LEU  97   0.619   1.059  -2.262
  713    HB2  LEU  97           HB2      LEU  97   0.433   3.152  -1.063
  714    HB3  LEU  97           HB3      LEU  97  -0.707   3.769  -2.240
  715   HD11  LEU  97          HD11      LEU  97  -2.245   1.919  -1.876
  716   HD12  LEU  97          HD12      LEU  97  -1.168   1.274  -0.636
  717   HD13  LEU  97          HD13      LEU  97  -1.679   0.251  -1.980
  718   HD21  LEU  97          HD21      LEU  97   0.392   1.903  -4.540
  719   HD22  LEU  97          HD22      LEU  97  -1.307   2.273  -4.246
  720   HD23  LEU  97          HD23      LEU  97  -0.754   0.598  -4.236
  721    H    ARG  98           H        ARG  98   2.609   4.553  -0.877
  722    HA   ARG  98           HA       ARG  98   1.567   7.183  -0.641
  723    HE   ARG  98           HE       ARG  98   2.130   5.446   4.849
  724    HB2  ARG  98           HB2      ARG  98   3.918   5.775   0.610
  725    HB3  ARG  98           HB3      ARG  98   3.530   7.452   0.974
  726    HG2  ARG  98           HG2      ARG  98   1.606   6.906   2.099
  727    HG3  ARG  98           HG3      ARG  98   1.416   5.369   1.252
  728    HD2  ARG  98           HD2      ARG  98   3.225   4.397   2.494
  729    HD3  ARG  98           HD3      ARG  98   3.624   5.950   3.221
  730   HH11  ARG  98          HH11      ARG  98   1.038   3.818   1.936
  731   HH12  ARG  98          HH12      ARG  98  -0.310   3.044   2.724
  732   HH21  ARG  98          HH21      ARG  98   0.368   4.472   5.862
  733   HH22  ARG  98          HH22      ARG  98  -0.696   3.426   4.962
  734    H    SER  99           H        SER  99   4.581   5.878  -1.974
  735    HA   SER  99           HA       SER  99   5.761   8.355  -2.605
  736    HG   SER  99           HG       SER  99   7.440   5.178  -2.412
  737    HB2  SER  99           HB2      SER  99   6.109   5.686  -3.992
  738    HB3  SER  99           HB3      SER  99   7.203   7.065  -4.111
  739    H    LEU 100           H        LEU 100   3.445   6.335  -4.312
  740    HA   LEU 100           HA       LEU 100   3.559   7.819  -6.758
  741    HG   LEU 100           HG       LEU 100   0.683   7.235  -7.724
  742    HB2  LEU 100           HB2      LEU 100   2.851   5.450  -6.611
  743    HB3  LEU 100           HB3      LEU 100   1.416   5.950  -5.739
  744   HD11  LEU 100          HD11      LEU 100   3.074   5.957  -9.045
  745   HD12  LEU 100          HD12      LEU 100   2.863   7.676  -8.714
  746   HD13  LEU 100          HD13      LEU 100   1.805   6.864  -9.868
  747   HD21  LEU 100          HD21      LEU 100   0.077   5.302  -9.092
  748   HD22  LEU 100          HD22      LEU 100  -0.125   4.966  -7.373
  749   HD23  LEU 100          HD23      LEU 100   1.269   4.321  -8.239
  750    H    ALA 101           H        ALA 101   2.013   8.249  -3.737
  751    HA   ALA 101           HA       ALA 101  -0.075   9.975  -4.780
  752    HB1  ALA 101           HB1      ALA 101   0.697   9.384  -1.924
  753    HB2  ALA 101           HB2      ALA 101  -0.527   8.523  -2.854
  754    HB3  ALA 101           HB3      ALA 101  -0.758  10.226  -2.460
  755    H    LEU 102           H        LEU 102   3.100  10.378  -4.525
  756    HA   LEU 102           HA       LEU 102   3.076  13.008  -3.273
  757    HG   LEU 102           HG       LEU 102   4.553  10.435  -2.331
  758    HB2  LEU 102           HB2      LEU 102   5.336  11.391  -4.451
  759    HB3  LEU 102           HB3      LEU 102   5.527  12.954  -3.680
  760   HD11  LEU 102          HD11      LEU 102   6.922  10.348  -2.862
  761   HD12  LEU 102          HD12      LEU 102   6.679  10.541  -1.125
  762   HD13  LEU 102          HD13      LEU 102   7.164  11.924  -2.106
  763   HD21  LEU 102          HD21      LEU 102   5.137  13.162  -1.182
  764   HD22  LEU 102          HD22      LEU 102   4.680  11.723  -0.268
  765   HD23  LEU 102          HD23      LEU 102   3.535  12.454  -1.394
  766    H    GLU 103           H        GLU 103   3.072  11.587  -6.434
  767    HA   GLU 103           HA       GLU 103   3.950  14.039  -7.691
  768    HB2  GLU 103           HB2      GLU 103   3.514  12.756  -9.833
  769    HB3  GLU 103           HB3      GLU 103   4.776  12.137  -8.784
  770    HG2  GLU 103           HG2      GLU 103   3.746  10.192  -9.287
  771    HG3  GLU 103           HG3      GLU 103   2.778  10.646  -7.888
  772    H    HIS 104           H        HIS 104   0.934  12.298  -7.189
  773    HA   HIS 104           HA       HIS 104  -0.426  14.773  -8.032
  774    HD1  HIS 104           HD1      HIS 104   0.062  11.868 -10.513
  775    HD2  HIS 104           HD2      HIS 104  -2.830  14.853 -10.335
  776    HE1  HIS 104           HE1      HIS 104  -0.164  12.739 -12.866
  777    HE2  HIS 104           HE2      HIS 104  -2.079  14.375 -12.763
  778    HB2  HIS 104           HB2      HIS 104  -1.281  11.914  -8.310
  779    HB3  HIS 104           HB3      HIS 104  -2.502  13.169  -8.124
  780    H    HIS 105           H        HIS 105  -0.281  15.775  -6.099
  781    HA   HIS 105           HA       HIS 105  -1.912  14.657  -3.931
  782    HD1  HIS 105           HD1      HIS 105   0.319  17.384  -1.579
  783    HD2  HIS 105           HD2      HIS 105  -0.899  13.439  -1.056
  784    HE1  HIS 105           HE1      HIS 105  -0.243  17.166   0.862
  785    HE2  HIS 105           HE2      HIS 105  -0.693  14.708   1.194
  786    HB2  HIS 105           HB2      HIS 105   0.465  14.160  -3.429
  787    HB3  HIS 105           HB3      HIS 105   0.846  15.869  -3.580
  788    H    HIS 106           H        HIS 106  -3.551  16.181  -4.361
  789    HA   HIS 106           HA       HIS 106  -3.082  18.967  -4.304
  790    HD1  HIS 106           HD1      HIS 106  -7.573  18.353  -2.739
  791    HD2  HIS 106           HD2      HIS 106  -4.856  15.296  -3.497
  792    HE1  HIS 106           HE1      HIS 106  -8.589  16.274  -1.750
  793    HE2  HIS 106           HE2      HIS 106  -7.052  14.407  -2.454
  794    HB2  HIS 106           HB2      HIS 106  -5.475  19.202  -3.734
  795    HB3  HIS 106           HB3      HIS 106  -5.223  18.118  -5.091
  796    H    HIS 107           H        HIS 107  -3.239  20.445  -2.567
  797    HA   HIS 107           HA       HIS 107  -1.574  19.741  -0.486
  798    HD1  HIS 107           HD1      HIS 107  -2.816  22.339   2.305
  799    HD2  HIS 107           HD2      HIS 107   0.379  22.220  -0.359
  800    HE1  HIS 107           HE1      HIS 107  -0.811  23.102   3.611
  801    HE2  HIS 107           HE2      HIS 107   1.136  22.837   2.041
  802    HB2  HIS 107           HB2      HIS 107  -2.282  22.086  -1.366
  803    HB3  HIS 107           HB3      HIS 107  -3.532  21.985  -0.131
  804    H    HIS 108           H        HIS 108  -5.118  20.101  -0.347
  805    HA   HIS 108           HA       HIS 108  -5.222  18.002   1.635
  806    HD1  HIS 108           HD1      HIS 108  -8.093  20.433   4.121
  807    HD2  HIS 108           HD2      HIS 108  -5.338  17.313   4.175
  808    HE1  HIS 108           HE1      HIS 108  -8.837  18.896   5.976
  809    HE2  HIS 108           HE2      HIS 108  -7.127  17.037   6.026
  810    HB2  HIS 108           HB2      HIS 108  -4.821  20.121   2.955
  811    HB3  HIS 108           HB3      HIS 108  -6.378  20.698   2.370
  812    H    HIS 109           H        HIS 109  -7.232  20.683   0.415
  813    HA   HIS 109           HA       HIS 109  -8.986  18.658  -0.803
  814    HD1  HIS 109           HD1      HIS 109 -12.026  18.286  -0.010
  815    HD2  HIS 109           HD2      HIS 109  -9.592  19.706   3.048
  816    HE1  HIS 109           HE1      HIS 109 -12.663  16.966   2.035
  817    HE2  HIS 109           HE2      HIS 109 -11.000  17.670   3.794
  818    HB2  HIS 109           HB2      HIS 109  -9.762  21.176   0.657
  819    HB3  HIS 109           HB3      HIS 109 -10.811  20.484  -0.573
  Start of MODEL   11
    1    HA   MET   1           HA       MET   1  28.720  15.419  28.386
    2    H1   MET   1           H1       MET   1  29.232  15.457  30.663
    3    H2   MET   1           H2       MET   1  27.851  16.426  30.461
    4    H3   MET   1           H3       MET   1  29.370  17.147  30.691
    5    HB2  MET   1           HB2      MET   1  27.289  17.383  28.287
    6    HB3  MET   1           HB3      MET   1  28.659  18.439  28.599
    7    HG2  MET   1           HG2      MET   1  28.003  18.453  26.247
    8    HG3  MET   1           HG3      MET   1  29.645  17.854  26.474
    9    HE1  MET   1           HE1      MET   1  29.574  16.895  23.961
   10    HE2  MET   1           HE2      MET   1  27.934  17.527  23.811
   11    HE3  MET   1           HE3      MET   1  28.279  15.856  23.367
   12    H    ALA   2           H        ALA   2  30.683  14.454  28.238
   13    HA   ALA   2           HA       ALA   2  32.910  16.180  27.491
   14    HB1  ALA   2           HB1      ALA   2  33.159  14.101  29.662
   15    HB2  ALA   2           HB2      ALA   2  33.211  15.849  29.896
   16    HB3  ALA   2           HB3      ALA   2  34.481  15.043  28.974
   17    H    MET   3           H        MET   3  32.882  15.423  25.431
   18    HA   MET   3           HA       MET   3  34.019  12.810  25.023
   19    HB2  MET   3           HB2      MET   3  32.287  12.060  23.416
   20    HB3  MET   3           HB3      MET   3  31.687  12.175  25.061
   21    HG2  MET   3           HG2      MET   3  30.669  14.353  24.493
   22    HG3  MET   3           HG3      MET   3  31.194  14.128  22.826
   23    HE1  MET   3           HE1      MET   3  30.340  12.026  21.306
   24    HE2  MET   3           HE2      MET   3  29.196  10.824  21.906
   25    HE3  MET   3           HE3      MET   3  30.809  10.935  22.609
   26    H    LYS   4           H        LYS   4  35.657  13.276  23.791
   27    HA   LYS   4           HA       LYS   4  35.607  15.614  22.080
   28    HB2  LYS   4           HB2      LYS   4  37.546  15.084  23.530
   29    HB3  LYS   4           HB3      LYS   4  37.822  13.621  22.599
   30    HG2  LYS   4           HG2      LYS   4  39.354  15.378  21.933
   31    HG3  LYS   4           HG3      LYS   4  38.259  14.966  20.609
   32    HD2  LYS   4           HD2      LYS   4  36.889  16.907  21.115
   33    HD3  LYS   4           HD3      LYS   4  37.927  17.303  22.487
   34    HE2  LYS   4           HE2      LYS   4  39.812  17.628  20.962
   35    HE3  LYS   4           HE3      LYS   4  38.775  17.226  19.592
   36    HZ1  LYS   4           HZ1      LYS   4  37.454  19.152  20.006
   37    HZ2  LYS   4           HZ2      LYS   4  39.080  19.642  19.950
   38    HZ3  LYS   4           HZ3      LYS   4  38.287  19.490  21.444
   39    H    ASP   5           H        ASP   5  35.448  12.167  21.774
   40    HA   ASP   5           HA       ASP   5  35.526  12.421  18.842
   41    HB2  ASP   5           HB2      ASP   5  37.543  11.301  19.663
   42    HB3  ASP   5           HB3      ASP   5  36.559  10.141  20.547
   43    H    VAL   6           H        VAL   6  33.605  12.053  18.008
   44    HA   VAL   6           HA       VAL   6  31.691  10.363  19.425
   45    HB   VAL   6           HB       VAL   6  30.034  11.135  17.780
   46   HG11  VAL   6          HG11      VAL   6  31.617  13.369  19.042
   47   HG12  VAL   6          HG12      VAL   6  30.360  12.411  19.822
   48   HG13  VAL   6          HG13      VAL   6  29.949  13.480  18.482
   49   HG21  VAL   6          HG21      VAL   6  30.579  12.892  16.175
   50   HG22  VAL   6          HG22      VAL   6  31.503  11.427  15.846
   51   HG23  VAL   6          HG23      VAL   6  32.279  12.800  16.636
   52    H    VAL   7           H        VAL   7  31.087   8.381  18.789
   53    HA   VAL   7           HA       VAL   7  32.529   7.251  16.494
   54    HB   VAL   7           HB       VAL   7  31.200   5.802  18.796
   55   HG11  VAL   7          HG11      VAL   7  31.271   4.440  16.799
   56   HG12  VAL   7          HG12      VAL   7  32.457   3.848  17.964
   57   HG13  VAL   7          HG13      VAL   7  32.982   4.802  16.575
   58   HG21  VAL   7          HG21      VAL   7  34.120   6.360  18.287
   59   HG22  VAL   7          HG22      VAL   7  33.469   5.369  19.593
   60   HG23  VAL   7          HG23      VAL   7  33.124   7.099  19.539
   61    H    ASP   8           H        ASP   8  31.455   6.850  14.716
   62    HA   ASP   8           HA       ASP   8  28.848   5.633  14.735
   63    HB2  ASP   8           HB2      ASP   8  28.206   8.017  14.897
   64    HB3  ASP   8           HB3      ASP   8  29.182   8.375  13.476
   65    H    LYS   9           H        LYS   9  28.952   4.130  13.282
   66    HA   LYS   9           HA       LYS   9  31.033   4.331  11.245
   67    HB2  LYS   9           HB2      LYS   9  29.382   1.939  12.061
   68    HB3  LYS   9           HB3      LYS   9  30.797   1.940  11.029
   69    HG2  LYS   9           HG2      LYS   9  32.134   2.764  12.965
   70    HG3  LYS   9           HG3      LYS   9  30.700   2.539  13.969
   71    HD2  LYS   9           HD2      LYS   9  32.034   0.587  14.225
   72    HD3  LYS   9           HD3      LYS   9  30.667   0.141  13.197
   73    HE2  LYS   9           HE2      LYS   9  32.187   0.623  11.227
   74    HE3  LYS   9           HE3      LYS   9  33.513   0.691  12.389
   75    HZ1  LYS   9           HZ1      LYS   9  32.685  -1.600  13.102
   76    HZ2  LYS   9           HZ2      LYS   9  33.519  -1.484  11.632
   77    HZ3  LYS   9           HZ3      LYS   9  31.827  -1.614  11.638
   78    H    CYS  10           H        CYS  10  30.425   5.097   9.357
   79    HA   CYS  10           HA       CYS  10  27.684   4.571   8.445
   80    HG   CYS  10           HG       CYS  10  30.116   8.152   9.048
   81    HB2  CYS  10           HB2      CYS  10  28.076   6.628   6.994
   82    HB3  CYS  10           HB3      CYS  10  27.902   6.900   8.724
   83    H    SER  11           H        SER  11  28.230   2.577   7.483
   84    HA   SER  11           HA       SER  11  30.017   2.565   5.216
   85    HG   SER  11           HG       SER  11  30.425   0.057   4.716
   86    HB2  SER  11           HB2      SER  11  29.504   0.534   6.655
   87    HB3  SER  11           HB3      SER  11  27.902   0.511   5.922
   88    H    THR  12           H        THR  12  29.380   2.727   3.033
   89    HA   THR  12           HA       THR  12  27.045   4.369   2.735
   90    HB   THR  12           HB       THR  12  28.926   3.416   0.573
   91    HG1  THR  12           HG1      THR  12  29.495   4.928   2.632
   92   HG21  THR  12          HG21      THR  12  28.157   5.396  -0.637
   93   HG22  THR  12          HG22      THR  12  27.073   5.805   0.692
   94   HG23  THR  12          HG23      THR  12  26.798   4.339  -0.252
   95    H    LYS  13           H        LYS  13  25.396   2.869   3.239
   96    HA   LYS  13           HA       LYS  13  24.290   1.830   0.815
   97    HB2  LYS  13           HB2      LYS  13  23.758  -0.417   1.721
   98    HB3  LYS  13           HB3      LYS  13  25.473  -0.168   1.447
   99    HG2  LYS  13           HG2      LYS  13  25.883   0.074   3.787
  100    HG3  LYS  13           HG3      LYS  13  24.154   0.089   4.139
  101    HD2  LYS  13           HD2      LYS  13  25.702  -2.223   2.975
  102    HD3  LYS  13           HD3      LYS  13  25.151  -2.086   4.646
  103    HE2  LYS  13           HE2      LYS  13  22.840  -2.084   3.921
  104    HE3  LYS  13           HE3      LYS  13  23.340  -2.096   2.231
  105    HZ1  LYS  13           HZ1      LYS  13  24.385  -4.266   2.625
  106    HZ2  LYS  13           HZ2      LYS  13  22.713  -4.300   2.914
  107    HZ3  LYS  13           HZ3      LYS  13  23.796  -4.256   4.219
  108    H    GLY  14           H        GLY  14  22.667   3.250   1.013
  109    HA2  GLY  14           HA2      GLY  14  20.931   2.979   3.389
  110    HA3  GLY  14           HA3      GLY  14  20.969   4.377   2.321
  111    H    CYS  15           H        CYS  15  20.634   0.866   1.867
  112    HA   CYS  15           HA       CYS  15  18.707   1.334  -0.243
  113    HG   CYS  15           HG       CYS  15  21.189   0.921  -1.171
  114    HB2  CYS  15           HB2      CYS  15  19.780  -1.266   0.865
  115    HB3  CYS  15           HB3      CYS  15  18.815  -1.088  -0.598
  116    H    ALA  16           H        ALA  16  17.103   2.302   1.098
  117    HA   ALA  16           HA       ALA  16  15.332   0.294   2.268
  118    HB1  ALA  16           HB1      ALA  16  16.602   1.240   4.145
  119    HB2  ALA  16           HB2      ALA  16  14.892   1.666   4.230
  120    HB3  ALA  16           HB3      ALA  16  16.071   2.856   3.681
  121    H    ILE  17           H        ILE  17  13.725   0.466   0.819
  122    HA   ILE  17           HA       ILE  17  12.830   3.044  -0.113
  123    HB   ILE  17           HB       ILE  17  12.698   1.270  -1.707
  124   HG12  ILE  17          HG12      ILE  17  10.273   1.282  -2.289
  125   HG13  ILE  17          HG13      ILE  17   9.937   2.013  -0.723
  126   HG21  ILE  17          HG21      ILE  17  12.599  -0.632  -0.224
  127   HG22  ILE  17          HG22      ILE  17  11.282  -0.713  -1.395
  128   HG23  ILE  17          HG23      ILE  17  10.960  -0.202   0.263
  129   HD11  ILE  17          HD11      ILE  17  11.604   3.216  -2.921
  130   HD12  ILE  17          HD12      ILE  17  11.299   3.946  -1.344
  131   HD13  ILE  17          HD13      ILE  17   9.965   3.684  -2.468
  132    H    ASP  18           H        ASP  18  11.575   4.302   1.028
  133    HA   ASP  18           HA       ASP  18   9.325   3.317   2.511
  134    HB2  ASP  18           HB2      ASP  18  11.021   2.805   4.137
  135    HB3  ASP  18           HB3      ASP  18  11.738   4.402   3.962
  136    H    ILE  19           H        ILE  19   7.814   4.827   2.719
  137    HA   ILE  19           HA       ILE  19   8.439   7.531   1.784
  138    HB   ILE  19           HB       ILE  19   5.740   6.197   2.122
  139   HG12  ILE  19          HG12      ILE  19   7.086   5.100   0.391
  140   HG13  ILE  19          HG13      ILE  19   5.740   5.981  -0.323
  141   HG21  ILE  19          HG21      ILE  19   6.474   8.760   0.713
  142   HG22  ILE  19          HG22      ILE  19   5.635   8.640   2.259
  143   HG23  ILE  19          HG23      ILE  19   4.866   8.041   0.789
  144   HD11  ILE  19          HD11      ILE  19   8.612   6.876  -0.224
  145   HD12  ILE  19          HD12      ILE  19   7.276   7.811  -0.893
  146   HD13  ILE  19          HD13      ILE  19   7.740   6.283  -1.638
  147    H    GLY  20           H        GLY  20   7.937   5.783   4.612
  148    HA2  GLY  20           HA2      GLY  20   8.196   6.881   6.736
  149    HA3  GLY  20           HA3      GLY  20   7.344   8.271   6.080
  150    H    THR  21           H        THR  21   5.878   5.429   5.105
  151    HA   THR  21           HA       THR  21   3.654   5.825   6.897
  152    HB   THR  21           HB       THR  21   3.992   3.554   4.951
  153    HG1  THR  21           HG1      THR  21   3.216   6.253   4.493
  154   HG21  THR  21          HG21      THR  21   2.105   3.441   6.541
  155   HG22  THR  21          HG22      THR  21   1.561   3.608   4.871
  156   HG23  THR  21          HG23      THR  21   1.539   5.004   5.950
  157    H    VAL  22           H        VAL  22   4.063   5.180   8.930
  158    HA   VAL  22           HA       VAL  22   5.484   2.643   9.308
  159    HB   VAL  22           HB       VAL  22   6.656   4.496  10.318
  160   HG11  VAL  22          HG11      VAL  22   4.835   6.060  10.624
  161   HG12  VAL  22          HG12      VAL  22   5.680   5.813  12.152
  162   HG13  VAL  22          HG13      VAL  22   4.126   5.030  11.867
  163   HG21  VAL  22          HG21      VAL  22   5.319   2.774  12.404
  164   HG22  VAL  22          HG22      VAL  22   6.800   3.704  12.642
  165   HG23  VAL  22          HG23      VAL  22   6.769   2.371  11.485
  166    H    ILE  23           H        ILE  23   4.424   0.973   9.987
  167    HA   ILE  23           HA       ILE  23   2.176   1.336  11.838
  168    HB   ILE  23           HB       ILE  23   1.133   0.839   9.723
  169   HG12  ILE  23          HG12      ILE  23   1.232  -1.679  11.397
  170   HG13  ILE  23          HG13      ILE  23   0.203  -0.285  11.714
  171   HG21  ILE  23          HG21      ILE  23   3.022  -0.080   8.532
  172   HG22  ILE  23          HG22      ILE  23   1.651  -1.186   8.437
  173   HG23  ILE  23          HG23      ILE  23   2.986  -1.527   9.538
  174   HD11  ILE  23          HD11      ILE  23   0.081  -2.047   9.274
  175   HD12  ILE  23          HD12      ILE  23  -0.963  -0.666   9.609
  176   HD13  ILE  23          HD13      ILE  23  -1.029  -2.092  10.644
  177    H    ASP  24           H        ASP  24   2.323   0.070  13.607
  178    HA   ASP  24           HA       ASP  24   4.812  -1.186  14.108
  179    HB2  ASP  24           HB2      ASP  24   3.368  -0.044  15.830
  180    HB3  ASP  24           HB3      ASP  24   2.304  -1.447  15.772
  181    H    ASN  25           H        ASN  25   1.704  -2.737  14.737
  182    HA   ASN  25           HA       ASN  25   2.170  -4.860  12.882
  183    HB2  ASN  25           HB2      ASN  25   2.644  -6.643  14.306
  184    HB3  ASN  25           HB3      ASN  25   3.630  -5.357  14.993
  185   HD21  ASN  25          HD21      ASN  25   2.878  -4.296  16.891
  186   HD22  ASN  25          HD22      ASN  25   1.783  -5.114  17.951
  187    H    ASP  26           H        ASP  26   0.347  -6.007  12.522
  188    HA   ASP  26           HA       ASP  26  -2.081  -5.621  13.993
  189    HB2  ASP  26           HB2      ASP  26  -1.594  -4.107  11.413
  190    HB3  ASP  26           HB3      ASP  26  -3.216  -4.526  11.945
  191    H    ASN  27           H        ASN  27  -3.660  -5.934  11.512
  192    HA   ASN  27           HA       ASN  27  -3.107  -8.708  10.919
  193    HB2  ASN  27           HB2      ASN  27  -5.171  -8.481   9.454
  194    HB3  ASN  27           HB3      ASN  27  -5.427  -8.234  11.174
  195   HD21  ASN  27          HD21      ASN  27  -3.960  -5.793   9.112
  196   HD22  ASN  27          HD22      ASN  27  -5.302  -4.700   9.153
  197    H    CYS  28           H        CYS  28  -3.478  -9.201   8.427
  198    HA   CYS  28           HA       CYS  28  -1.416  -7.615   7.058
  199    HG   CYS  28           HG       CYS  28  -0.602 -11.619   7.981
  200    HB2  CYS  28           HB2      CYS  28  -2.348 -10.438   6.504
  201    HB3  CYS  28           HB3      CYS  28  -1.047  -9.600   5.664
  202    H    THR  29           H        THR  29  -4.514  -7.431   7.269
  203    HA   THR  29           HA       THR  29  -5.063  -7.271   4.394
  204    HB   THR  29           HB       THR  29  -7.033  -7.149   6.688
  205    HG1  THR  29           HG1      THR  29  -5.945  -9.226   6.377
  206   HG21  THR  29          HG21      THR  29  -8.720  -7.509   4.944
  207   HG22  THR  29          HG22      THR  29  -7.460  -7.477   3.711
  208   HG23  THR  29          HG23      THR  29  -7.812  -6.026   4.650
  209    H    SER  30           H        SER  30  -4.936  -5.321   3.491
  210    HA   SER  30           HA       SER  30  -5.037  -2.960   5.217
  211    HG   SER  30           HG       SER  30  -3.226  -1.121   2.800
  212    HB2  SER  30           HB2      SER  30  -3.089  -3.187   3.717
  213    HB3  SER  30           HB3      SER  30  -4.170  -3.224   2.325
  214    H    LYS  31           H        LYS  31  -6.779  -1.749   5.301
  215    HA   LYS  31           HA       LYS  31  -8.810  -1.947   3.185
  216    HB2  LYS  31           HB2      LYS  31  -8.862  -1.049   6.044
  217    HB3  LYS  31           HB3      LYS  31 -10.063  -0.424   4.933
  218    HG2  LYS  31           HG2      LYS  31 -10.940  -2.295   6.179
  219    HG3  LYS  31           HG3      LYS  31 -10.820  -2.692   4.468
  220    HD2  LYS  31           HD2      LYS  31  -9.042  -4.146   4.806
  221    HD3  LYS  31           HD3      LYS  31  -8.627  -3.428   6.363
  222    HE2  LYS  31           HE2      LYS  31  -9.694  -5.652   6.578
  223    HE3  LYS  31           HE3      LYS  31 -10.601  -4.371   7.378
  224    HZ1  LYS  31           HZ1      LYS  31 -11.224  -5.624   4.760
  225    HZ2  LYS  31           HZ2      LYS  31 -12.049  -4.279   5.384
  226    HZ3  LYS  31           HZ3      LYS  31 -12.110  -5.769   6.194
  227    H    PHE  32           H        PHE  32  -8.551  -0.520   1.634
  228    HA   PHE  32           HA       PHE  32  -7.724   2.216   2.355
  229    HD1  PHE  32           HD1      PHE  32  -5.597   3.554   1.626
  230    HD2  PHE  32           HD2      PHE  32  -7.349   2.164  -1.991
  231    HE1  PHE  32           HE1      PHE  32  -5.018   5.684   0.534
  232    HE2  PHE  32           HE2      PHE  32  -6.776   4.287  -3.088
  233    HZ   PHE  32           HZ       PHE  32  -5.610   6.053  -1.828
  234    HB2  PHE  32           HB2      PHE  32  -5.979   1.059   1.067
  235    HB3  PHE  32           HB3      PHE  32  -7.139   0.710  -0.209
  236    H    SER  33           H        SER  33  -9.305   3.622   2.102
  237    HA   SER  33           HA       SER  33 -11.384   3.066   0.085
  238    HG   SER  33           HG       SER  33 -12.546   2.080   2.370
  239    HB2  SER  33           HB2      SER  33 -11.757   4.809   2.524
  240    HB3  SER  33           HB3      SER  33 -12.997   4.080   1.502
  241    H    ARG  34           H        ARG  34 -11.144   4.362  -1.634
  242    HA   ARG  34           HA       ARG  34 -10.292   7.150  -1.159
  243    HE   ARG  34           HE       ARG  34  -7.549   9.705  -3.706
  244    HB2  ARG  34           HB2      ARG  34  -8.706   5.426  -2.391
  245    HB3  ARG  34           HB3      ARG  34  -9.717   5.812  -3.769
  246    HG2  ARG  34           HG2      ARG  34  -8.305   7.901  -2.133
  247    HG3  ARG  34           HG3      ARG  34  -7.568   7.115  -3.527
  248    HD2  ARG  34           HD2      ARG  34  -9.444   7.917  -4.920
  249    HD3  ARG  34           HD3      ARG  34 -10.093   8.765  -3.517
  250   HH11  ARG  34          HH11      ARG  34 -10.240   9.542  -5.943
  251   HH12  ARG  34          HH12      ARG  34  -9.719  10.916  -6.871
  252   HH21  ARG  34          HH21      ARG  34  -6.889  11.513  -4.877
  253   HH22  ARG  34          HH22      ARG  34  -7.803  12.043  -6.255
  254    H    PHE  35           H        PHE  35 -11.491   8.681  -2.070
  255    HA   PHE  35           HA       PHE  35 -13.975   7.808  -3.342
  256    HD1  PHE  35           HD1      PHE  35 -15.992   8.275  -1.605
  257    HD2  PHE  35           HD2      PHE  35 -12.549  10.300  -0.139
  258    HE1  PHE  35           HE1      PHE  35 -16.572   7.599   0.687
  259    HE2  PHE  35           HE2      PHE  35 -13.125   9.627   2.154
  260    HZ   PHE  35           HZ       PHE  35 -15.137   8.272   2.571
  261    HB2  PHE  35           HB2      PHE  35 -13.176  10.558  -2.363
  262    HB3  PHE  35           HB3      PHE  35 -14.778  10.079  -2.910
  263    H    PHE  36           H        PHE  36 -14.408   8.083  -5.424
  264    HA   PHE  36           HA       PHE  36 -12.570   9.761  -7.005
  265    HD1  PHE  36           HD1      PHE  36 -10.670   8.600  -8.941
  266    HD2  PHE  36           HD2      PHE  36 -12.344   5.882  -6.131
  267    HE1  PHE  36           HE1      PHE  36  -8.428   7.708  -8.476
  268    HE2  PHE  36           HE2      PHE  36 -10.102   4.986  -5.656
  269    HZ   PHE  36           HZ       PHE  36  -8.140   5.902  -6.828
  270    HB2  PHE  36           HB2      PHE  36 -13.733   7.060  -7.687
  271    HB3  PHE  36           HB3      PHE  36 -13.045   8.129  -8.903
  272    H    ALA  37           H        ALA  37 -13.559  10.344  -9.178
  273    HA   ALA  37           HA       ALA  37 -16.007  11.694  -8.711
  274    HB1  ALA  37           HB1      ALA  37 -15.825  12.432 -11.026
  275    HB2  ALA  37           HB2      ALA  37 -14.545  11.253 -11.313
  276    HB3  ALA  37           HB3      ALA  37 -14.280  12.587 -10.191
  277    H    THR  38           H        THR  38 -15.194   9.079 -11.006
  278    HA   THR  38           HA       THR  38 -18.045   8.342 -10.974
  279    HB   THR  38           HB       THR  38 -17.696   7.466 -13.287
  280    HG1  THR  38           HG1      THR  38 -15.766   8.622 -14.316
  281   HG21  THR  38          HG21      THR  38 -17.200  10.424 -12.908
  282   HG22  THR  38          HG22      THR  38 -18.772   9.626 -12.932
  283   HG23  THR  38          HG23      THR  38 -17.780   9.662 -14.388
  284    H    ARG  39           H        ARG  39 -18.459   6.063 -11.560
  285    HA   ARG  39           HA       ARG  39 -16.908   4.269 -10.005
  286    HE   ARG  39           HE       ARG  39 -21.344   3.709 -10.937
  287    HB2  ARG  39           HB2      ARG  39 -18.381   2.549 -10.828
  288    HB3  ARG  39           HB3      ARG  39 -19.333   3.984 -10.489
  289    HG2  ARG  39           HG2      ARG  39 -19.277   4.537 -12.901
  290    HG3  ARG  39           HG3      ARG  39 -18.433   3.017 -13.193
  291    HD2  ARG  39           HD2      ARG  39 -20.766   2.718 -13.657
  292    HD3  ARG  39           HD3      ARG  39 -20.348   1.810 -12.206
  293   HH11  ARG  39          HH11      ARG  39 -22.230   3.240 -14.286
  294   HH12  ARG  39          HH12      ARG  39 -23.833   3.884 -14.092
  295   HH21  ARG  39          HH21      ARG  39 -23.425   4.577 -10.659
  296   HH22  ARG  39          HH22      ARG  39 -24.519   4.624 -12.015
  297    H    GLU  40           H        GLU  40 -16.738   5.379 -13.234
  298    HA   GLU  40           HA       GLU  40 -15.199   3.303 -14.396
  299    HB2  GLU  40           HB2      GLU  40 -15.223   6.250 -15.072
  300    HB3  GLU  40           HB3      GLU  40 -14.685   4.938 -16.110
  301    HG2  GLU  40           HG2      GLU  40 -16.950   4.054 -16.185
  302    HG3  GLU  40           HG3      GLU  40 -17.497   5.343 -15.115
  303    H    GLU  41           H        GLU  41 -14.381   6.377 -12.866
  304    HA   GLU  41           HA       GLU  41 -11.598   6.193 -12.977
  305    HB2  GLU  41           HB2      GLU  41 -13.462   7.527 -11.019
  306    HB3  GLU  41           HB3      GLU  41 -11.717   7.682 -10.898
  307    HG2  GLU  41           HG2      GLU  41 -13.254   8.410 -13.370
  308    HG3  GLU  41           HG3      GLU  41 -12.932   9.548 -12.063
  309    H    ALA  42           H        ALA  42 -13.915   4.604 -10.953
  310    HA   ALA  42           HA       ALA  42 -12.081   3.817  -8.897
  311    HB1  ALA  42           HB1      ALA  42 -13.889   2.435  -8.063
  312    HB2  ALA  42           HB2      ALA  42 -14.784   2.658  -9.566
  313    HB3  ALA  42           HB3      ALA  42 -14.502   4.031  -8.496
  314    H    GLU  43           H        GLU  43 -13.665   2.074 -11.564
  315    HA   GLU  43           HA       GLU  43 -12.264  -0.340 -11.246
  316    HB2  GLU  43           HB2      GLU  43 -13.758   0.922 -13.513
  317    HB3  GLU  43           HB3      GLU  43 -12.837  -0.549 -13.794
  318    HG2  GLU  43           HG2      GLU  43 -14.861  -0.342 -11.593
  319    HG3  GLU  43           HG3      GLU  43 -15.303  -0.788 -13.241
  320    H    SER  44           H        SER  44 -11.502   2.576 -13.048
  321    HA   SER  44           HA       SER  44  -9.274   1.542 -14.430
  322    HG   SER  44           HG       SER  44 -11.480   3.915 -14.882
  323    HB2  SER  44           HB2      SER  44  -9.830   4.394 -13.589
  324    HB3  SER  44           HB3      SER  44  -8.679   3.883 -14.826
  325    H    PHE  45           H        PHE  45  -9.694   2.735 -11.173
  326    HA   PHE  45           HA       PHE  45  -6.876   2.988 -10.662
  327    HD1  PHE  45           HD1      PHE  45  -6.101   4.905  -9.029
  328    HD2  PHE  45           HD2      PHE  45  -8.398   2.200  -6.678
  329    HE1  PHE  45           HE1      PHE  45  -4.528   5.202  -7.157
  330    HE2  PHE  45           HE2      PHE  45  -6.830   2.490  -4.805
  331    HZ   PHE  45           HZ       PHE  45  -4.895   3.991  -5.044
  332    HB2  PHE  45           HB2      PHE  45  -8.584   4.347  -9.480
  333    HB3  PHE  45           HB3      PHE  45  -9.210   2.882  -8.737
  334    H    MET  46           H        MET  46  -9.433   0.663  -9.949
  335    HA   MET  46           HA       MET  46  -7.840  -1.010  -8.308
  336    HB2  MET  46           HB2      MET  46 -10.271  -0.968  -8.137
  337    HB3  MET  46           HB3      MET  46 -10.418  -1.603  -9.769
  338    HG2  MET  46           HG2      MET  46 -10.773  -3.290  -7.998
  339    HG3  MET  46           HG3      MET  46  -9.471  -3.695  -9.114
  340    HE1  MET  46           HE1      MET  46 -10.288  -2.146  -5.579
  341    HE2  MET  46           HE2      MET  46  -9.154  -0.986  -6.272
  342    HE3  MET  46           HE3      MET  46  -8.672  -1.983  -4.898
  343    H    THR  47           H        THR  47  -8.629  -1.090 -11.765
  344    HA   THR  47           HA       THR  47  -7.662  -3.663 -12.294
  345    HB   THR  47           HB       THR  47  -7.652  -1.291 -14.172
  346    HG1  THR  47           HG1      THR  47  -9.749  -1.541 -13.672
  347   HG21  THR  47          HG21      THR  47  -6.304  -3.175 -14.988
  348   HG22  THR  47          HG22      THR  47  -7.775  -2.976 -15.943
  349   HG23  THR  47          HG23      THR  47  -7.673  -4.257 -14.736
  350    H    LYS  48           H        LYS  48  -5.949  -0.529 -12.398
  351    HA   LYS  48           HA       LYS  48  -3.459  -1.768 -13.068
  352    HB2  LYS  48           HB2      LYS  48  -2.449   0.416 -12.763
  353    HB3  LYS  48           HB3      LYS  48  -3.916   0.553 -13.712
  354    HG2  LYS  48           HG2      LYS  48  -4.280   2.301 -12.358
  355    HG3  LYS  48           HG3      LYS  48  -4.913   1.061 -11.278
  356    HD2  LYS  48           HD2      LYS  48  -2.929   1.017 -10.003
  357    HD3  LYS  48           HD3      LYS  48  -2.025   1.904 -11.232
  358    HE2  LYS  48           HE2      LYS  48  -4.318   3.024  -9.625
  359    HE3  LYS  48           HE3      LYS  48  -2.612   3.286  -9.264
  360    HZ1  LYS  48           HZ1      LYS  48  -2.380   4.330 -11.465
  361    HZ2  LYS  48           HZ2      LYS  48  -3.493   5.151 -10.484
  362    HZ3  LYS  48           HZ3      LYS  48  -4.048   4.143 -11.729
  363    H    LEU  49           H        LEU  49  -5.135  -1.011 -10.123
  364    HA   LEU  49           HA       LEU  49  -3.023  -1.292  -8.293
  365    HG   LEU  49           HG       LEU  49  -5.680  -0.169  -6.091
  366    HB2  LEU  49           HB2      LEU  49  -5.913  -1.224  -8.219
  367    HB3  LEU  49           HB3      LEU  49  -5.296  -2.415  -7.092
  368   HD11  LEU  49          HD11      LEU  49  -3.538  -0.068  -4.911
  369   HD12  LEU  49          HD12      LEU  49  -2.833  -1.150  -6.113
  370   HD13  LEU  49          HD13      LEU  49  -4.131  -1.721  -5.065
  371   HD21  LEU  49          HD21      LEU  49  -5.041   1.209  -7.992
  372   HD22  LEU  49          HD22      LEU  49  -3.379   0.634  -7.870
  373   HD23  LEU  49          HD23      LEU  49  -4.072   1.614  -6.576
  374    H    LYS  50           H        LYS  50  -4.904  -3.652 -10.066
  375    HA   LYS  50           HA       LYS  50  -4.156  -5.978  -8.700
  376    HB2  LYS  50           HB2      LYS  50  -5.209  -5.331 -11.374
  377    HB3  LYS  50           HB3      LYS  50  -4.291  -6.825 -11.295
  378    HG2  LYS  50           HG2      LYS  50  -6.637  -7.271 -10.979
  379    HG3  LYS  50           HG3      LYS  50  -5.756  -7.614  -9.491
  380    HD2  LYS  50           HD2      LYS  50  -6.472  -5.469  -8.570
  381    HD3  LYS  50           HD3      LYS  50  -7.325  -5.104 -10.071
  382    HE2  LYS  50           HE2      LYS  50  -7.929  -7.358  -8.156
  383    HE3  LYS  50           HE3      LYS  50  -8.889  -5.899  -8.398
  384    HZ1  LYS  50           HZ1      LYS  50  -9.934  -7.598  -9.630
  385    HZ2  LYS  50           HZ2      LYS  50  -8.471  -8.138 -10.300
  386    HZ3  LYS  50           HZ3      LYS  50  -9.120  -6.644 -10.776
  387    H    GLU  51           H        GLU  51  -2.473  -4.068 -11.127
  388    HA   GLU  51           HA       GLU  51  -0.320  -5.846 -11.560
  389    HB2  GLU  51           HB2      GLU  51  -0.516  -2.848 -11.804
  390    HB3  GLU  51           HB3      GLU  51   0.897  -3.772 -12.298
  391    HG2  GLU  51           HG2      GLU  51  -1.854  -4.290 -13.381
  392    HG3  GLU  51           HG3      GLU  51  -0.725  -3.154 -14.108
  393    H    LEU  52           H        LEU  52  -0.859  -3.204  -9.299
  394    HA   LEU  52           HA       LEU  52   1.675  -3.187  -8.092
  395    HG   LEU  52           HG       LEU  52  -0.461  -1.045  -8.917
  396    HB2  LEU  52           HB2      LEU  52  -1.014  -2.416  -6.963
  397    HB3  LEU  52           HB3      LEU  52   0.526  -2.016  -6.233
  398   HD11  LEU  52          HD11      LEU  52  -0.097   0.368  -6.279
  399   HD12  LEU  52          HD12      LEU  52  -1.630  -0.003  -7.070
  400   HD13  LEU  52          HD13      LEU  52  -0.513   1.147  -7.806
  401   HD21  LEU  52          HD21      LEU  52   1.537   0.382  -8.905
  402   HD22  LEU  52          HD22      LEU  52   1.966  -1.329  -8.921
  403   HD23  LEU  52          HD23      LEU  52   2.088  -0.401  -7.426
  404    H    ALA  53           H        ALA  53  -1.345  -4.792  -7.116
  405    HA   ALA  53           HA       ALA  53  -0.335  -5.964  -4.766
  406    HB1  ALA  53           HB1      ALA  53  -2.304  -7.424  -4.870
  407    HB2  ALA  53           HB2      ALA  53  -2.613  -6.882  -6.521
  408    HB3  ALA  53           HB3      ALA  53  -2.717  -5.738  -5.182
  409    H    ALA  54           H        ALA  54  -0.450  -7.121  -8.092
  410    HA   ALA  54           HA       ALA  54   0.345  -9.768  -7.630
  411    HB1  ALA  54           HB1      ALA  54  -0.605  -9.011  -9.752
  412    HB2  ALA  54           HB2      ALA  54   0.939  -9.827  -9.995
  413    HB3  ALA  54           HB3      ALA  54   0.851  -8.068 -10.071
  414    H    ALA  55           H        ALA  55   2.241  -6.845  -8.209
  415    HA   ALA  55           HA       ALA  55   4.740  -8.285  -8.224
  416    HB1  ALA  55           HB1      ALA  55   5.758  -6.075  -8.455
  417    HB2  ALA  55           HB2      ALA  55   4.194  -5.320  -8.148
  418    HB3  ALA  55           HB3      ALA  55   4.432  -6.292  -9.599
  419    H    ALA  56           H        ALA  56   2.783  -6.619  -5.889
  420    HA   ALA  56           HA       ALA  56   4.849  -6.208  -3.964
  421    HB1  ALA  56           HB1      ALA  56   2.827  -4.848  -3.950
  422    HB2  ALA  56           HB2      ALA  56   3.030  -5.684  -2.410
  423    HB3  ALA  56           HB3      ALA  56   1.856  -6.275  -3.587
  424    H    SER  57           H        SER  57   2.193  -8.578  -4.175
  425    HA   SER  57           HA       SER  57   3.317 -10.053  -1.942
  426    HG   SER  57           HG       SER  57   1.624 -11.696  -1.096
  427    HB2  SER  57           HB2      SER  57   0.892  -9.738  -2.015
  428    HB3  SER  57           HB3      SER  57   0.826 -10.546  -3.581
  429    H    SER  58           H        SER  58   2.142 -11.010  -5.126
  430    HA   SER  58           HA       SER  58   2.867 -12.496  -6.676
  431    HG   SER  58           HG       SER  58   4.209 -10.663  -6.926
  432    HB2  SER  58           HB2      SER  58   5.495 -12.334  -5.188
  433    HB3  SER  58           HB3      SER  58   5.255 -13.066  -6.774
  434    H    ALA  59           H        ALA  59   1.984 -13.299  -3.809
  435    HA   ALA  59           HA       ALA  59   3.072 -15.800  -3.199
  436    HB1  ALA  59           HB1      ALA  59   1.626 -14.569  -1.659
  437    HB2  ALA  59           HB2      ALA  59   1.034 -16.209  -1.922
  438    HB3  ALA  59           HB3      ALA  59   0.248 -14.848  -2.722
  439    H    ASP  60           H        ASP  60  -0.268 -15.580  -4.381
  440    HA   ASP  60           HA       ASP  60   0.294 -17.809  -6.192
  441    HB2  ASP  60           HB2      ASP  60  -1.617 -18.235  -4.801
  442    HB3  ASP  60           HB3      ASP  60  -2.314 -16.663  -5.182
  443    H    GLU  61           H        GLU  61  -1.724 -14.914  -6.258
  444    HA   GLU  61           HA       GLU  61  -0.578 -14.266  -8.891
  445    HB2  GLU  61           HB2      GLU  61  -2.899 -15.001  -9.150
  446    HB3  GLU  61           HB3      GLU  61  -3.422 -13.844  -7.936
  447    HG2  GLU  61           HG2      GLU  61  -2.837 -12.004  -9.370
  448    HG3  GLU  61           HG3      GLU  61  -2.156 -13.108 -10.565
  449    H    GLY  62           H        GLY  62  -1.316 -13.348  -5.683
  450    HA2  GLY  62           HA2      GLY  62   0.236 -11.366  -5.108
  451    HA3  GLY  62           HA3      GLY  62  -0.764 -10.514  -6.274
  452    H    ALA  63           H        ALA  63  -1.000 -12.446  -3.321
  453    HA   ALA  63           HA       ALA  63  -2.239 -12.246  -1.440
  454    HB1  ALA  63           HB1      ALA  63  -2.685  -9.411  -2.372
  455    HB2  ALA  63           HB2      ALA  63  -1.344  -9.971  -1.372
  456    HB3  ALA  63           HB3      ALA  63  -2.993 -10.030  -0.751
  457    H    SER  64           H        SER  64  -4.564 -11.235  -0.722
  458    HA   SER  64           HA       SER  64  -6.474 -12.151  -2.766
  459    HG   SER  64           HG       SER  64  -6.268 -14.115   0.209
  460    HB2  SER  64           HB2      SER  64  -6.726 -12.051   0.251
  461    HB3  SER  64           HB3      SER  64  -8.007 -12.554  -0.849
  462    H    VAL  65           H        VAL  65  -7.728 -10.634  -3.661
  463    HA   VAL  65           HA       VAL  65  -7.885  -8.038  -2.294
  464    HB   VAL  65           HB       VAL  65  -6.812  -7.803  -4.420
  465   HG11  VAL  65          HG11      VAL  65  -9.223  -9.140  -5.646
  466   HG12  VAL  65          HG12      VAL  65  -7.595  -9.809  -5.534
  467   HG13  VAL  65          HG13      VAL  65  -7.896  -8.392  -6.538
  468   HG21  VAL  65          HG21      VAL  65  -8.326  -6.007  -3.775
  469   HG22  VAL  65          HG22      VAL  65  -9.657  -6.814  -4.603
  470   HG23  VAL  65          HG23      VAL  65  -8.286  -6.199  -5.527
  471    H    ALA  66           H        ALA  66  -9.683  -7.671  -1.285
  472    HA   ALA  66           HA       ALA  66 -12.212  -8.408  -2.605
  473    HB1  ALA  66           HB1      ALA  66 -11.977  -9.592  -0.495
  474    HB2  ALA  66           HB2      ALA  66 -13.248  -8.375  -0.366
  475    HB3  ALA  66           HB3      ALA  66 -11.662  -8.074   0.347
  476    H    TYR  67           H        TYR  67 -12.688  -6.568  -3.720
  477    HA   TYR  67           HA       TYR  67 -12.581  -4.049  -2.207
  478    HD1  TYR  67           HD2      TYR  67 -11.651  -6.119  -5.844
  479    HD2  TYR  67           HD1      TYR  67 -13.137  -2.128  -5.790
  480    HE1  TYR  67           HE2      TYR  67 -12.449  -6.388  -8.157
  481    HE2  TYR  67           HE1      TYR  67 -13.936  -2.388  -8.099
  482    HH   TYR  67           HH       TYR  67 -13.502  -3.743 -10.066
  483    HB2  TYR  67           HB2      TYR  67 -11.746  -2.875  -4.037
  484    HB3  TYR  67           HB3      TYR  67 -10.878  -4.399  -4.145
  485    H    LYS  68           H        LYS  68 -14.129  -2.447  -2.809
  486    HA   LYS  68           HA       LYS  68 -16.352  -3.406  -4.458
  487    HB2  LYS  68           HB2      LYS  68 -16.624  -2.134  -1.743
  488    HB3  LYS  68           HB3      LYS  68 -17.942  -2.235  -2.901
  489    HG2  LYS  68           HG2      LYS  68 -17.212  -4.800  -2.853
  490    HG3  LYS  68           HG3      LYS  68 -16.729  -4.316  -1.233
  491    HD2  LYS  68           HD2      LYS  68 -18.966  -5.081  -1.065
  492    HD3  LYS  68           HD3      LYS  68 -19.027  -3.322  -0.957
  493    HE2  LYS  68           HE2      LYS  68 -19.601  -3.193  -3.331
  494    HE3  LYS  68           HE3      LYS  68 -19.534  -4.950  -3.447
  495    HZ1  LYS  68           HZ1      LYS  68 -21.450  -3.369  -1.816
  496    HZ2  LYS  68           HZ2      LYS  68 -21.364  -5.062  -1.840
  497    HZ3  LYS  68           HZ3      LYS  68 -21.796  -4.215  -3.245
  498    H    ILE  69           H        ILE  69 -17.759  -1.731  -5.167
  499    HA   ILE  69           HA       ILE  69 -16.543   0.955  -5.241
  500    HB   ILE  69           HB       ILE  69 -17.963  -0.407  -7.543
  501   HG12  ILE  69          HG12      ILE  69 -15.054   0.366  -7.229
  502   HG13  ILE  69          HG13      ILE  69 -15.689  -1.275  -7.170
  503   HG21  ILE  69          HG21      ILE  69 -17.399   1.589  -8.828
  504   HG22  ILE  69          HG22      ILE  69 -16.665   2.313  -7.397
  505   HG23  ILE  69          HG23      ILE  69 -18.400   1.998  -7.434
  506   HD11  ILE  69          HD11      ILE  69 -16.404  -1.081  -9.489
  507   HD12  ILE  69          HD12      ILE  69 -14.673  -0.795  -9.316
  508   HD13  ILE  69          HD13      ILE  69 -15.773   0.564  -9.549
  509    H    LYS  70           H        LYS  70 -17.866   2.083  -3.942
  510    HA   LYS  70           HA       LYS  70 -20.723   1.484  -3.961
  511    HB2  LYS  70           HB2      LYS  70 -19.555   1.708  -1.800
  512    HB3  LYS  70           HB3      LYS  70 -19.169   3.374  -2.194
  513    HG2  LYS  70           HG2      LYS  70 -21.536   3.927  -2.234
  514    HG3  LYS  70           HG3      LYS  70 -21.940   2.249  -1.870
  515    HD2  LYS  70           HD2      LYS  70 -20.735   2.426   0.258
  516    HD3  LYS  70           HD3      LYS  70 -20.342   4.107  -0.106
  517    HE2  LYS  70           HE2      LYS  70 -22.758   4.616  -0.181
  518    HE3  LYS  70           HE3      LYS  70 -23.103   2.947   0.269
  519    HZ1  LYS  70           HZ1      LYS  70 -21.933   3.291   2.346
  520    HZ2  LYS  70           HZ2      LYS  70 -23.172   4.439   2.180
  521    HZ3  LYS  70           HZ3      LYS  70 -21.560   4.889   1.910
  522    H    ASP  71           H        ASP  71 -22.004   2.543  -5.202
  523    HA   ASP  71           HA       ASP  71 -21.158   4.882  -6.641
  524    HB2  ASP  71           HB2      ASP  71 -22.620   3.069  -7.612
  525    HB3  ASP  71           HB3      ASP  71 -23.921   3.643  -6.574
  526    H    LEU  72           H        LEU  72 -21.097   6.768  -5.595
  527    HA   LEU  72           HA       LEU  72 -23.083   7.312  -3.505
  528    HG   LEU  72           HG       LEU  72 -20.136   6.417  -3.079
  529    HB2  LEU  72           HB2      LEU  72 -20.442   8.641  -4.110
  530    HB3  LEU  72           HB3      LEU  72 -21.513   9.090  -2.798
  531   HD11  LEU  72          HD11      LEU  72 -18.788   7.181  -1.165
  532   HD12  LEU  72          HD12      LEU  72 -19.550   8.768  -1.281
  533   HD13  LEU  72          HD13      LEU  72 -18.539   8.176  -2.598
  534   HD21  LEU  72          HD21      LEU  72 -21.810   7.576  -0.855
  535   HD22  LEU  72          HD22      LEU  72 -20.920   6.055  -0.777
  536   HD23  LEU  72          HD23      LEU  72 -22.258   6.237  -1.912
  537    H    GLU  73           H        GLU  73 -23.148   9.963  -3.350
  538    HA   GLU  73           HA       GLU  73 -24.484  10.667  -5.854
  539    HB2  GLU  73           HB2      GLU  73 -25.415  12.572  -4.461
  540    HB3  GLU  73           HB3      GLU  73 -25.915  10.953  -3.995
  541    HG2  GLU  73           HG2      GLU  73 -24.131  11.000  -2.245
  542    HG3  GLU  73           HG3      GLU  73 -23.874  12.696  -2.644
  543    H    GLY  74           H        GLY  74 -22.995  11.400  -7.245
  544    HA2  GLY  74           HA2      GLY  74 -21.850  13.228  -8.188
  545    HA3  GLY  74           HA3      GLY  74 -21.711  13.942  -6.589
  546    H    GLN  75           H        GLN  75 -20.882  10.727  -6.447
  547    HA   GLN  75           HA       GLN  75 -18.230  10.738  -7.420
  548    HB2  GLN  75           HB2      GLN  75 -17.052  10.708  -5.233
  549    HB3  GLN  75           HB3      GLN  75 -17.789  12.266  -5.576
  550    HG2  GLN  75           HG2      GLN  75 -19.683  11.650  -4.116
  551    HG3  GLN  75           HG3      GLN  75 -18.847  10.150  -3.717
  552   HE21  GLN  75          HE21      GLN  75 -17.017  10.222  -2.417
  553   HE22  GLN  75          HE22      GLN  75 -16.608  11.613  -1.472
  554    H    VAL  76           H        VAL  76 -17.007   8.801  -6.230
  555    HA   VAL  76           HA       VAL  76 -18.939   6.768  -5.361
  556    HB   VAL  76           HB       VAL  76 -17.803   5.025  -6.660
  557   HG11  VAL  76          HG11      VAL  76 -18.829   7.292  -8.356
  558   HG12  VAL  76          HG12      VAL  76 -19.802   6.037  -7.592
  559   HG13  VAL  76          HG13      VAL  76 -18.667   5.615  -8.874
  560   HG21  VAL  76          HG21      VAL  76 -16.275   7.306  -7.902
  561   HG22  VAL  76          HG22      VAL  76 -16.263   5.639  -8.474
  562   HG23  VAL  76          HG23      VAL  76 -15.612   6.028  -6.882
  563    H    GLU  77           H        GLU  77 -18.033   5.092  -4.099
  564    HA   GLU  77           HA       GLU  77 -15.511   5.868  -2.806
  565    HB2  GLU  77           HB2      GLU  77 -17.428   5.710  -1.295
  566    HB3  GLU  77           HB3      GLU  77 -17.762   4.075  -1.850
  567    HG2  GLU  77           HG2      GLU  77 -15.489   3.437  -0.969
  568    HG3  GLU  77           HG3      GLU  77 -15.426   5.031  -0.217
  569    H    LEU  78           H        LEU  78 -13.804   4.801  -3.620
  570    HA   LEU  78           HA       LEU  78 -14.130   2.035  -4.503
  571    HG   LEU  78           HG       LEU  78 -11.169   2.321  -6.664
  572    HB2  LEU  78           HB2      LEU  78 -12.834   3.734  -5.861
  573    HB3  LEU  78           HB3      LEU  78 -11.641   3.748  -4.580
  574   HD11  LEU  78          HD11      LEU  78 -10.988   1.067  -3.925
  575   HD12  LEU  78          HD12      LEU  78  -9.828   2.189  -4.634
  576   HD13  LEU  78          HD13      LEU  78 -10.051   0.588  -5.341
  577   HD21  LEU  78          HD21      LEU  78 -13.348   1.264  -6.833
  578   HD22  LEU  78          HD22      LEU  78 -13.121   0.512  -5.254
  579   HD23  LEU  78          HD23      LEU  78 -12.084   0.055  -6.606
  580    H    ASP  79           H        ASP  79 -14.002   0.564  -2.987
  581    HA   ASP  79           HA       ASP  79 -12.375   1.137  -0.593
  582    HB2  ASP  79           HB2      ASP  79 -14.913   1.002  -0.323
  583    HB3  ASP  79           HB3      ASP  79 -14.759  -0.708  -0.699
  584    H    ALA  80           H        ALA  80 -10.581  -0.035  -0.585
  585    HA   ALA  80           HA       ALA  80 -10.666  -2.689  -1.858
  586    HB1  ALA  80           HB1      ALA  80  -9.217  -1.085  -2.998
  587    HB2  ALA  80           HB2      ALA  80  -8.288  -2.416  -2.308
  588    HB3  ALA  80           HB3      ALA  80  -8.307  -0.845  -1.506
  589    H    ALA  81           H        ALA  81 -10.132  -4.426  -0.711
  590    HA   ALA  81           HA       ALA  81  -8.630  -4.092   1.789
  591    HB1  ALA  81           HB1      ALA  81 -10.956  -4.584   2.335
  592    HB2  ALA  81           HB2      ALA  81  -9.912  -5.941   2.762
  593    HB3  ALA  81           HB3      ALA  81 -10.905  -6.016   1.307
  594    H    PHE  82           H        PHE  82  -6.682  -4.845   1.302
  595    HA   PHE  82           HA       PHE  82  -6.445  -7.262  -0.362
  596    HD1  PHE  82           HD2      PHE  82  -5.784  -3.366  -0.793
  597    HD2  PHE  82           HD1      PHE  82  -4.672  -6.936  -2.832
  598    HE1  PHE  82           HE2      PHE  82  -6.371  -2.321  -2.939
  599    HE2  PHE  82           HE1      PHE  82  -5.257  -5.892  -4.984
  600    HZ   PHE  82           HZ       PHE  82  -6.106  -3.584  -5.037
  601    HB2  PHE  82           HB2      PHE  82  -4.458  -5.081   0.300
  602    HB3  PHE  82           HB3      PHE  82  -4.021  -6.563  -0.538
  603    H    THR  83           H        THR  83  -6.206  -9.071   0.741
  604    HA   THR  83           HA       THR  83  -4.882  -9.018   3.352
  605    HB   THR  83           HB       THR  83  -6.364 -11.283   1.992
  606    HG1  THR  83           HG1      THR  83  -7.163  -9.615   4.175
  607   HG21  THR  83          HG21      THR  83  -5.359 -11.021   4.833
  608   HG22  THR  83          HG22      THR  83  -4.667 -12.064   3.588
  609   HG23  THR  83          HG23      THR  83  -6.299 -12.366   4.185
  610    H    PHE  84           H        PHE  84  -2.746  -9.152   3.209
  611    HA   PHE  84           HA       PHE  84  -1.499 -10.709   1.088
  612    HD1  PHE  84           HD2      PHE  84  -1.726  -7.022   2.676
  613    HD2  PHE  84           HD1      PHE  84   0.541  -9.018  -0.324
  614    HE1  PHE  84           HE2      PHE  84  -2.094  -5.132   1.143
  615    HE2  PHE  84           HE1      PHE  84   0.178  -7.133  -1.858
  616    HZ   PHE  84           HZ       PHE  84  -1.143  -5.191  -1.129
  617    HB2  PHE  84           HB2      PHE  84  -0.316  -8.917   3.218
  618    HB3  PHE  84           HB3      PHE  84   0.619  -9.741   1.973
  619    H    SER  85           H        SER  85   0.533 -11.967   1.829
  620    HA   SER  85           HA       SER  85  -0.389 -14.046   3.566
  621    HG   SER  85           HG       SER  85   1.636 -13.344   0.761
  622    HB2  SER  85           HB2      SER  85   2.464 -13.821   2.681
  623    HB3  SER  85           HB3      SER  85   1.441 -15.253   2.799
  624    H    CYS  86           H        CYS  86   2.228 -11.663   3.686
  625    HA   CYS  86           HA       CYS  86   2.033 -11.698   6.616
  626    HG   CYS  86           HG       CYS  86   2.959 -14.188   6.101
  627    HB2  CYS  86           HB2      CYS  86   4.608 -11.614   5.021
  628    HB3  CYS  86           HB3      CYS  86   4.485 -11.426   6.768
  629    H    GLN  87           H        GLN  87   2.817  -9.692   7.605
  630    HA   GLN  87           HA       GLN  87   1.652  -7.458   6.397
  631    HB2  GLN  87           HB2      GLN  87   1.793  -7.593   8.784
  632    HB3  GLN  87           HB3      GLN  87   3.546  -7.685   8.734
  633    HG2  GLN  87           HG2      GLN  87   3.770  -5.427   8.198
  634    HG3  GLN  87           HG3      GLN  87   2.085  -5.274   7.709
  635   HE21  GLN  87          HE21      GLN  87   0.491  -5.102   9.309
  636   HE22  GLN  87          HE22      GLN  87   0.884  -4.661  10.932
  637    H    ALA  88           H        ALA  88   4.856  -8.712   6.120
  638    HA   ALA  88           HA       ALA  88   6.316  -6.457   5.387
  639    HB1  ALA  88           HB1      ALA  88   7.818  -7.985   4.243
  640    HB2  ALA  88           HB2      ALA  88   6.589  -9.248   4.277
  641    HB3  ALA  88           HB3      ALA  88   7.301  -8.672   5.783
  642    H    GLU  89           H        GLU  89   4.190  -8.517   3.453
  643    HA   GLU  89           HA       GLU  89   4.734  -7.217   0.961
  644    HB2  GLU  89           HB2      GLU  89   2.345  -8.894   1.791
  645    HB3  GLU  89           HB3      GLU  89   2.800  -8.488   0.140
  646    HG2  GLU  89           HG2      GLU  89   4.519  -9.980   0.102
  647    HG3  GLU  89           HG3      GLU  89   4.780  -9.900   1.843
  648    H    MET  90           H        MET  90   2.559  -6.661   3.618
  649    HA   MET  90           HA       MET  90   0.722  -5.025   2.151
  650    HB2  MET  90           HB2      MET  90   0.124  -6.286   4.232
  651    HB3  MET  90           HB3      MET  90   1.107  -5.147   5.143
  652    HG2  MET  90           HG2      MET  90  -0.338  -3.314   4.362
  653    HG3  MET  90           HG3      MET  90  -1.342  -4.488   3.516
  654    HE1  MET  90           HE1      MET  90   0.394  -4.653   7.064
  655    HE2  MET  90           HE2      MET  90  -0.937  -4.124   8.094
  656    HE3  MET  90           HE3      MET  90  -0.226  -3.008   6.927
  657    H    ILE  91           H        ILE  91   3.375  -4.382   4.433
  658    HA   ILE  91           HA       ILE  91   3.041  -1.596   4.452
  659    HB   ILE  91           HB       ILE  91   5.444  -1.548   5.260
  660   HG12  ILE  91          HG12      ILE  91   5.093  -4.547   5.315
  661   HG13  ILE  91          HG13      ILE  91   6.099  -3.698   4.153
  662   HG21  ILE  91          HG21      ILE  91   3.441  -3.276   6.698
  663   HG22  ILE  91          HG22      ILE  91   3.560  -1.518   6.775
  664   HG23  ILE  91          HG23      ILE  91   4.852  -2.519   7.438
  665   HD11  ILE  91          HD11      ILE  91   7.479  -2.844   5.996
  666   HD12  ILE  91          HD12      ILE  91   7.442  -4.607   5.942
  667   HD13  ILE  91          HD13      ILE  91   6.477  -3.743   7.136
  668    H    ILE  92           H        ILE  92   5.094  -3.669   2.393
  669    HA   ILE  92           HA       ILE  92   6.327  -1.515   1.036
  670    HB   ILE  92           HB       ILE  92   6.883  -3.136  -0.729
  671   HG12  ILE  92          HG12      ILE  92   5.387  -5.186   0.897
  672   HG13  ILE  92          HG13      ILE  92   4.752  -4.443  -0.572
  673   HG21  ILE  92          HG21      ILE  92   8.289  -4.599   0.614
  674   HG22  ILE  92          HG22      ILE  92   7.356  -4.175   2.049
  675   HG23  ILE  92          HG23      ILE  92   8.309  -2.945   1.223
  676   HD11  ILE  92          HD11      ILE  92   7.309  -6.024  -0.425
  677   HD12  ILE  92          HD12      ILE  92   6.537  -5.382  -1.877
  678   HD13  ILE  92          HD13      ILE  92   5.752  -6.664  -0.954
  679    H    PHE  93           H        PHE  93   3.299  -3.181   0.645
  680    HA   PHE  93           HA       PHE  93   2.630  -2.194  -1.922
  681    HD1  PHE  93           HD2      PHE  93   0.979  -3.673  -3.324
  682    HD2  PHE  93           HD1      PHE  93  -1.276  -2.209  -0.024
  683    HE1  PHE  93           HE2      PHE  93  -0.970  -3.380  -4.792
  684    HE2  PHE  93           HE1      PHE  93  -3.232  -1.914  -1.488
  685    HZ   PHE  93           HZ       PHE  93  -3.075  -2.498  -3.874
  686    HB2  PHE  93           HB2      PHE  93   1.547  -4.149  -0.858
  687    HB3  PHE  93           HB3      PHE  93   0.825  -3.086   0.341
  688    H    GLU  94           H        GLU  94   1.778  -1.142   1.364
  689    HA   GLU  94           HA       GLU  94   0.270   1.098   0.722
  690    HB2  GLU  94           HB2      GLU  94   2.111   0.622   3.068
  691    HB3  GLU  94           HB3      GLU  94   0.995   1.975   2.958
  692    HG2  GLU  94           HG2      GLU  94   0.188  -0.920   2.887
  693    HG3  GLU  94           HG3      GLU  94   0.146   0.106   4.321
  694    H    LEU  95           H        LEU  95   3.781   0.816   1.158
  695    HA   LEU  95           HA       LEU  95   4.395   3.530   0.779
  696    HG   LEU  95           HG       LEU  95   5.440   1.136   2.512
  697    HB2  LEU  95           HB2      LEU  95   6.081   1.110   0.122
  698    HB3  LEU  95           HB3      LEU  95   6.670   2.754   0.278
  699   HD11  LEU  95          HD11      LEU  95   8.313   1.879   1.990
  700   HD12  LEU  95          HD12      LEU  95   7.615   0.267   1.830
  701   HD13  LEU  95          HD13      LEU  95   7.702   1.040   3.414
  702   HD21  LEU  95          HD21      LEU  95   6.211   2.952   3.953
  703   HD22  LEU  95          HD22      LEU  95   5.057   3.539   2.755
  704   HD23  LEU  95          HD23      LEU  95   6.781   3.839   2.539
  705    H    SER  96           H        SER  96   4.212   0.830  -1.508
  706    HA   SER  96           HA       SER  96   5.035   2.228  -3.795
  707    HG   SER  96           HG       SER  96   5.200  -0.661  -2.722
  708    HB2  SER  96           HB2      SER  96   3.203  -0.172  -3.569
  709    HB3  SER  96           HB3      SER  96   3.972   0.381  -5.056
  710    H    LEU  97           H        LEU  97   1.894   1.930  -2.253
  711    HA   LEU  97           HA       LEU  97   0.305   3.038  -4.287
  712    HG   LEU  97           HG       LEU  97  -0.078   0.886  -2.036
  713    HB2  LEU  97           HB2      LEU  97  -0.026   3.221  -1.292
  714    HB3  LEU  97           HB3      LEU  97  -1.263   3.630  -2.466
  715   HD11  LEU  97          HD11      LEU  97  -2.322   0.329  -1.203
  716   HD12  LEU  97          HD12      LEU  97  -2.787   2.024  -1.351
  717   HD13  LEU  97          HD13      LEU  97  -1.525   1.550  -0.212
  718   HD21  LEU  97          HD21      LEU  97  -2.295   1.799  -3.867
  719   HD22  LEU  97          HD22      LEU  97  -1.804   0.127  -3.591
  720   HD23  LEU  97          HD23      LEU  97  -0.693   1.257  -4.367
  721    H    ARG  98           H        ARG  98   2.005   4.558  -1.567
  722    HA   ARG  98           HA       ARG  98   1.198   7.201  -2.173
  723    HE   ARG  98           HE       ARG  98  -0.141   7.017   2.077
  724    HB2  ARG  98           HB2      ARG  98   3.376   6.019  -0.493
  725    HB3  ARG  98           HB3      ARG  98   3.387   7.743  -0.825
  726    HG2  ARG  98           HG2      ARG  98   2.339   7.331   1.294
  727    HG3  ARG  98           HG3      ARG  98   1.131   7.915   0.150
  728    HD2  ARG  98           HD2      ARG  98   0.389   5.613  -0.220
  729    HD3  ARG  98           HD3      ARG  98   1.588   5.042   0.940
  730   HH11  ARG  98          HH11      ARG  98   0.087   3.622   1.241
  731   HH12  ARG  98          HH12      ARG  98  -1.082   3.109   2.427
  732   HH21  ARG  98          HH21      ARG  98  -1.667   6.349   3.652
  733   HH22  ARG  98          HH22      ARG  98  -2.083   4.665   3.790
  734    H    SER  99           H        SER  99   3.968   5.249  -3.118
  735    HA   SER  99           HA       SER  99   5.369   7.351  -4.430
  736    HG   SER  99           HG       SER  99   6.299   5.992  -2.763
  737    HB2  SER  99           HB2      SER  99   5.628   4.363  -4.842
  738    HB3  SER  99           HB3      SER  99   6.814   5.591  -5.288
  739    H    LEU 100           H        LEU 100   2.586   5.658  -5.285
  740    HA   LEU 100           HA       LEU 100   3.053   5.878  -8.153
  741    HG   LEU 100           HG       LEU 100   1.294   4.955  -9.567
  742    HB2  LEU 100           HB2      LEU 100   1.897   3.910  -7.194
  743    HB3  LEU 100           HB3      LEU 100   0.594   4.955  -6.669
  744   HD11  LEU 100          HD11      LEU 100  -0.199   3.032  -9.939
  745   HD12  LEU 100          HD12      LEU 100  -0.259   2.768  -8.196
  746   HD13  LEU 100          HD13      LEU 100   1.267   2.593  -9.063
  747   HD21  LEU 100          HD21      LEU 100  -0.424   6.473  -8.698
  748   HD22  LEU 100          HD22      LEU 100  -1.322   5.093  -8.066
  749   HD23  LEU 100          HD23      LEU 100  -1.113   5.287  -9.807
  750    H    ALA 101           H        ALA 101   0.679   7.052  -5.787
  751    HA   ALA 101           HA       ALA 101  -0.485   8.971  -7.497
  752    HB1  ALA 101           HB1      ALA 101  -1.611   8.168  -5.488
  753    HB2  ALA 101           HB2      ALA 101  -1.450   9.924  -5.455
  754    HB3  ALA 101           HB3      ALA 101  -0.375   8.921  -4.481
  755    H    LEU 102           H        LEU 102   2.272   9.005  -5.366
  756    HA   LEU 102           HA       LEU 102   3.089  11.554  -6.562
  757    HG   LEU 102           HG       LEU 102   1.549  12.821  -5.044
  758    HB2  LEU 102           HB2      LEU 102   3.329  10.887  -3.627
  759    HB3  LEU 102           HB3      LEU 102   4.052  12.281  -4.400
  760   HD11  LEU 102          HD11      LEU 102  -0.001  12.176  -3.247
  761   HD12  LEU 102          HD12      LEU 102   1.241  11.125  -2.568
  762   HD13  LEU 102          HD13      LEU 102   0.571  10.781  -4.163
  763   HD21  LEU 102          HD21      LEU 102   1.395  14.195  -3.042
  764   HD22  LEU 102          HD22      LEU 102   3.033  14.222  -3.695
  765   HD23  LEU 102          HD23      LEU 102   2.665  13.242  -2.276
  766    H    GLU 103           H        GLU 103   4.508  10.444  -7.896
  767    HA   GLU 103           HA       GLU 103   6.433   8.621  -6.787
  768    HB2  GLU 103           HB2      GLU 103   7.434   8.646  -9.051
  769    HB3  GLU 103           HB3      GLU 103   5.721   8.260  -9.059
  770    HG2  GLU 103           HG2      GLU 103   5.135  10.309  -9.984
  771    HG3  GLU 103           HG3      GLU 103   6.664  11.057  -9.522
  772    H    HIS 104           H        HIS 104   8.654   8.927  -6.615
  773    HA   HIS 104           HA       HIS 104  10.551  10.027  -6.025
  774    HD1  HIS 104           HD1      HIS 104   9.154  10.907  -9.909
  775    HD2  HIS 104           HD2      HIS 104  12.850  10.431  -8.061
  776    HE1  HIS 104           HE1      HIS 104  10.589   9.685 -11.568
  777    HE2  HIS 104           HE2      HIS 104  12.874   9.589 -10.508
  778    HB2  HIS 104           HB2      HIS 104   9.359  12.206  -7.751
  779    HB3  HIS 104           HB3      HIS 104  10.953  12.320  -7.015
  780    H    HIS 105           H        HIS 105  11.040  12.646  -5.266
  781    HA   HIS 105           HA       HIS 105  10.794  14.154  -3.591
  782    HD1  HIS 105           HD1      HIS 105   6.978  14.023  -5.662
  783    HD2  HIS 105           HD2      HIS 105   9.547  16.745  -3.850
  784    HE1  HIS 105           HE1      HIS 105   6.787  16.133  -7.006
  785    HE2  HIS 105           HE2      HIS 105   8.128  17.833  -5.720
  786    HB2  HIS 105           HB2      HIS 105   7.958  13.130  -3.563
  787    HB3  HIS 105           HB3      HIS 105   8.529  14.342  -2.425
  788    H    HIS 106           H        HIS 106  10.741  14.311  -1.283
  789    HA   HIS 106           HA       HIS 106  11.123  13.622   0.836
  790    HD1  HIS 106           HD1      HIS 106  10.227  13.609   2.993
  791    HD2  HIS 106           HD2      HIS 106   9.119   9.654   2.331
  792    HE1  HIS 106           HE1      HIS 106  10.144  12.538   5.268
  793    HE2  HIS 106           HE2      HIS 106   9.434  10.157   4.857
  794    HB2  HIS 106           HB2      HIS 106   8.783  12.771   0.533
  795    HB3  HIS 106           HB3      HIS 106   9.463  11.197   0.137
  796    H    HIS 107           H        HIS 107  12.932  12.673  -1.369
  797    HA   HIS 107           HA       HIS 107  13.952  10.165  -0.370
  798    HD1  HIS 107           HD1      HIS 107  15.851   8.616  -2.878
  799    HD2  HIS 107           HD2      HIS 107  12.376  10.788  -3.602
  800    HE1  HIS 107           HE1      HIS 107  14.466   7.195  -4.432
  801    HE2  HIS 107           HE2      HIS 107  12.434   8.587  -4.971
  802    HB2  HIS 107           HB2      HIS 107  14.792  12.066  -2.516
  803    HB3  HIS 107           HB3      HIS 107  15.956  10.890  -1.911
  804    H    HIS 108           H        HIS 108  13.921  11.294   1.840
  805    HA   HIS 108           HA       HIS 108  16.671  12.181   2.373
  806    HD1  HIS 108           HD1      HIS 108  16.997  15.448   4.018
  807    HD2  HIS 108           HD2      HIS 108  14.854  14.581   0.555
  808    HE1  HIS 108           HE1      HIS 108  17.624  17.235   2.363
  809    HE2  HIS 108           HE2      HIS 108  16.198  16.787   0.336
  810    HB2  HIS 108           HB2      HIS 108  14.120  13.470   3.250
  811    HB3  HIS 108           HB3      HIS 108  15.512  13.516   4.325
  812    H    HIS 109           H        HIS 109  17.539  10.529   3.379
  813    HA   HIS 109           HA       HIS 109  16.386   9.723   5.933
  814    HD1  HIS 109           HD1      HIS 109  15.002   6.679   2.899
  815    HD2  HIS 109           HD2      HIS 109  14.504   8.370   6.660
  816    HE1  HIS 109           HE1      HIS 109  12.587   6.308   3.487
  817    HE2  HIS 109           HE2      HIS 109  12.379   7.133   5.862
  818    HB2  HIS 109           HB2      HIS 109  17.054   7.846   3.679
  819    HB3  HIS 109           HB3      HIS 109  17.240   7.320   5.348
  Start of MODEL   12
    1    HA   MET   1           HA       MET   1  39.074 -36.572  -6.714
    2    H1   MET   1           H1       MET   1  39.734 -38.808  -6.176
    3    H2   MET   1           H2       MET   1  39.358 -38.568  -4.540
    4    H3   MET   1           H3       MET   1  40.635 -37.705  -5.254
    5    HB2  MET   1           HB2      MET   1  37.018 -38.051  -5.048
    6    HB3  MET   1           HB3      MET   1  36.653 -36.751  -6.173
    7    HG2  MET   1           HG2      MET   1  37.425 -38.092  -8.029
    8    HG3  MET   1           HG3      MET   1  37.907 -39.380  -6.928
    9    HE1  MET   1           HE1      MET   1  34.895 -37.374  -8.456
   10    HE2  MET   1           HE2      MET   1  34.681 -37.131  -6.722
   11    HE3  MET   1           HE3      MET   1  33.522 -38.104  -7.624
   12    H    ALA   2           H        ALA   2  39.551 -34.619  -5.954
   13    HA   ALA   2           HA       ALA   2  38.598 -33.924  -3.262
   14    HB1  ALA   2           HB1      ALA   2  41.034 -34.248  -3.197
   15    HB2  ALA   2           HB2      ALA   2  40.580 -32.576  -2.875
   16    HB3  ALA   2           HB3      ALA   2  41.222 -33.026  -4.456
   17    H    MET   3           H        MET   3  36.771 -33.240  -4.662
   18    HA   MET   3           HA       MET   3  37.026 -30.425  -5.231
   19    HB2  MET   3           HB2      MET   3  36.193 -30.515  -7.507
   20    HB3  MET   3           HB3      MET   3  37.683 -31.435  -7.383
   21    HG2  MET   3           HG2      MET   3  34.951 -32.692  -7.321
   22    HG3  MET   3           HG3      MET   3  35.879 -32.450  -8.797
   23    HE1  MET   3           HE1      MET   3  38.933 -34.786  -8.314
   24    HE2  MET   3           HE2      MET   3  38.820 -33.048  -8.035
   25    HE3  MET   3           HE3      MET   3  38.036 -33.771  -9.440
   26    H    LYS   4           H        LYS   4  35.348 -29.509  -4.316
   27    HA   LYS   4           HA       LYS   4  32.686 -30.341  -4.969
   28    HB2  LYS   4           HB2      LYS   4  31.928 -30.489  -2.584
   29    HB3  LYS   4           HB3      LYS   4  32.927 -31.831  -3.117
   30    HG2  LYS   4           HG2      LYS   4  34.789 -31.054  -1.889
   31    HG3  LYS   4           HG3      LYS   4  34.034 -29.486  -1.599
   32    HD2  LYS   4           HD2      LYS   4  33.996 -31.008   0.376
   33    HD3  LYS   4           HD3      LYS   4  32.400 -30.468  -0.147
   34    HE2  LYS   4           HE2      LYS   4  32.309 -32.815   0.375
   35    HE3  LYS   4           HE3      LYS   4  32.117 -32.604  -1.363
   36    HZ1  LYS   4           HZ1      LYS   4  34.480 -33.157  -1.624
   37    HZ2  LYS   4           HZ2      LYS   4  33.601 -34.420  -0.917
   38    HZ3  LYS   4           HZ3      LYS   4  34.596 -33.436   0.042
   39    H    ASP   5           H        ASP   5  34.503 -28.045  -5.209
   40    HA   ASP   5           HA       ASP   5  33.647 -25.970  -3.473
   41    HB2  ASP   5           HB2      ASP   5  34.740 -24.462  -5.072
   42    HB3  ASP   5           HB3      ASP   5  35.764 -25.849  -4.712
   43    H    VAL   6           H        VAL   6  32.159 -24.315  -3.848
   44    HA   VAL   6           HA       VAL   6  30.187 -24.915  -5.947
   45    HB   VAL   6           HB       VAL   6  29.300 -25.607  -3.789
   46   HG11  VAL   6          HG11      VAL   6  29.751 -22.757  -2.918
   47   HG12  VAL   6          HG12      VAL   6  30.609 -24.180  -2.328
   48   HG13  VAL   6          HG13      VAL   6  28.887 -23.986  -1.995
   49   HG21  VAL   6          HG21      VAL   6  28.010 -23.092  -4.840
   50   HG22  VAL   6          HG22      VAL   6  27.235 -24.259  -3.767
   51   HG23  VAL   6          HG23      VAL   6  27.718 -24.741  -5.393
   52    H    VAL   7           H        VAL   7  29.471 -23.250  -7.142
   53    HA   VAL   7           HA       VAL   7  30.185 -20.540  -6.270
   54    HB   VAL   7           HB       VAL   7  31.673 -21.158  -8.096
   55   HG11  VAL   7          HG11      VAL   7  29.186 -21.632  -9.730
   56   HG12  VAL   7          HG12      VAL   7  30.311 -22.868  -9.168
   57   HG13  VAL   7          HG13      VAL   7  30.843 -21.657 -10.335
   58   HG21  VAL   7          HG21      VAL   7  29.555 -19.196  -8.969
   59   HG22  VAL   7          HG22      VAL   7  31.180 -19.319  -9.643
   60   HG23  VAL   7          HG23      VAL   7  30.957 -18.842  -7.961
   61    H    ASP   8           H        ASP   8  28.501 -19.265  -6.024
   62    HA   ASP   8           HA       ASP   8  26.206 -19.567  -7.814
   63    HB2  ASP   8           HB2      ASP   8  24.584 -19.409  -6.044
   64    HB3  ASP   8           HB3      ASP   8  25.656 -20.751  -5.673
   65    H    LYS   9           H        LYS   9  24.853 -17.709  -7.888
   66    HA   LYS   9           HA       LYS   9  26.508 -15.302  -7.558
   67    HB2  LYS   9           HB2      LYS   9  24.371 -15.946  -9.603
   68    HB3  LYS   9           HB3      LYS   9  25.177 -14.398  -9.461
   69    HG2  LYS   9           HG2      LYS   9  26.210 -15.535 -11.250
   70    HG3  LYS   9           HG3      LYS   9  27.345 -15.596  -9.904
   71    HD2  LYS   9           HD2      LYS   9  26.635 -17.880  -9.400
   72    HD3  LYS   9           HD3      LYS   9  25.467 -17.817 -10.717
   73    HE2  LYS   9           HE2      LYS   9  28.434 -17.471 -11.098
   74    HE3  LYS   9           HE3      LYS   9  27.604 -19.020 -11.236
   75    HZ1  LYS   9           HZ1      LYS   9  27.846 -18.082 -13.404
   76    HZ2  LYS   9           HZ2      LYS   9  27.166 -16.607 -12.915
   77    HZ3  LYS   9           HZ3      LYS   9  26.203 -18.002 -12.986
   78    H    CYS  10           H        CYS  10  25.804 -13.827  -6.178
   79    HA   CYS  10           HA       CYS  10  22.971 -13.274  -5.946
   80    HG   CYS  10           HG       CYS  10  22.321 -13.900  -1.890
   81    HB2  CYS  10           HB2      CYS  10  23.332 -15.029  -4.234
   82    HB3  CYS  10           HB3      CYS  10  24.590 -14.039  -3.502
   83    H    SER  11           H        SER  11  23.417 -11.280  -6.795
   84    HA   SER  11           HA       SER  11  24.453  -9.362  -4.882
   85    HG   SER  11           HG       SER  11  26.346 -10.700  -5.387
   86    HB2  SER  11           HB2      SER  11  25.602  -9.524  -7.686
   87    HB3  SER  11           HB3      SER  11  25.981  -8.295  -6.478
   88    H    THR  12           H        THR  12  22.313  -8.659  -4.779
   89    HA   THR  12           HA       THR  12  21.453  -7.068  -7.059
   90    HB   THR  12           HB       THR  12  20.386  -9.170  -7.554
   91    HG1  THR  12           HG1      THR  12  18.938  -7.666  -8.084
   92   HG21  THR  12          HG21      THR  12  20.445 -10.210  -5.362
   93   HG22  THR  12          HG22      THR  12  18.800 -10.228  -5.998
   94   HG23  THR  12          HG23      THR  12  19.252  -9.058  -4.759
   95    H    LYS  13           H        LYS  13  20.899  -5.171  -6.370
   96    HA   LYS  13           HA       LYS  13  19.318  -4.928  -3.905
   97    HB2  LYS  13           HB2      LYS  13  21.560  -3.052  -4.714
   98    HB3  LYS  13           HB3      LYS  13  20.470  -2.812  -3.354
   99    HG2  LYS  13           HG2      LYS  13  21.337  -4.971  -2.407
  100    HG3  LYS  13           HG3      LYS  13  22.558  -4.953  -3.679
  101    HD2  LYS  13           HD2      LYS  13  22.156  -2.846  -1.553
  102    HD3  LYS  13           HD3      LYS  13  23.457  -4.037  -1.608
  103    HE2  LYS  13           HE2      LYS  13  24.226  -3.058  -3.729
  104    HE3  LYS  13           HE3      LYS  13  22.948  -1.849  -3.617
  105    HZ1  LYS  13           HZ1      LYS  13  24.901  -0.847  -2.795
  106    HZ2  LYS  13           HZ2      LYS  13  25.293  -2.184  -1.836
  107    HZ3  LYS  13           HZ3      LYS  13  23.969  -1.206  -1.424
  108    H    GLY  14           H        GLY  14  18.105  -2.768  -3.904
  109    HA2  GLY  14           HA2      GLY  14  17.785  -1.226  -6.194
  110    HA3  GLY  14           HA3      GLY  14  16.707  -2.597  -6.374
  111    H    CYS  15           H        CYS  15  17.130  -1.693  -3.116
  112    HA   CYS  15           HA       CYS  15  14.461  -0.538  -3.077
  113    HG   CYS  15           HG       CYS  15  13.415  -1.528   0.266
  114    HB2  CYS  15           HB2      CYS  15  15.269  -2.191  -1.343
  115    HB3  CYS  15           HB3      CYS  15  16.367  -0.944  -0.759
  116    H    ALA  16           H        ALA  16  14.515   1.494  -3.902
  117    HA   ALA  16           HA       ALA  16  16.846   3.163  -3.441
  118    HB1  ALA  16           HB1      ALA  16  15.932   2.978  -5.690
  119    HB2  ALA  16           HB2      ALA  16  15.858   4.643  -5.110
  120    HB3  ALA  16           HB3      ALA  16  14.401   3.650  -5.133
  121    H    ILE  17           H        ILE  17  13.452   3.086  -2.504
  122    HA   ILE  17           HA       ILE  17  13.902   5.606  -1.056
  123    HB   ILE  17           HB       ILE  17  11.351   5.918  -1.343
  124   HG12  ILE  17          HG12      ILE  17  10.596   5.048  -3.619
  125   HG13  ILE  17          HG13      ILE  17  11.965   3.948  -3.554
  126   HG21  ILE  17          HG21      ILE  17  13.018   7.402  -2.287
  127   HG22  ILE  17          HG22      ILE  17  11.700   7.148  -3.430
  128   HG23  ILE  17          HG23      ILE  17  13.237   6.315  -3.658
  129   HD11  ILE  17          HD11      ILE  17   9.659   4.032  -1.618
  130   HD12  ILE  17          HD12      ILE  17  11.043   2.943  -1.514
  131   HD13  ILE  17          HD13      ILE  17   9.931   2.829  -2.879
  132    H    ASP  18           H        ASP  18  12.510   5.996   0.766
  133    HA   ASP  18           HA       ASP  18  11.044   3.749   1.881
  134    HB2  ASP  18           HB2      ASP  18  13.116   3.367   3.006
  135    HB3  ASP  18           HB3      ASP  18  13.353   5.089   3.301
  136    H    ILE  19           H        ILE  19   9.152   4.474   2.590
  137    HA   ILE  19           HA       ILE  19   8.826   7.378   2.861
  138    HB   ILE  19           HB       ILE  19   6.609   5.337   2.628
  139   HG12  ILE  19          HG12      ILE  19   8.011   5.125   0.643
  140   HG13  ILE  19          HG13      ILE  19   6.505   5.932   0.225
  141   HG21  ILE  19          HG21      ILE  19   6.680   8.311   2.109
  142   HG22  ILE  19          HG22      ILE  19   5.949   7.517   3.504
  143   HG23  ILE  19          HG23      ILE  19   5.279   7.262   1.892
  144   HD11  ILE  19          HD11      ILE  19   7.650   8.088   0.247
  145   HD12  ILE  19          HD12      ILE  19   8.399   6.964  -0.888
  146   HD13  ILE  19          HD13      ILE  19   9.159   7.280   0.672
  147    H    GLY  20           H        GLY  20   9.027   4.542   4.704
  148    HA2  GLY  20           HA2      GLY  20   8.639   4.065   6.915
  149    HA3  GLY  20           HA3      GLY  20   8.556   5.804   7.176
  150    H    THR  21           H        THR  21   6.444   3.861   5.121
  151    HA   THR  21           HA       THR  21   4.142   5.057   6.375
  152    HB   THR  21           HB       THR  21   4.097   2.918   4.269
  153    HG1  THR  21           HG1      THR  21   4.918   5.566   4.126
  154   HG21  THR  21          HG21      THR  21   1.942   3.449   5.263
  155   HG22  THR  21          HG22      THR  21   2.003   4.067   3.611
  156   HG23  THR  21          HG23      THR  21   2.209   5.167   4.975
  157    H    VAL  22           H        VAL  22   4.526   4.112   8.442
  158    HA   VAL  22           HA       VAL  22   3.292   1.461   8.656
  159    HB   VAL  22           HB       VAL  22   4.589   1.273  10.864
  160   HG11  VAL  22          HG11      VAL  22   6.561   0.333   9.733
  161   HG12  VAL  22          HG12      VAL  22   6.065   1.130   8.241
  162   HG13  VAL  22          HG13      VAL  22   5.055  -0.133   8.942
  163   HG21  VAL  22          HG21      VAL  22   5.395   3.562  11.009
  164   HG22  VAL  22          HG22      VAL  22   6.278   3.364   9.497
  165   HG23  VAL  22          HG23      VAL  22   6.753   2.440  10.923
  166    H    ILE  23           H        ILE  23   1.262   2.380   8.887
  167    HA   ILE  23           HA       ILE  23   0.679   3.397  11.527
  168    HB   ILE  23           HB       ILE  23   1.185   5.477  10.406
  169   HG12  ILE  23          HG12      ILE  23  -1.031   6.635  10.586
  170   HG13  ILE  23          HG13      ILE  23  -1.788   5.053  10.743
  171   HG21  ILE  23          HG21      ILE  23   0.929   4.810   8.104
  172   HG22  ILE  23          HG22      ILE  23  -0.063   6.234   8.425
  173   HG23  ILE  23          HG23      ILE  23  -0.816   4.643   8.314
  174   HD11  ILE  23          HD11      ILE  23   0.257   6.206  12.624
  175   HD12  ILE  23          HD12      ILE  23  -0.553   4.648  12.790
  176   HD13  ILE  23          HD13      ILE  23  -1.482   6.143  12.901
  177    H    ASP  24           H        ASP  24  -1.163   2.585  12.219
  178    HA   ASP  24           HA       ASP  24  -3.137   1.506  12.342
  179    HB2  ASP  24           HB2      ASP  24  -4.085   3.418  11.208
  180    HB3  ASP  24           HB3      ASP  24  -3.601   2.780   9.639
  181    H    ASN  25           H        ASN  25  -2.275  -0.538  12.390
  182    HA   ASN  25           HA       ASN  25  -3.097  -2.221  10.217
  183    HB2  ASN  25           HB2      ASN  25  -0.960  -3.221   9.713
  184    HB3  ASN  25           HB3      ASN  25  -0.825  -1.484   9.473
  185   HD21  ASN  25          HD21      ASN  25   0.150  -4.203  11.362
  186   HD22  ASN  25          HD22      ASN  25   1.409  -3.413  12.251
  187    H    ASP  26           H        ASP  26  -2.971  -4.478  10.772
  188    HA   ASP  26           HA       ASP  26  -2.094  -5.266  13.404
  189    HB2  ASP  26           HB2      ASP  26  -4.263  -4.479  14.066
  190    HB3  ASP  26           HB3      ASP  26  -5.033  -5.233  12.673
  191    H    ASN  27           H        ASN  27  -4.337  -6.289  10.865
  192    HA   ASN  27           HA       ASN  27  -2.956  -8.842  10.619
  193    HB2  ASN  27           HB2      ASN  27  -4.761  -9.438   9.086
  194    HB3  ASN  27           HB3      ASN  27  -5.422  -8.814  10.591
  195   HD21  ASN  27          HD21      ASN  27  -6.578  -8.994   7.911
  196   HD22  ASN  27          HD22      ASN  27  -7.072  -7.385   7.512
  197    H    CYS  28           H        CYS  28  -3.172  -9.371   7.969
  198    HA   CYS  28           HA       CYS  28  -1.319  -7.417   6.816
  199    HG   CYS  28           HG       CYS  28  -0.575 -10.882   8.307
  200    HB2  CYS  28           HB2      CYS  28  -1.789 -10.307   6.036
  201    HB3  CYS  28           HB3      CYS  28  -0.567  -9.238   5.356
  202    H    THR  29           H        THR  29  -3.468  -6.248   6.528
  203    HA   THR  29           HA       THR  29  -4.348  -6.717   3.785
  204    HB   THR  29           HB       THR  29  -6.269  -6.445   6.107
  205    HG1  THR  29           HG1      THR  29  -5.207  -8.569   5.239
  206   HG21  THR  29          HG21      THR  29  -8.056  -6.577   4.430
  207   HG22  THR  29          HG22      THR  29  -6.851  -6.535   3.142
  208   HG23  THR  29          HG23      THR  29  -7.063  -5.138   4.199
  209    H    SER  30           H        SER  30  -4.292  -4.958   2.668
  210    HA   SER  30           HA       SER  30  -4.257  -2.354   3.992
  211    HG   SER  30           HG       SER  30  -1.693  -1.866   2.497
  212    HB2  SER  30           HB2      SER  30  -3.593  -3.227   1.169
  213    HB3  SER  30           HB3      SER  30  -3.596  -1.551   1.699
  214    H    LYS  31           H        LYS  31  -6.258  -1.660   4.355
  215    HA   LYS  31           HA       LYS  31  -8.277  -1.994   2.272
  216    HB2  LYS  31           HB2      LYS  31  -9.949  -1.422   3.928
  217    HB3  LYS  31           HB3      LYS  31  -8.933  -2.715   4.533
  218    HG2  LYS  31           HG2      LYS  31  -8.748   0.184   5.321
  219    HG3  LYS  31           HG3      LYS  31  -9.482  -1.107   6.270
  220    HD2  LYS  31           HD2      LYS  31  -7.219  -2.245   6.182
  221    HD3  LYS  31           HD3      LYS  31  -6.586  -0.729   5.558
  222    HE2  LYS  31           HE2      LYS  31  -6.235  -0.867   7.955
  223    HE3  LYS  31           HE3      LYS  31  -7.354   0.434   7.564
  224    HZ1  LYS  31           HZ1      LYS  31  -7.936  -1.053   9.507
  225    HZ2  LYS  31           HZ2      LYS  31  -8.301  -2.255   8.364
  226    HZ3  LYS  31           HZ3      LYS  31  -9.160  -0.789   8.361
  227    H    PHE  32           H        PHE  32  -8.495  -0.489   0.913
  228    HA   PHE  32           HA       PHE  32  -7.796   2.287   1.621
  229    HD1  PHE  32           HD2      PHE  32  -5.815   3.757   0.494
  230    HD2  PHE  32           HD1      PHE  32  -8.294   2.353  -2.666
  231    HE1  PHE  32           HE2      PHE  32  -5.573   5.921  -0.653
  232    HE2  PHE  32           HE1      PHE  32  -8.054   4.511  -3.817
  233    HZ   PHE  32           HZ       PHE  32  -6.692   6.298  -2.814
  234    HB2  PHE  32           HB2      PHE  32  -6.227   1.291   0.024
  235    HB3  PHE  32           HB3      PHE  32  -7.558   0.867  -1.042
  236    H    SER  33           H        SER  33  -9.512   3.553   1.748
  237    HA   SER  33           HA       SER  33 -11.750   3.090  -0.115
  238    HG   SER  33           HG       SER  33 -12.848   1.845   2.141
  239    HB2  SER  33           HB2      SER  33 -11.945   4.481   2.563
  240    HB3  SER  33           HB3      SER  33 -13.263   3.896   1.549
  241    H    ARG  34           H        ARG  34 -11.859   4.611  -1.647
  242    HA   ARG  34           HA       ARG  34 -11.366   7.401  -0.906
  243    HE   ARG  34           HE       ARG  34  -8.734  10.565  -2.958
  244    HB2  ARG  34           HB2      ARG  34  -9.341   6.097  -2.027
  245    HB3  ARG  34           HB3      ARG  34 -10.231   6.443  -3.496
  246    HG2  ARG  34           HG2      ARG  34  -9.529   8.618  -1.559
  247    HG3  ARG  34           HG3      ARG  34  -8.371   8.053  -2.760
  248    HD2  ARG  34           HD2      ARG  34 -10.016   8.563  -4.533
  249    HD3  ARG  34           HD3      ARG  34 -11.101   9.212  -3.302
  250   HH11  ARG  34          HH11      ARG  34 -11.067  10.162  -5.539
  251   HH12  ARG  34          HH12      ARG  34 -10.691  11.681  -6.298
  252   HH21  ARG  34          HH21      ARG  34  -8.220  12.570  -3.972
  253   HH22  ARG  34          HH22      ARG  34  -9.093  13.054  -5.400
  254    H    PHE  35           H        PHE  35 -12.588   8.842  -2.065
  255    HA   PHE  35           HA       PHE  35 -14.809   7.656  -3.530
  256    HD1  PHE  35           HD1      PHE  35 -17.147   8.175  -2.169
  257    HD2  PHE  35           HD2      PHE  35 -13.973  10.341  -0.343
  258    HE1  PHE  35           HE1      PHE  35 -18.029   7.587   0.051
  259    HE2  PHE  35           HE2      PHE  35 -14.852   9.755   1.881
  260    HZ   PHE  35           HZ       PHE  35 -16.879   8.375   2.077
  261    HB2  PHE  35           HB2      PHE  35 -14.322  10.515  -2.658
  262    HB3  PHE  35           HB3      PHE  35 -15.803   9.915  -3.399
  263    H    PHE  36           H        PHE  36 -15.184   7.917  -5.673
  264    HA   PHE  36           HA       PHE  36 -13.254   9.565  -7.166
  265    HD1  PHE  36           HD2      PHE  36 -11.151   8.805  -8.291
  266    HD2  PHE  36           HD1      PHE  36 -12.973   5.336  -6.635
  267    HE1  PHE  36           HE2      PHE  36  -8.949   8.021  -7.530
  268    HE2  PHE  36           HE1      PHE  36 -10.771   4.544  -5.867
  269    HZ   PHE  36           HZ       PHE  36  -8.760   5.889  -6.316
  270    HB2  PHE  36           HB2      PHE  36 -14.263   6.805  -7.852
  271    HB3  PHE  36           HB3      PHE  36 -13.476   7.857  -9.025
  272    H    ALA  37           H        ALA  37 -14.026  10.129  -9.370
  273    HA   ALA  37           HA       ALA  37 -16.355  11.628  -9.200
  274    HB1  ALA  37           HB1      ALA  37 -16.103  12.019 -11.588
  275    HB2  ALA  37           HB2      ALA  37 -14.967  10.674 -11.698
  276    HB3  ALA  37           HB3      ALA  37 -14.547  12.109 -10.762
  277    H    THR  38           H        THR  38 -15.873   8.563 -10.950
  278    HA   THR  38           HA       THR  38 -18.724   8.005 -10.595
  279    HB   THR  38           HB       THR  38 -18.667   7.002 -12.970
  280    HG1  THR  38           HG1      THR  38 -16.801   9.029 -13.551
  281   HG21  THR  38          HG21      THR  38 -18.667  10.002 -12.615
  282   HG22  THR  38          HG22      THR  38 -20.045   8.930 -12.362
  283   HG23  THR  38          HG23      THR  38 -19.365   9.127 -13.977
  284    H    ARG  39           H        ARG  39 -19.199   5.675 -11.259
  285    HA   ARG  39           HA       ARG  39 -17.605   3.910  -9.787
  286    HE   ARG  39           HE       ARG  39 -21.041   2.772 -14.638
  287    HB2  ARG  39           HB2      ARG  39 -18.977   2.143 -10.703
  288    HB3  ARG  39           HB3      ARG  39 -19.995   3.540 -10.392
  289    HG2  ARG  39           HG2      ARG  39 -20.011   4.117 -12.725
  290    HG3  ARG  39           HG3      ARG  39 -18.871   2.822 -13.090
  291    HD2  ARG  39           HD2      ARG  39 -20.572   1.207 -12.215
  292    HD3  ARG  39           HD3      ARG  39 -21.707   2.554 -12.119
  293   HH11  ARG  39          HH11      ARG  39 -21.698  -0.139 -12.802
  294   HH12  ARG  39          HH12      ARG  39 -22.141  -1.077 -14.204
  295   HH21  ARG  39          HH21      ARG  39 -21.618   1.549 -16.477
  296   HH22  ARG  39          HH22      ARG  39 -22.107  -0.110 -16.298
  297    H    GLU  40           H        GLU  40 -17.453   4.930 -13.100
  298    HA   GLU  40           HA       GLU  40 -15.791   2.953 -14.186
  299    HB2  GLU  40           HB2      GLU  40 -15.969   5.892 -14.834
  300    HB3  GLU  40           HB3      GLU  40 -15.184   4.680 -15.833
  301    HG2  GLU  40           HG2      GLU  40 -17.340   3.534 -16.083
  302    HG3  GLU  40           HG3      GLU  40 -18.108   4.816 -15.148
  303    H    GLU  41           H        GLU  41 -15.078   5.998 -12.586
  304    HA   GLU  41           HA       GLU  41 -12.294   6.001 -12.884
  305    HB2  GLU  41           HB2      GLU  41 -13.947   7.178 -10.643
  306    HB3  GLU  41           HB3      GLU  41 -12.283   7.599 -11.010
  307    HG2  GLU  41           HG2      GLU  41 -14.678   8.076 -12.767
  308    HG3  GLU  41           HG3      GLU  41 -13.788   9.289 -11.848
  309    H    ALA  42           H        ALA  42 -14.384   4.317 -10.702
  310    HA   ALA  42           HA       ALA  42 -12.429   3.672  -8.724
  311    HB1  ALA  42           HB1      ALA  42 -15.035   2.285  -9.353
  312    HB2  ALA  42           HB2      ALA  42 -14.840   3.648  -8.252
  313    HB3  ALA  42           HB3      ALA  42 -14.084   2.099  -7.878
  314    H    GLU  43           H        GLU  43 -13.914   1.809 -11.363
  315    HA   GLU  43           HA       GLU  43 -12.287  -0.463 -11.187
  316    HB2  GLU  43           HB2      GLU  43 -13.824   0.813 -13.432
  317    HB3  GLU  43           HB3      GLU  43 -12.880  -0.647 -13.697
  318    HG2  GLU  43           HG2      GLU  43 -14.929  -0.495 -11.520
  319    HG3  GLU  43           HG3      GLU  43 -15.379  -0.874 -13.183
  320    H    SER  44           H        SER  44 -11.816   2.626 -12.750
  321    HA   SER  44           HA       SER  44  -9.601   1.938 -14.347
  322    HG   SER  44           HG       SER  44 -12.029   3.793 -14.515
  323    HB2  SER  44           HB2      SER  44 -10.394   4.633 -13.219
  324    HB3  SER  44           HB3      SER  44  -9.242   4.371 -14.530
  325    H    PHE  45           H        PHE  45  -9.860   2.773 -10.950
  326    HA   PHE  45           HA       PHE  45  -7.006   3.237 -10.728
  327    HD1  PHE  45           HD2      PHE  45  -6.398   5.441  -9.226
  328    HD2  PHE  45           HD1      PHE  45  -7.734   2.283  -6.707
  329    HE1  PHE  45           HE2      PHE  45  -4.575   5.933  -7.647
  330    HE2  PHE  45           HE1      PHE  45  -5.918   2.770  -5.122
  331    HZ   PHE  45           HZ       PHE  45  -4.335   4.594  -5.592
  332    HB2  PHE  45           HB2      PHE  45  -8.717   4.474  -9.358
  333    HB3  PHE  45           HB3      PHE  45  -9.052   2.966  -8.516
  334    H    MET  46           H        MET  46  -9.288   0.673 -10.329
  335    HA   MET  46           HA       MET  46  -7.741  -0.907  -8.531
  336    HB2  MET  46           HB2      MET  46 -10.169  -1.088  -8.615
  337    HB3  MET  46           HB3      MET  46 -10.091  -1.640 -10.282
  338    HG2  MET  46           HG2      MET  46 -10.484  -3.457  -8.672
  339    HG3  MET  46           HG3      MET  46  -9.012  -3.675  -9.616
  340    HE1  MET  46           HE1      MET  46  -8.878  -2.043  -5.307
  341    HE2  MET  46           HE2      MET  46 -10.394  -2.344  -6.156
  342    HE3  MET  46           HE3      MET  46  -9.299  -1.085  -6.726
  343    H    THR  47           H        THR  47  -8.180  -0.912 -12.043
  344    HA   THR  47           HA       THR  47  -7.166  -3.408 -12.652
  345    HB   THR  47           HB       THR  47  -6.718  -0.933 -14.317
  346    HG1  THR  47           HG1      THR  47  -8.789  -1.064 -14.925
  347   HG21  THR  47          HG21      THR  47  -7.092  -3.834 -15.070
  348   HG22  THR  47          HG22      THR  47  -5.568  -2.948 -15.105
  349   HG23  THR  47          HG23      THR  47  -6.879  -2.493 -16.195
  350    H    LYS  48           H        LYS  48  -5.299  -0.354 -12.656
  351    HA   LYS  48           HA       LYS  48  -2.838  -1.651 -13.129
  352    HB2  LYS  48           HB2      LYS  48  -1.810   0.513 -12.609
  353    HB3  LYS  48           HB3      LYS  48  -3.135   0.640 -13.753
  354    HG2  LYS  48           HG2      LYS  48  -4.590   1.259 -11.772
  355    HG3  LYS  48           HG3      LYS  48  -3.083   1.453 -10.874
  356    HD2  LYS  48           HD2      LYS  48  -3.912   2.922 -13.371
  357    HD3  LYS  48           HD3      LYS  48  -3.741   3.581 -11.751
  358    HE2  LYS  48           HE2      LYS  48  -1.454   2.353 -13.268
  359    HE3  LYS  48           HE3      LYS  48  -1.847   4.068 -13.352
  360    HZ1  LYS  48           HZ1      LYS  48  -0.091   3.334 -11.689
  361    HZ2  LYS  48           HZ2      LYS  48  -1.375   2.732 -10.764
  362    HZ3  LYS  48           HZ3      LYS  48  -1.302   4.383 -11.135
  363    H    LEU  49           H        LEU  49  -4.586  -0.940 -10.219
  364    HA   LEU  49           HA       LEU  49  -2.403  -1.313  -8.423
  365    HG   LEU  49           HG       LEU  49  -4.835   0.484  -6.388
  366    HB2  LEU  49           HB2      LEU  49  -5.327  -1.006  -8.203
  367    HB3  LEU  49           HB3      LEU  49  -4.570  -1.928  -6.917
  368   HD11  LEU  49          HD11      LEU  49  -1.993  -0.510  -6.563
  369   HD12  LEU  49          HD12      LEU  49  -3.137  -0.829  -5.259
  370   HD13  LEU  49          HD13      LEU  49  -2.560   0.812  -5.544
  371   HD21  LEU  49          HD21      LEU  49  -4.477   1.399  -8.624
  372   HD22  LEU  49          HD22      LEU  49  -2.794   0.875  -8.577
  373   HD23  LEU  49          HD23      LEU  49  -3.362   2.113  -7.458
  374    H    LYS  50           H        LYS  50  -4.671  -3.475 -10.000
  375    HA   LYS  50           HA       LYS  50  -4.253  -5.791  -8.496
  376    HB2  LYS  50           HB2      LYS  50  -4.753  -5.405 -11.445
  377    HB3  LYS  50           HB3      LYS  50  -4.782  -6.971 -10.654
  378    HG2  LYS  50           HG2      LYS  50  -6.781  -6.588  -9.652
  379    HG3  LYS  50           HG3      LYS  50  -6.501  -4.849  -9.511
  380    HD2  LYS  50           HD2      LYS  50  -7.152  -4.432 -11.687
  381    HD3  LYS  50           HD3      LYS  50  -6.838  -6.085 -12.201
  382    HE2  LYS  50           HE2      LYS  50  -8.786  -6.848 -10.943
  383    HE3  LYS  50           HE3      LYS  50  -9.081  -5.199 -10.391
  384    HZ1  LYS  50           HZ1      LYS  50 -10.425  -6.019 -12.352
  385    HZ2  LYS  50           HZ2      LYS  50  -9.000  -5.897 -13.266
  386    HZ3  LYS  50           HZ3      LYS  50  -9.664  -4.517 -12.533
  387    H    GLU  51           H        GLU  51  -2.427  -4.426 -11.190
  388    HA   GLU  51           HA       GLU  51  -0.550  -6.481 -11.532
  389    HB2  GLU  51           HB2      GLU  51  -0.074  -3.519 -11.944
  390    HB3  GLU  51           HB3      GLU  51   0.792  -4.843 -12.711
  391    HG2  GLU  51           HG2      GLU  51  -1.276  -5.506 -13.860
  392    HG3  GLU  51           HG3      GLU  51  -2.106  -4.137 -13.123
  393    H    LEU  52           H        LEU  52  -0.604  -3.661  -9.447
  394    HA   LEU  52           HA       LEU  52   2.021  -3.988  -8.408
  395    HG   LEU  52           HG       LEU  52   0.493  -1.578  -9.509
  396    HB2  LEU  52           HB2      LEU  52  -0.361  -2.457  -7.356
  397    HB3  LEU  52           HB3      LEU  52   1.254  -2.345  -6.693
  398   HD11  LEU  52          HD11      LEU  52   1.110   0.158  -7.123
  399   HD12  LEU  52          HD12      LEU  52  -0.481  -0.073  -7.844
  400   HD13  LEU  52          HD13      LEU  52   0.797   0.719  -8.767
  401   HD21  LEU  52          HD21      LEU  52   2.789  -2.322  -9.358
  402   HD22  LEU  52          HD22      LEU  52   3.066  -1.271  -7.968
  403   HD23  LEU  52          HD23      LEU  52   2.737  -0.569  -9.552
  404    H    ALA  53           H        ALA  53  -1.203  -4.881  -7.240
  405    HA   ALA  53           HA       ALA  53  -0.436  -5.721  -4.666
  406    HB1  ALA  53           HB1      ALA  53  -2.611  -6.800  -4.560
  407    HB2  ALA  53           HB2      ALA  53  -2.795  -6.628  -6.306
  408    HB3  ALA  53           HB3      ALA  53  -2.742  -5.195  -5.277
  409    H    ALA  54           H        ALA  54  -0.724  -7.495  -7.712
  410    HA   ALA  54           HA       ALA  54  -0.374 -10.073  -6.674
  411    HB1  ALA  54           HB1      ALA  54  -1.170  -9.635  -8.950
  412    HB2  ALA  54           HB2      ALA  54   0.199 -10.746  -8.935
  413    HB3  ALA  54           HB3      ALA  54   0.439  -9.061  -9.395
  414    H    ALA  55           H        ALA  55   1.997  -7.746  -7.888
  415    HA   ALA  55           HA       ALA  55   4.221  -9.498  -7.470
  416    HB1  ALA  55           HB1      ALA  55   4.232  -7.790  -9.222
  417    HB2  ALA  55           HB2      ALA  55   5.587  -7.590  -8.111
  418    HB3  ALA  55           HB3      ALA  55   4.182  -6.531  -7.988
  419    H    ALA  56           H        ALA  56   2.422  -7.389  -5.494
  420    HA   ALA  56           HA       ALA  56   4.437  -6.603  -3.665
  421    HB1  ALA  56           HB1      ALA  56   1.469  -6.871  -3.201
  422    HB2  ALA  56           HB2      ALA  56   2.288  -5.446  -3.843
  423    HB3  ALA  56           HB3      ALA  56   2.605  -5.978  -2.192
  424    H    SER  57           H        SER  57   2.297  -9.407  -3.835
  425    HA   SER  57           HA       SER  57   3.515 -10.450  -1.379
  426    HG   SER  57           HG       SER  57   1.340  -9.372  -1.293
  427    HB2  SER  57           HB2      SER  57   1.080 -11.431  -2.882
  428    HB3  SER  57           HB3      SER  57   1.673 -12.078  -1.351
  429    H    SER  58           H        SER  58   3.297 -10.964  -4.781
  430    HA   SER  58           HA       SER  58   4.568 -12.163  -6.220
  431    HG   SER  58           HG       SER  58   6.469 -10.826  -3.973
  432    HB2  SER  58           HB2      SER  58   6.148 -12.951  -3.767
  433    HB3  SER  58           HB3      SER  58   6.647 -13.219  -5.436
  434    H    ALA  59           H        ALA  59   2.977 -13.701  -3.614
  435    HA   ALA  59           HA       ALA  59   3.493 -16.394  -4.450
  436    HB1  ALA  59           HB1      ALA  59   1.432 -15.339  -2.521
  437    HB2  ALA  59           HB2      ALA  59   3.053 -15.896  -2.110
  438    HB3  ALA  59           HB3      ALA  59   1.865 -17.034  -2.746
  439    H    ASP  60           H        ASP  60   2.874 -15.844  -6.710
  440    HA   ASP  60           HA       ASP  60   1.568 -16.235  -8.515
  441    HB2  ASP  60           HB2      ASP  60  -0.025 -17.800  -6.486
  442    HB3  ASP  60           HB3      ASP  60  -0.376 -17.807  -8.211
  443    H    GLU  61           H        GLU  61  -1.155 -16.271  -6.315
  444    HA   GLU  61           HA       GLU  61  -2.559 -14.312  -7.907
  445    HB2  GLU  61           HB2      GLU  61  -3.435 -15.556  -5.299
  446    HB3  GLU  61           HB3      GLU  61  -4.452 -14.875  -6.560
  447    HG2  GLU  61           HG2      GLU  61  -4.323 -16.731  -7.866
  448    HG3  GLU  61           HG3      GLU  61  -2.724 -17.176  -7.267
  449    H    GLY  62           H        GLY  62  -0.582 -14.358  -5.136
  450    HA2  GLY  62           HA2      GLY  62   0.017 -12.567  -3.735
  451    HA3  GLY  62           HA3      GLY  62  -1.342 -11.643  -4.380
  452    H    ALA  63           H        ALA  63  -3.261 -11.681  -3.344
  453    HA   ALA  63           HA       ALA  63  -4.123 -13.864  -1.763
  454    HB1  ALA  63           HB1      ALA  63  -4.223 -12.807   0.413
  455    HB2  ALA  63           HB2      ALA  63  -3.415 -11.378  -0.230
  456    HB3  ALA  63           HB3      ALA  63  -2.554 -12.915  -0.147
  457    H    SER  64           H        SER  64  -5.988 -12.611  -0.161
  458    HA   SER  64           HA       SER  64  -8.082 -12.385  -1.964
  459    HG   SER  64           HG       SER  64  -8.574 -13.432   1.408
  460    HB2  SER  64           HB2      SER  64  -7.900 -11.449   0.900
  461    HB3  SER  64           HB3      SER  64  -9.398 -11.572  -0.019
  462    H    VAL  65           H        VAL  65  -8.717 -10.843  -3.263
  463    HA   VAL  65           HA       VAL  65  -8.348  -8.065  -2.373
  464    HB   VAL  65           HB       VAL  65  -6.892  -8.366  -4.268
  465   HG11  VAL  65          HG11      VAL  65  -7.863 -10.346  -5.262
  466   HG12  VAL  65          HG12      VAL  65  -7.723  -9.068  -6.470
  467   HG13  VAL  65          HG13      VAL  65  -9.291  -9.434  -5.748
  468   HG21  VAL  65          HG21      VAL  65  -8.072  -6.252  -4.157
  469   HG22  VAL  65          HG22      VAL  65  -9.409  -6.927  -5.089
  470   HG23  VAL  65          HG23      VAL  65  -7.824  -6.730  -5.839
  471    H    ALA  66           H        ALA  66 -10.200  -7.234  -1.823
  472    HA   ALA  66           HA       ALA  66 -12.582  -7.866  -3.416
  473    HB1  ALA  66           HB1      ALA  66 -13.938  -7.925  -1.383
  474    HB2  ALA  66           HB2      ALA  66 -12.489  -7.688  -0.405
  475    HB3  ALA  66           HB3      ALA  66 -12.686  -9.167  -1.343
  476    H    TYR  67           H        TYR  67 -13.258  -6.033  -4.314
  477    HA   TYR  67           HA       TYR  67 -12.998  -3.592  -2.705
  478    HD1  TYR  67           HD1      TYR  67 -11.467  -5.567  -6.079
  479    HD2  TYR  67           HD2      TYR  67 -13.872  -2.091  -6.584
  480    HE1  TYR  67           HE1      TYR  67 -11.897  -6.206  -8.418
  481    HE2  TYR  67           HE2      TYR  67 -14.314  -2.727  -8.911
  482    HH   TYR  67           HH       TYR  67 -13.290  -4.057 -10.677
  483    HB2  TYR  67           HB2      TYR  67 -12.478  -2.294  -4.675
  484    HB3  TYR  67           HB3      TYR  67 -11.323  -3.607  -4.516
  485    H    LYS  68           H        LYS  68 -14.675  -2.274  -2.602
  486    HA   LYS  68           HA       LYS  68 -17.114  -3.068  -4.036
  487    HB2  LYS  68           HB2      LYS  68 -16.755  -1.372  -1.562
  488    HB3  LYS  68           HB3      LYS  68 -18.292  -1.641  -2.366
  489    HG2  LYS  68           HG2      LYS  68 -18.226  -3.968  -1.843
  490    HG3  LYS  68           HG3      LYS  68 -16.599  -3.807  -1.190
  491    HD2  LYS  68           HD2      LYS  68 -19.122  -2.555  -0.101
  492    HD3  LYS  68           HD3      LYS  68 -18.179  -3.845   0.646
  493    HE2  LYS  68           HE2      LYS  68 -16.365  -2.389   1.097
  494    HE3  LYS  68           HE3      LYS  68 -17.020  -1.132   0.052
  495    HZ1  LYS  68           HZ1      LYS  68 -17.375  -0.552   2.339
  496    HZ2  LYS  68           HZ2      LYS  68 -18.151  -2.027   2.652
  497    HZ3  LYS  68           HZ3      LYS  68 -18.877  -0.889   1.626
  498    H    ILE  69           H        ILE  69 -18.260  -1.606  -5.150
  499    HA   ILE  69           HA       ILE  69 -17.182   1.133  -5.329
  500    HB   ILE  69           HB       ILE  69 -18.608  -0.364  -7.545
  501   HG12  ILE  69          HG12      ILE  69 -15.686   0.403  -7.343
  502   HG13  ILE  69          HG13      ILE  69 -16.317  -1.226  -7.129
  503   HG21  ILE  69          HG21      ILE  69 -17.954   1.571  -8.929
  504   HG22  ILE  69          HG22      ILE  69 -17.317   2.362  -7.487
  505   HG23  ILE  69          HG23      ILE  69 -19.042   2.013  -7.613
  506   HD11  ILE  69          HD11      ILE  69 -16.460   0.410  -9.649
  507   HD12  ILE  69          HD12      ILE  69 -17.107  -1.217  -9.440
  508   HD13  ILE  69          HD13      ILE  69 -15.369  -0.939  -9.338
  509    H    LYS  70           H        LYS  70 -18.548   2.206  -4.002
  510    HA   LYS  70           HA       LYS  70 -21.336   1.393  -3.924
  511    HB2  LYS  70           HB2      LYS  70 -20.139   1.861  -1.809
  512    HB3  LYS  70           HB3      LYS  70 -19.963   3.539  -2.303
  513    HG2  LYS  70           HG2      LYS  70 -21.820   3.280  -0.755
  514    HG3  LYS  70           HG3      LYS  70 -22.394   3.786  -2.345
  515    HD2  LYS  70           HD2      LYS  70 -22.867   1.374  -2.842
  516    HD3  LYS  70           HD3      LYS  70 -22.491   1.017  -1.157
  517    HE2  LYS  70           HE2      LYS  70 -24.872   1.209  -1.399
  518    HE3  LYS  70           HE3      LYS  70 -24.280   2.590  -0.473
  519    HZ1  LYS  70           HZ1      LYS  70 -24.930   2.619  -3.379
  520    HZ2  LYS  70           HZ2      LYS  70 -24.422   3.947  -2.455
  521    HZ3  LYS  70           HZ3      LYS  70 -25.919   3.230  -2.143
  522    H    ASP  71           H        ASP  71 -22.752   2.231  -5.154
  523    HA   ASP  71           HA       ASP  71 -22.267   4.430  -6.865
  524    HB2  ASP  71           HB2      ASP  71 -24.591   4.100  -7.573
  525    HB3  ASP  71           HB3      ASP  71 -23.753   2.561  -7.473
  526    H    LEU  72           H        LEU  72 -22.146   6.452  -6.126
  527    HA   LEU  72           HA       LEU  72 -24.207   7.346  -4.220
  528    HG   LEU  72           HG       LEU  72 -21.320   6.443  -3.399
  529    HB2  LEU  72           HB2      LEU  72 -21.473   8.544  -4.698
  530    HB3  LEU  72           HB3      LEU  72 -22.666   9.133  -3.556
  531   HD11  LEU  72          HD11      LEU  72 -20.803   8.996  -1.890
  532   HD12  LEU  72          HD12      LEU  72 -19.704   8.179  -3.002
  533   HD13  LEU  72          HD13      LEU  72 -20.134   7.419  -1.469
  534   HD21  LEU  72          HD21      LEU  72 -22.286   6.365  -1.154
  535   HD22  LEU  72          HD22      LEU  72 -23.533   6.458  -2.397
  536   HD23  LEU  72          HD23      LEU  72 -23.113   7.892  -1.461
  537    H    GLU  73           H        GLU  73 -24.361   9.900  -4.476
  538    HA   GLU  73           HA       GLU  73 -25.249  10.281  -7.214
  539    HB2  GLU  73           HB2      GLU  73 -26.704  10.941  -5.318
  540    HB3  GLU  73           HB3      GLU  73 -25.498  12.131  -4.834
  541    HG2  GLU  73           HG2      GLU  73 -25.762  13.141  -7.131
  542    HG3  GLU  73           HG3      GLU  73 -27.162  12.088  -7.331
  543    H    GLY  74           H        GLY  74 -23.615  10.772  -8.563
  544    HA2  GLY  74           HA2      GLY  74 -22.367  12.460  -9.622
  545    HA3  GLY  74           HA3      GLY  74 -22.337  13.355  -8.112
  546    H    GLN  75           H        GLN  75 -21.566  10.326  -7.251
  547    HA   GLN  75           HA       GLN  75 -18.861  10.117  -8.114
  548    HB2  GLN  75           HB2      GLN  75 -17.789  10.517  -5.931
  549    HB3  GLN  75           HB3      GLN  75 -18.541  11.975  -6.561
  550    HG2  GLN  75           HG2      GLN  75 -20.448  11.638  -5.069
  551    HG3  GLN  75           HG3      GLN  75 -19.692  10.173  -4.440
  552   HE21  GLN  75          HE21      GLN  75 -17.909  10.345  -3.093
  553   HE22  GLN  75          HE22      GLN  75 -17.450  11.836  -2.337
  554    H    VAL  76           H        VAL  76 -17.707   8.445  -6.542
  555    HA   VAL  76           HA       VAL  76 -19.666   6.596  -5.384
  556    HB   VAL  76           HB       VAL  76 -18.554   4.642  -6.389
  557   HG11  VAL  76          HG11      VAL  76 -20.579   5.438  -7.423
  558   HG12  VAL  76          HG12      VAL  76 -19.464   4.873  -8.668
  559   HG13  VAL  76          HG13      VAL  76 -19.667   6.602  -8.385
  560   HG21  VAL  76          HG21      VAL  76 -17.082   6.666  -8.065
  561   HG22  VAL  76          HG22      VAL  76 -17.049   4.917  -8.295
  562   HG23  VAL  76          HG23      VAL  76 -16.378   5.627  -6.826
  563    H    GLU  77           H        GLU  77 -18.675   4.976  -3.992
  564    HA   GLU  77           HA       GLU  77 -16.102   5.883  -2.890
  565    HB2  GLU  77           HB2      GLU  77 -17.929   5.799  -1.251
  566    HB3  GLU  77           HB3      GLU  77 -18.223   4.112  -1.651
  567    HG2  GLU  77           HG2      GLU  77 -15.962   3.557  -0.844
  568    HG3  GLU  77           HG3      GLU  77 -15.742   5.241  -0.368
  569    H    LEU  78           H        LEU  78 -14.397   4.772  -3.578
  570    HA   LEU  78           HA       LEU  78 -14.711   1.962  -4.344
  571    HG   LEU  78           HG       LEU  78 -11.777   2.217  -6.607
  572    HB2  LEU  78           HB2      LEU  78 -13.523   3.573  -5.857
  573    HB3  LEU  78           HB3      LEU  78 -12.297   3.766  -4.624
  574   HD11  LEU  78          HD11      LEU  78 -11.463   1.158  -3.799
  575   HD12  LEU  78          HD12      LEU  78 -10.388   2.295  -4.610
  576   HD13  LEU  78          HD13      LEU  78 -10.535   0.642  -5.207
  577   HD21  LEU  78          HD21      LEU  78 -13.898   1.020  -6.640
  578   HD22  LEU  78          HD22      LEU  78 -13.576   0.378  -5.029
  579   HD23  LEU  78          HD23      LEU  78 -12.549  -0.088  -6.386
  580    H    ASP  79           H        ASP  79 -14.417   0.522  -2.832
  581    HA   ASP  79           HA       ASP  79 -12.547   1.094  -0.619
  582    HB2  ASP  79           HB2      ASP  79 -14.861   1.173   0.179
  583    HB3  ASP  79           HB3      ASP  79 -15.171  -0.415  -0.512
  584    H    ALA  80           H        ALA  80 -10.802  -0.132  -0.998
  585    HA   ALA  80           HA       ALA  80 -11.260  -2.888  -1.950
  586    HB1  ALA  80           HB1      ALA  80 -10.188  -1.488  -3.643
  587    HB2  ALA  80           HB2      ALA  80  -9.109  -2.766  -3.084
  588    HB3  ALA  80           HB3      ALA  80  -8.888  -1.113  -2.511
  589    H    ALA  81           H        ALA  81 -10.703  -4.425  -0.576
  590    HA   ALA  81           HA       ALA  81  -8.674  -3.827   1.483
  591    HB1  ALA  81           HB1      ALA  81  -9.639  -5.711   2.730
  592    HB2  ALA  81           HB2      ALA  81 -10.809  -5.966   1.437
  593    HB3  ALA  81           HB3      ALA  81 -10.846  -4.475   2.378
  594    H    PHE  82           H        PHE  82  -6.748  -4.397   0.612
  595    HA   PHE  82           HA       PHE  82  -6.508  -6.857  -0.964
  596    HD1  PHE  82           HD2      PHE  82  -5.463  -6.071  -3.575
  597    HD2  PHE  82           HD1      PHE  82  -5.521  -2.746  -0.916
  598    HE1  PHE  82           HE2      PHE  82  -6.252  -4.623  -5.402
  599    HE2  PHE  82           HE1      PHE  82  -6.306  -1.296  -2.740
  600    HZ   PHE  82           HZ       PHE  82  -6.673  -2.236  -4.985
  601    HB2  PHE  82           HB2      PHE  82  -4.430  -4.751  -0.297
  602    HB3  PHE  82           HB3      PHE  82  -4.217  -6.077  -1.428
  603    H    THR  83           H        THR  83  -5.772  -8.719  -0.089
  604    HA   THR  83           HA       THR  83  -4.659  -8.599   2.617
  605    HB   THR  83           HB       THR  83  -5.511 -11.038   1.041
  606    HG1  THR  83           HG1      THR  83  -7.005  -9.086   2.035
  607   HG21  THR  83          HG21      THR  83  -5.097 -10.607   4.003
  608   HG22  THR  83          HG22      THR  83  -4.006 -11.488   2.935
  609   HG23  THR  83          HG23      THR  83  -5.630 -12.106   3.237
  610    H    PHE  84           H        PHE  84  -2.646  -9.505   3.110
  611    HA   PHE  84           HA       PHE  84  -0.982 -10.213   0.787
  612    HD1  PHE  84           HD1      PHE  84   0.728  -8.163  -0.296
  613    HD2  PHE  84           HD2      PHE  84  -1.607  -6.778   2.972
  614    HE1  PHE  84           HE1      PHE  84   0.189  -6.122  -1.557
  615    HE2  PHE  84           HE2      PHE  84  -2.152  -4.733   1.723
  616    HZ   PHE  84           HZ       PHE  84  -1.257  -4.404  -0.547
  617    HB2  PHE  84           HB2      PHE  84  -0.153  -8.639   3.234
  618    HB3  PHE  84           HB3      PHE  84   0.929  -9.149   1.939
  619    H    SER  85           H        SER  85   0.532 -11.843   1.080
  620    HA   SER  85           HA       SER  85  -0.165 -13.887   2.885
  621    HG   SER  85           HG       SER  85   0.326 -15.018   0.312
  622    HB2  SER  85           HB2      SER  85   2.462 -13.605   1.417
  623    HB3  SER  85           HB3      SER  85   1.690 -15.096   1.957
  624    H    CYS  86           H        CYS  86   2.127 -11.274   3.055
  625    HA   CYS  86           HA       CYS  86   2.813 -12.064   5.795
  626    HG   CYS  86           HG       CYS  86   5.991 -13.241   3.176
  627    HB2  CYS  86           HB2      CYS  86   4.824 -10.977   3.812
  628    HB3  CYS  86           HB3      CYS  86   5.141 -11.531   5.450
  629    H    GLN  87           H        GLN  87   3.673 -10.211   7.055
  630    HA   GLN  87           HA       GLN  87   2.162  -7.841   6.500
  631    HB2  GLN  87           HB2      GLN  87   2.469  -8.579   8.803
  632    HB3  GLN  87           HB3      GLN  87   4.213  -8.400   8.650
  633    HG2  GLN  87           HG2      GLN  87   4.083  -6.072   8.582
  634    HG3  GLN  87           HG3      GLN  87   2.358  -6.082   8.227
  635   HE21  GLN  87          HE21      GLN  87   0.899  -6.563   9.914
  636   HE22  GLN  87          HE22      GLN  87   1.359  -6.411  11.573
  637    H    ALA  88           H        ALA  88   5.432  -8.911   6.042
  638    HA   ALA  88           HA       ALA  88   6.683  -6.482   5.469
  639    HB1  ALA  88           HB1      ALA  88   7.134  -9.135   4.099
  640    HB2  ALA  88           HB2      ALA  88   7.861  -8.640   5.628
  641    HB3  ALA  88           HB3      ALA  88   8.255  -7.775   4.142
  642    H    GLU  89           H        GLU  89   4.749  -8.614   3.407
  643    HA   GLU  89           HA       GLU  89   4.981  -7.158   1.011
  644    HB2  GLU  89           HB2      GLU  89   2.422  -8.569   1.648
  645    HB3  GLU  89           HB3      GLU  89   3.340  -8.550   0.152
  646    HG2  GLU  89           HG2      GLU  89   3.999 -10.095   2.647
  647    HG3  GLU  89           HG3      GLU  89   3.375 -10.745   1.135
  648    H    MET  90           H        MET  90   2.766  -6.969   3.719
  649    HA   MET  90           HA       MET  90   0.889  -5.144   2.832
  650    HB2  MET  90           HB2      MET  90   0.610  -6.247   4.939
  651    HB3  MET  90           HB3      MET  90   2.117  -5.584   5.555
  652    HG2  MET  90           HG2      MET  90   0.539  -4.309   6.624
  653    HG3  MET  90           HG3      MET  90   0.957  -3.296   5.245
  654    HE1  MET  90           HE1      MET  90  -1.594  -2.697   6.879
  655    HE2  MET  90           HE2      MET  90  -2.809  -2.491   5.620
  656    HE3  MET  90           HE3      MET  90  -1.188  -1.832   5.397
  657    H    ILE  91           H        ILE  91   3.885  -4.417   4.631
  658    HA   ILE  91           HA       ILE  91   3.450  -1.616   4.465
  659    HB   ILE  91           HB       ILE  91   5.966  -1.603   5.223
  660   HG12  ILE  91          HG12      ILE  91   5.121  -4.393   6.012
  661   HG13  ILE  91          HG13      ILE  91   6.229  -4.056   4.693
  662   HG21  ILE  91          HG21      ILE  91   3.696  -2.591   6.946
  663   HG22  ILE  91          HG22      ILE  91   4.073  -0.908   6.577
  664   HG23  ILE  91          HG23      ILE  91   5.195  -1.874   7.536
  665   HD11  ILE  91          HD11      ILE  91   6.653  -3.394   7.598
  666   HD12  ILE  91          HD12      ILE  91   7.766  -2.993   6.290
  667   HD13  ILE  91          HD13      ILE  91   7.441  -4.681   6.685
  668    H    ILE  92           H        ILE  92   5.485  -3.841   2.563
  669    HA   ILE  92           HA       ILE  92   6.903  -1.761   1.265
  670    HB   ILE  92           HB       ILE  92   7.570  -3.426  -0.413
  671   HG12  ILE  92          HG12      ILE  92   6.850  -5.883   0.370
  672   HG13  ILE  92          HG13      ILE  92   5.391  -5.018   0.839
  673   HG21  ILE  92          HG21      ILE  92   7.749  -4.367   2.436
  674   HG22  ILE  92          HG22      ILE  92   8.833  -3.237   1.625
  675   HG23  ILE  92          HG23      ILE  92   8.775  -4.924   1.114
  676   HD11  ILE  92          HD11      ILE  92   5.167  -5.968  -1.379
  677   HD12  ILE  92          HD12      ILE  92   6.603  -5.097  -1.917
  678   HD13  ILE  92          HD13      ILE  92   5.150  -4.206  -1.460
  679    H    PHE  93           H        PHE  93   3.827  -3.297   0.662
  680    HA   PHE  93           HA       PHE  93   3.385  -2.190  -1.910
  681    HD1  PHE  93           HD2      PHE  93   1.799  -3.465  -3.474
  682    HD2  PHE  93           HD1      PHE  93  -0.670  -1.985  -0.339
  683    HE1  PHE  93           HE2      PHE  93   0.024  -2.987  -5.106
  684    HE2  PHE  93           HE1      PHE  93  -2.453  -1.506  -1.967
  685    HZ   PHE  93           HZ       PHE  93  -2.104  -2.005  -4.355
  686    HB2  PHE  93           HB2      PHE  93   2.079  -4.081  -0.957
  687    HB3  PHE  93           HB3      PHE  93   1.344  -2.967   0.189
  688    H    GLU  94           H        GLU  94   2.419  -1.176   1.350
  689    HA   GLU  94           HA       GLU  94   1.156   1.216   0.731
  690    HB2  GLU  94           HB2      GLU  94   2.804   0.475   3.156
  691    HB3  GLU  94           HB3      GLU  94   1.817   1.926   3.050
  692    HG2  GLU  94           HG2      GLU  94   0.705  -0.847   2.714
  693    HG3  GLU  94           HG3      GLU  94   0.786  -0.015   4.267
  694    H    LEU  95           H        LEU  95   4.603   0.644   1.440
  695    HA   LEU  95           HA       LEU  95   5.533   3.257   1.221
  696    HG   LEU  95           HG       LEU  95   6.373   0.697   2.779
  697    HB2  LEU  95           HB2      LEU  95   6.911   0.705   0.379
  698    HB3  LEU  95           HB3      LEU  95   7.711   2.253   0.565
  699   HD11  LEU  95          HD11      LEU  95   8.424  -0.362   1.989
  700   HD12  LEU  95          HD12      LEU  95   8.645   0.333   3.595
  701   HD13  LEU  95          HD13      LEU  95   9.292   1.161   2.179
  702   HD21  LEU  95          HD21      LEU  95   8.012   3.225   2.882
  703   HD22  LEU  95          HD22      LEU  95   7.340   2.357   4.263
  704   HD23  LEU  95          HD23      LEU  95   6.265   3.127   3.098
  705    H    SER  96           H        SER  96   5.068   0.841  -1.301
  706    HA   SER  96           HA       SER  96   6.148   2.335  -3.423
  707    HG   SER  96           HG       SER  96   5.748  -0.769  -2.539
  708    HB2  SER  96           HB2      SER  96   4.058   0.154  -3.545
  709    HB3  SER  96           HB3      SER  96   5.101   0.681  -4.868
  710    H    LEU  97           H        LEU  97   2.866   2.095  -2.127
  711    HA   LEU  97           HA       LEU  97   1.545   3.461  -4.202
  712    HG   LEU  97           HG       LEU  97   0.906   1.087  -2.094
  713    HB2  LEU  97           HB2      LEU  97   0.810   3.365  -1.277
  714    HB3  LEU  97           HB3      LEU  97  -0.256   3.828  -2.587
  715   HD11  LEU  97          HD11      LEU  97  -1.921   2.134  -1.990
  716   HD12  LEU  97          HD12      LEU  97  -0.926   1.673  -0.608
  717   HD13  LEU  97          HD13      LEU  97  -1.437   0.453  -1.775
  718   HD21  LEU  97          HD21      LEU  97  -0.443   0.371  -4.017
  719   HD22  LEU  97          HD22      LEU  97   0.808   1.521  -4.488
  720   HD23  LEU  97          HD23      LEU  97  -0.867   2.052  -4.341
  721    H    ARG  98           H        ARG  98   3.120   4.608  -1.267
  722    HA   ARG  98           HA       ARG  98   2.297   7.331  -1.641
  723    HE   ARG  98           HE       ARG  98   0.349   6.311   2.375
  724    HB2  ARG  98           HB2      ARG  98   4.253   5.990   0.210
  725    HB3  ARG  98           HB3      ARG  98   4.163   7.742   0.108
  726    HG2  ARG  98           HG2      ARG  98   2.856   6.871   1.973
  727    HG3  ARG  98           HG3      ARG  98   1.833   7.690   0.793
  728    HD2  ARG  98           HD2      ARG  98   1.180   5.542  -0.147
  729    HD3  ARG  98           HD3      ARG  98   2.239   4.712   0.987
  730   HH11  ARG  98          HH11      ARG  98   0.681   3.348   0.548
  731   HH12  ARG  98          HH12      ARG  98  -0.616   2.523   1.362
  732   HH21  ARG  98          HH21      ARG  98  -1.377   5.214   3.477
  733   HH22  ARG  98          HH22      ARG  98  -1.780   3.586   3.013
  734    H    SER  99           H        SER  99   5.044   5.386  -2.557
  735    HA   SER  99           HA       SER  99   6.630   7.582  -3.486
  736    HG   SER  99           HG       SER  99   7.017   4.825  -2.034
  737    HB2  SER  99           HB2      SER  99   6.799   4.659  -4.252
  738    HB3  SER  99           HB3      SER  99   8.063   5.872  -4.455
  739    H    LEU 100           H        LEU 100   3.765   6.454  -4.534
  740    HA   LEU 100           HA       LEU 100   4.345   6.846  -7.389
  741    HG   LEU 100           HG       LEU 100   2.966   5.600  -8.974
  742    HB2  LEU 100           HB2      LEU 100   3.343   4.661  -6.574
  743    HB3  LEU 100           HB3      LEU 100   1.902   5.565  -6.167
  744   HD11  LEU 100          HD11      LEU 100   2.796   3.253  -8.384
  745   HD12  LEU 100          HD12      LEU 100   1.492   3.701  -9.482
  746   HD13  LEU 100          HD13      LEU 100   1.165   3.506  -7.760
  747   HD21  LEU 100          HD21      LEU 100   1.211   7.190  -8.424
  748   HD22  LEU 100          HD22      LEU 100   0.202   5.886  -7.798
  749   HD23  LEU 100          HD23      LEU 100   0.598   5.950  -9.517
  750    H    ALA 101           H        ALA 101   1.537   7.291  -5.219
  751    HA   ALA 101           HA       ALA 101   0.776   9.608  -6.849
  752    HB1  ALA 101           HB1      ALA 101  -1.452   9.326  -5.926
  753    HB2  ALA 101           HB2      ALA 101  -0.868   8.045  -4.862
  754    HB3  ALA 101           HB3      ALA 101  -0.865   7.811  -6.610
  755    H    LEU 102           H        LEU 102   1.669   8.756  -3.590
  756    HA   LEU 102           HA       LEU 102   1.006  11.470  -2.673
  757    HG   LEU 102           HG       LEU 102  -0.634   8.862  -2.132
  758    HB2  LEU 102           HB2      LEU 102   1.595   8.981  -1.063
  759    HB3  LEU 102           HB3      LEU 102   1.174  10.547  -0.399
  760   HD11  LEU 102          HD11      LEU 102  -0.268   7.871   0.073
  761   HD12  LEU 102          HD12      LEU 102  -1.910   8.492  -0.093
  762   HD13  LEU 102          HD13      LEU 102  -0.714   9.399   0.834
  763   HD21  LEU 102          HD21      LEU 102  -2.356  10.480  -1.489
  764   HD22  LEU 102          HD22      LEU 102  -1.046  11.249  -2.387
  765   HD23  LEU 102          HD23      LEU 102  -1.140  11.432  -0.636
  766    H    GLU 103           H        GLU 103   3.101  11.559  -4.196
  767    HA   GLU 103           HA       GLU 103   5.606  10.697  -3.395
  768    HB2  GLU 103           HB2      GLU 103   5.040  13.294  -4.825
  769    HB3  GLU 103           HB3      GLU 103   6.492  12.308  -4.934
  770    HG2  GLU 103           HG2      GLU 103   5.446  10.679  -6.215
  771    HG3  GLU 103           HG3      GLU 103   3.832  11.218  -5.750
  772    H    HIS 104           H        HIS 104   4.234  13.957  -2.919
  773    HA   HIS 104           HA       HIS 104   6.279  14.572  -0.980
  774    HD1  HIS 104           HD1      HIS 104   3.718  15.858  -4.112
  775    HD2  HIS 104           HD2      HIS 104   2.289  16.966  -0.359
  776    HE1  HIS 104           HE1      HIS 104   1.279  16.370  -4.433
  777    HE2  HIS 104           HE2      HIS 104   0.405  16.913  -2.132
  778    HB2  HIS 104           HB2      HIS 104   5.032  16.733  -0.697
  779    HB3  HIS 104           HB3      HIS 104   5.572  16.417  -2.339
  780    H    HIS 105           H        HIS 105   6.159  13.499   0.860
  781    HA   HIS 105           HA       HIS 105   3.550  13.334   2.199
  782    HD1  HIS 105           HD1      HIS 105   1.973  10.707   2.703
  783    HD2  HIS 105           HD2      HIS 105   5.624  10.309   4.657
  784    HE1  HIS 105           HE1      HIS 105   1.472   9.464   4.825
  785    HE2  HIS 105           HE2      HIS 105   3.676   9.324   6.049
  786    HB2  HIS 105           HB2      HIS 105   4.094  11.164   1.209
  787    HB3  HIS 105           HB3      HIS 105   5.653  11.164   2.019
  788    H    HIS 106           H        HIS 106   4.256  15.231   3.373
  789    HA   HIS 106           HA       HIS 106   6.321  14.733   5.367
  790    HD1  HIS 106           HD1      HIS 106   8.077  17.160   6.186
  791    HD2  HIS 106           HD2      HIS 106   4.252  17.735   7.699
  792    HE1  HIS 106           HE1      HIS 106   8.399  18.089   8.498
  793    HE2  HIS 106           HE2      HIS 106   6.077  18.199   9.473
  794    HB2  HIS 106           HB2      HIS 106   6.185  17.001   4.410
  795    HB3  HIS 106           HB3      HIS 106   4.526  17.149   4.985
  796    H    HIS 107           H        HIS 107   5.595  13.199   6.725
  797    HA   HIS 107           HA       HIS 107   3.396  13.911   8.482
  798    HD1  HIS 107           HD1      HIS 107   0.098  11.914   7.120
  799    HD2  HIS 107           HD2      HIS 107   2.735  11.165  10.253
  800    HE1  HIS 107           HE1      HIS 107  -1.320  11.085   9.023
  801    HE2  HIS 107           HE2      HIS 107   0.293  10.594  10.896
  802    HB2  HIS 107           HB2      HIS 107   2.413  12.580   6.557
  803    HB3  HIS 107           HB3      HIS 107   3.403  11.226   7.081
  804    H    HIS 108           H        HIS 108   4.750  14.011  10.183
  805    HA   HIS 108           HA       HIS 108   6.054  13.345  11.916
  806    HD1  HIS 108           HD1      HIS 108   7.935   9.802  12.040
  807    HD2  HIS 108           HD2      HIS 108   5.196  11.528  14.654
  808    HE1  HIS 108           HE1      HIS 108   8.776   9.278  14.349
  809    HE2  HIS 108           HE2      HIS 108   7.010  10.171  15.904
  810    HB2  HIS 108           HB2      HIS 108   4.510  11.360  11.974
  811    HB3  HIS 108           HB3      HIS 108   5.653  10.505  10.944
  812    H    HIS 109           H        HIS 109   7.974  14.195  11.421
  813    HA   HIS 109           HA       HIS 109   9.614  13.581   9.284
  814    HD1  HIS 109           HD1      HIS 109   8.904  15.352  13.202
  815    HD2  HIS 109           HD2      HIS 109  12.726  13.811  12.632
  816    HE1  HIS 109           HE1      HIS 109   9.866  15.042  15.511
  817    HE2  HIS 109           HE2      HIS 109  12.239  14.270  15.129
  818    HB2  HIS 109           HB2      HIS 109  11.377  14.771  10.419
  819    HB3  HIS 109           HB3      HIS 109   9.854  15.582  10.749
  Start of MODEL   13
    1    HA   MET   1           HA       MET   1  51.300 -24.183  -1.510
    2    H1   MET   1           H1       MET   1  52.460 -24.844  -3.447
    3    H2   MET   1           H2       MET   1  53.343 -25.369  -2.095
    4    H3   MET   1           H3       MET   1  53.861 -24.016  -2.974
    5    HB2  MET   1           HB2      MET   1  52.297 -22.713   0.171
    6    HB3  MET   1           HB3      MET   1  53.185 -24.222   0.063
    7    HG2  MET   1           HG2      MET   1  54.052 -21.670  -1.273
    8    HG3  MET   1           HG3      MET   1  54.587 -22.178   0.327
    9    HE1  MET   1           HE1      MET   1  57.747 -22.734  -1.952
   10    HE2  MET   1           HE2      MET   1  57.118 -21.928  -0.514
   11    HE3  MET   1           HE3      MET   1  56.543 -21.454  -2.112
   12    H    ALA   2           H        ALA   2  49.876 -22.751  -2.200
   13    HA   ALA   2           HA       ALA   2  50.510 -20.089  -2.951
   14    HB1  ALA   2           HB1      ALA   2  49.938 -20.192  -5.326
   15    HB2  ALA   2           HB2      ALA   2  49.805 -21.946  -5.222
   16    HB3  ALA   2           HB3      ALA   2  51.366 -21.167  -4.974
   17    H    MET   3           H        MET   3  48.640 -18.855  -3.449
   18    HA   MET   3           HA       MET   3  46.080 -20.250  -3.072
   19    HB2  MET   3           HB2      MET   3  45.217 -18.269  -1.905
   20    HB3  MET   3           HB3      MET   3  46.601 -18.946  -1.056
   21    HG2  MET   3           HG2      MET   3  48.031 -17.219  -2.035
   22    HG3  MET   3           HG3      MET   3  46.630 -16.539  -2.862
   23    HE1  MET   3           HE1      MET   3  44.355 -16.893  -0.647
   24    HE2  MET   3           HE2      MET   3  44.561 -15.423  -1.599
   25    HE3  MET   3           HE3      MET   3  44.433 -15.325   0.157
   26    H    LYS   4           H        LYS   4  44.390 -19.575  -4.401
   27    HA   LYS   4           HA       LYS   4  44.818 -17.419  -6.272
   28    HB2  LYS   4           HB2      LYS   4  44.495 -19.045  -8.247
   29    HB3  LYS   4           HB3      LYS   4  46.092 -18.925  -7.518
   30    HG2  LYS   4           HG2      LYS   4  45.675 -20.960  -6.246
   31    HG3  LYS   4           HG3      LYS   4  44.060 -21.073  -6.945
   32    HD2  LYS   4           HD2      LYS   4  45.004 -21.350  -9.158
   33    HD3  LYS   4           HD3      LYS   4  46.634 -21.140  -8.515
   34    HE2  LYS   4           HE2      LYS   4  46.095 -23.505  -8.889
   35    HE3  LYS   4           HE3      LYS   4  46.395 -23.157  -7.186
   36    HZ1  LYS   4           HZ1      LYS   4  43.717 -23.436  -8.454
   37    HZ2  LYS   4           HZ2      LYS   4  44.004 -23.101  -6.815
   38    HZ3  LYS   4           HZ3      LYS   4  44.474 -24.590  -7.468
   39    H    ASP   5           H        ASP   5  42.911 -16.500  -5.820
   40    HA   ASP   5           HA       ASP   5  40.577 -17.887  -6.897
   41    HB2  ASP   5           HB2      ASP   5  39.144 -17.327  -5.077
   42    HB3  ASP   5           HB3      ASP   5  40.561 -18.096  -4.377
   43    H    VAL   6           H        VAL   6  38.818 -16.358  -7.443
   44    HA   VAL   6           HA       VAL   6  39.782 -13.613  -7.853
   45    HB   VAL   6           HB       VAL   6  38.804 -13.609 -10.137
   46   HG11  VAL   6          HG11      VAL   6  41.208 -13.908  -9.846
   47   HG12  VAL   6          HG12      VAL   6  40.625 -14.831 -11.231
   48   HG13  VAL   6          HG13      VAL   6  40.985 -15.654  -9.714
   49   HG21  VAL   6          HG21      VAL   6  37.247 -15.467  -9.887
   50   HG22  VAL   6          HG22      VAL   6  38.595 -16.594  -9.735
   51   HG23  VAL   6          HG23      VAL   6  38.329 -15.738 -11.253
   52    H    VAL   7           H        VAL   7  38.027 -12.088  -8.344
   53    HA   VAL   7           HA       VAL   7  35.404 -13.070  -7.448
   54    HB   VAL   7           HB       VAL   7  36.450 -11.932  -5.559
   55   HG11  VAL   7          HG11      VAL   7  36.584  -9.508  -7.344
   56   HG12  VAL   7          HG12      VAL   7  37.958 -10.446  -6.759
   57   HG13  VAL   7          HG13      VAL   7  36.958  -9.547  -5.621
   58   HG21  VAL   7          HG21      VAL   7  34.044 -11.792  -5.781
   59   HG22  VAL   7          HG22      VAL   7  34.197 -10.352  -6.788
   60   HG23  VAL   7          HG23      VAL   7  34.678 -10.298  -5.091
   61    H    ASP   8           H        ASP   8  33.759 -12.502  -8.687
   62    HA   ASP   8           HA       ASP   8  33.824 -10.014 -10.187
   63    HB2  ASP   8           HB2      ASP   8  34.719 -11.643 -11.794
   64    HB3  ASP   8           HB3      ASP   8  33.319 -12.680 -11.535
   65    H    LYS   9           H        LYS   9  32.138  -9.112  -9.233
   66    HA   LYS   9           HA       LYS   9  29.506 -10.253  -9.534
   67    HB2  LYS   9           HB2      LYS   9  30.355 -11.371  -7.480
   68    HB3  LYS   9           HB3      LYS   9  30.612  -9.790  -6.755
   69    HG2  LYS   9           HG2      LYS   9  28.189  -9.348  -6.946
   70    HG3  LYS   9           HG3      LYS   9  27.971 -10.986  -7.566
   71    HD2  LYS   9           HD2      LYS   9  29.098 -10.253  -4.860
   72    HD3  LYS   9           HD3      LYS   9  27.472 -10.866  -5.169
   73    HE2  LYS   9           HE2      LYS   9  28.379 -12.956  -5.980
   74    HE3  LYS   9           HE3      LYS   9  30.022 -12.344  -5.807
   75    HZ1  LYS   9           HZ1      LYS   9  29.610 -12.150  -3.400
   76    HZ2  LYS   9           HZ2      LYS   9  29.498 -13.747  -3.955
   77    HZ3  LYS   9           HZ3      LYS   9  28.089 -12.868  -3.613
   78    H    CYS  10           H        CYS  10  28.476  -8.524 -10.301
   79    HA   CYS  10           HA       CYS  10  28.577  -6.025  -8.788
   80    HG   CYS  10           HG       CYS  10  31.211  -6.173  -9.272
   81    HB2  CYS  10           HB2      CYS  10  29.096  -6.195 -11.766
   82    HB3  CYS  10           HB3      CYS  10  28.853  -4.703 -10.866
   83    H    SER  11           H        SER  11  26.664  -8.189  -9.206
   84    HA   SER  11           HA       SER  11  24.569  -7.125 -10.873
   85    HG   SER  11           HG       SER  11  24.887  -9.092  -7.980
   86    HB2  SER  11           HB2      SER  11  23.272  -9.055  -9.772
   87    HB3  SER  11           HB3      SER  11  24.659  -9.494 -10.770
   88    H    THR  12           H        THR  12  23.914  -5.153 -10.074
   89    HA   THR  12           HA       THR  12  22.327  -5.228  -7.656
   90    HB   THR  12           HB       THR  12  24.683  -3.336  -7.860
   91    HG1  THR  12           HG1      THR  12  24.521  -5.784  -6.889
   92   HG21  THR  12          HG21      THR  12  23.960  -2.525  -5.655
   93   HG22  THR  12          HG22      THR  12  22.530  -3.554  -5.749
   94   HG23  THR  12          HG23      THR  12  22.737  -2.224  -6.889
   95    H    LYS  13           H        LYS  13  20.528  -4.672  -8.740
   96    HA   LYS  13           HA       LYS  13  20.290  -1.853  -9.345
   97    HB2  LYS  13           HB2      LYS  13  19.076  -2.288 -11.495
   98    HB3  LYS  13           HB3      LYS  13  20.802  -2.608 -11.559
   99    HG2  LYS  13           HG2      LYS  13  20.479  -4.934 -11.567
  100    HG3  LYS  13           HG3      LYS  13  18.794  -4.784 -11.068
  101    HD2  LYS  13           HD2      LYS  13  19.072  -5.346 -13.467
  102    HD3  LYS  13           HD3      LYS  13  18.191  -3.844 -13.192
  103    HE2  LYS  13           HE2      LYS  13  20.212  -2.557 -13.675
  104    HE3  LYS  13           HE3      LYS  13  21.117  -4.051 -13.905
  105    HZ1  LYS  13           HZ1      LYS  13  19.893  -4.560 -15.838
  106    HZ2  LYS  13           HZ2      LYS  13  20.310  -2.921 -15.982
  107    HZ3  LYS  13           HZ3      LYS  13  18.738  -3.358 -15.528
  108    H    GLY  14           H        GLY  14  18.217  -1.083  -9.065
  109    HA2  GLY  14           HA2      GLY  14  15.818  -2.330  -8.963
  110    HA3  GLY  14           HA3      GLY  14  16.535  -2.767  -7.420
  111    H    CYS  15           H        CYS  15  17.404   0.293  -8.752
  112    HA   CYS  15           HA       CYS  15  16.149   1.647  -6.545
  113    HG   CYS  15           HG       CYS  15  20.031   2.653  -7.942
  114    HB2  CYS  15           HB2      CYS  15  17.606   2.817  -8.922
  115    HB3  CYS  15           HB3      CYS  15  17.243   3.635  -7.405
  116    H    ALA  16           H        ALA  16  14.031   2.008  -6.607
  117    HA   ALA  16           HA       ALA  16  12.860   3.335  -8.911
  118    HB1  ALA  16           HB1      ALA  16  12.675   0.981  -9.530
  119    HB2  ALA  16           HB2      ALA  16  11.087   1.685  -9.229
  120    HB3  ALA  16           HB3      ALA  16  11.834   0.642  -8.018
  121    H    ILE  17           H        ILE  17  12.138   1.696  -5.833
  122    HA   ILE  17           HA       ILE  17   9.791   3.271  -5.394
  123    HB   ILE  17           HB       ILE  17   9.884   1.012  -4.523
  124   HG12  ILE  17          HG12      ILE  17   9.864   2.987  -2.233
  125   HG13  ILE  17          HG13      ILE  17   8.526   2.743  -3.351
  126   HG21  ILE  17          HG21      ILE  17  12.265   0.834  -4.082
  127   HG22  ILE  17          HG22      ILE  17  11.330   0.389  -2.655
  128   HG23  ILE  17          HG23      ILE  17  12.118   1.966  -2.737
  129   HD11  ILE  17          HD11      ILE  17   8.334   0.424  -2.609
  130   HD12  ILE  17          HD12      ILE  17   8.150   1.560  -1.273
  131   HD13  ILE  17          HD13      ILE  17   9.664   0.680  -1.479
  132    H    ASP  18           H        ASP  18   9.610   5.184  -4.477
  133    HA   ASP  18           HA       ASP  18  11.833   6.211  -2.862
  134    HB2  ASP  18           HB2      ASP  18  12.190   7.055  -5.133
  135    HB3  ASP  18           HB3      ASP  18  10.543   7.673  -5.184
  136    H    ILE  19           H        ILE  19  10.512   5.917  -1.024
  137    HA   ILE  19           HA       ILE  19   8.583   8.065  -0.723
  138    HB   ILE  19           HB       ILE  19   7.481   6.299   0.974
  139   HG12  ILE  19          HG12      ILE  19   7.099   4.201  -0.325
  140   HG13  ILE  19          HG13      ILE  19   8.399   4.669  -1.400
  141   HG21  ILE  19          HG21      ILE  19   6.772   6.678  -1.922
  142   HG22  ILE  19          HG22      ILE  19   6.301   7.722  -0.580
  143   HG23  ILE  19          HG23      ILE  19   5.684   6.071  -0.672
  144   HD11  ILE  19          HD11      ILE  19   9.963   4.580   0.474
  145   HD12  ILE  19          HD12      ILE  19   9.136   3.041   0.244
  146   HD13  ILE  19          HD13      ILE  19   8.645   4.119   1.551
  147    H    GLY  20           H        GLY  20   9.196   9.333   0.757
  148    HA2  GLY  20           HA2      GLY  20  10.924   8.462   2.936
  149    HA3  GLY  20           HA3      GLY  20  10.485  10.124   2.559
  150    H    THR  21           H        THR  21   8.496   7.253   3.134
  151    HA   THR  21           HA       THR  21   7.295   8.587   5.454
  152    HB   THR  21           HB       THR  21   5.701   7.256   3.246
  153    HG1  THR  21           HG1      THR  21   6.103  10.000   3.915
  154   HG21  THR  21          HG21      THR  21   4.674   7.050   5.467
  155   HG22  THR  21          HG22      THR  21   3.749   8.135   4.429
  156   HG23  THR  21          HG23      THR  21   4.799   8.797   5.681
  157    H    VAL  22           H        VAL  22   7.021   7.247   7.149
  158    HA   VAL  22           HA       VAL  22   7.428   4.373   6.659
  159    HB   VAL  22           HB       VAL  22   8.307   4.250   8.975
  160   HG11  VAL  22          HG11      VAL  22  10.482   5.241   8.485
  161   HG12  VAL  22          HG12      VAL  22   9.763   6.178   7.175
  162   HG13  VAL  22          HG13      VAL  22   9.825   4.417   7.071
  163   HG21  VAL  22          HG21      VAL  22   8.938   6.281  10.151
  164   HG22  VAL  22          HG22      VAL  22   7.198   6.252   9.861
  165   HG23  VAL  22          HG23      VAL  22   8.243   7.260   8.861
  166    H    ILE  23           H        ILE  23   6.553   3.013   8.496
  167    HA   ILE  23           HA       ILE  23   4.170   4.027   9.796
  168    HB   ILE  23           HB       ILE  23   3.265   3.357   7.634
  169   HG12  ILE  23          HG12      ILE  23   2.627   1.302   9.764
  170   HG13  ILE  23          HG13      ILE  23   1.899   2.899   9.630
  171   HG21  ILE  23          HG21      ILE  23   4.578   0.699   8.162
  172   HG22  ILE  23          HG22      ILE  23   4.986   1.850   6.889
  173   HG23  ILE  23          HG23      ILE  23   3.432   1.015   6.862
  174   HD11  ILE  23          HD11      ILE  23   1.636   0.647   7.654
  175   HD12  ILE  23          HD12      ILE  23   0.946   2.257   7.464
  176   HD13  ILE  23          HD13      ILE  23   0.401   1.215   8.777
  177    H    ASP  24           H        ASP  24   3.585   2.761  11.590
  178    HA   ASP  24           HA       ASP  24   5.708   1.144  12.632
  179    HB2  ASP  24           HB2      ASP  24   3.022   1.949  13.725
  180    HB3  ASP  24           HB3      ASP  24   4.056   0.799  14.568
  181    H    ASN  25           H        ASN  25   2.288   0.260  12.792
  182    HA   ASN  25           HA       ASN  25   2.539  -2.104  11.241
  183    HB2  ASN  25           HB2      ASN  25   2.486  -3.780  12.990
  184    HB3  ASN  25           HB3      ASN  25   3.899  -2.762  13.238
  185   HD21  ASN  25          HD21      ASN  25   0.891  -3.833  14.510
  186   HD22  ASN  25          HD22      ASN  25   0.995  -3.009  16.029
  187    H    ASP  26           H        ASP  26   0.562  -3.211  11.050
  188    HA   ASP  26           HA       ASP  26  -1.676  -2.241  12.665
  189    HB2  ASP  26           HB2      ASP  26  -1.743  -0.930  10.574
  190    HB3  ASP  26           HB3      ASP  26  -1.754  -2.423   9.641
  191    H    ASN  27           H        ASN  27  -1.802  -4.200   9.756
  192    HA   ASN  27           HA       ASN  27  -1.947  -6.682  11.283
  193    HB2  ASN  27           HB2      ASN  27  -4.187  -5.621   9.539
  194    HB3  ASN  27           HB3      ASN  27  -4.035  -7.323   9.955
  195   HD21  ASN  27          HD21      ASN  27  -4.850  -4.153  11.070
  196   HD22  ASN  27          HD22      ASN  27  -5.504  -4.641  12.602
  197    H    CYS  28           H        CYS  28  -2.923  -8.193   9.013
  198    HA   CYS  28           HA       CYS  28  -0.761  -7.713   7.077
  199    HG   CYS  28           HG       CYS  28   0.974 -10.060   8.355
  200    HB2  CYS  28           HB2      CYS  28  -2.305 -10.277   7.547
  201    HB3  CYS  28           HB3      CYS  28  -0.912 -10.072   6.491
  202    H    THR  29           H        THR  29  -3.859  -7.008   7.525
  203    HA   THR  29           HA       THR  29  -4.579  -7.304   4.681
  204    HB   THR  29           HB       THR  29  -6.455  -6.984   7.039
  205    HG1  THR  29           HG1      THR  29  -5.345  -9.100   6.720
  206   HG21  THR  29          HG21      THR  29  -8.222  -7.478   5.398
  207   HG22  THR  29          HG22      THR  29  -7.017  -7.471   4.113
  208   HG23  THR  29          HG23      THR  29  -7.362  -5.991   5.010
  209    H    SER  30           H        SER  30  -4.550  -5.435   3.581
  210    HA   SER  30           HA       SER  30  -4.641  -2.928   5.112
  211    HG   SER  30           HG       SER  30  -2.458  -1.338   3.543
  212    HB2  SER  30           HB2      SER  30  -2.625  -3.419   3.679
  213    HB3  SER  30           HB3      SER  30  -3.678  -3.309   2.269
  214    H    LYS  31           H        LYS  31  -6.340  -1.646   4.946
  215    HA   LYS  31           HA       LYS  31  -8.329  -2.128   2.838
  216    HB2  LYS  31           HB2      LYS  31  -8.436  -0.617   5.455
  217    HB3  LYS  31           HB3      LYS  31  -9.715  -0.524   4.257
  218    HG2  LYS  31           HG2      LYS  31  -8.794  -3.094   5.519
  219    HG3  LYS  31           HG3      LYS  31 -10.136  -2.124   6.123
  220    HD2  LYS  31           HD2      LYS  31  -9.923  -3.432   3.411
  221    HD3  LYS  31           HD3      LYS  31 -10.987  -3.912   4.735
  222    HE2  LYS  31           HE2      LYS  31 -12.061  -1.664   4.577
  223    HE3  LYS  31           HE3      LYS  31 -11.082  -1.355   3.143
  224    HZ1  LYS  31           HZ1      LYS  31 -12.125  -3.458   2.228
  225    HZ2  LYS  31           HZ2      LYS  31 -13.132  -2.106   2.346
  226    HZ3  LYS  31           HZ3      LYS  31 -13.244  -3.349   3.496
  227    H    PHE  32           H        PHE  32  -8.463  -0.773   1.161
  228    HA   PHE  32           HA       PHE  32  -7.363   1.944   1.488
  229    HD1  PHE  32           HD1      PHE  32  -5.065   2.848   0.022
  230    HD2  PHE  32           HD2      PHE  32  -8.307   1.909  -2.572
  231    HE1  PHE  32           HE1      PHE  32  -4.626   4.897  -1.264
  232    HE2  PHE  32           HE2      PHE  32  -7.873   3.956  -3.861
  233    HZ   PHE  32           HZ       PHE  32  -6.033   5.453  -3.208
  234    HB2  PHE  32           HB2      PHE  32  -6.036   0.578  -0.095
  235    HB3  PHE  32           HB3      PHE  32  -7.487   0.289  -1.050
  236    H    SER  33           H        SER  33  -8.906   3.446   1.487
  237    HA   SER  33           HA       SER  33 -11.307   2.989  -0.154
  238    HG   SER  33           HG       SER  33 -12.000   1.668   1.988
  239    HB2  SER  33           HB2      SER  33 -11.351   4.400   2.519
  240    HB3  SER  33           HB3      SER  33 -12.722   3.814   1.573
  241    H    ARG  34           H        ARG  34 -11.383   4.495  -1.697
  242    HA   ARG  34           HA       ARG  34 -10.730   7.269  -0.986
  243    HE   ARG  34           HE       ARG  34  -6.714   9.413  -3.021
  244    HB2  ARG  34           HB2      ARG  34  -8.816   6.047  -2.203
  245    HB3  ARG  34           HB3      ARG  34  -9.851   6.105  -3.622
  246    HG2  ARG  34           HG2      ARG  34  -9.920   8.564  -3.432
  247    HG3  ARG  34           HG3      ARG  34  -8.814   8.464  -2.059
  248    HD2  ARG  34           HD2      ARG  34  -7.297   7.140  -3.677
  249    HD3  ARG  34           HD3      ARG  34  -8.306   7.838  -4.945
  250   HH11  ARG  34          HH11      ARG  34  -8.162   9.018  -6.187
  251   HH12  ARG  34          HH12      ARG  34  -7.453  10.465  -6.826
  252   HH21  ARG  34          HH21      ARG  34  -5.761  11.298  -3.881
  253   HH22  ARG  34          HH22      ARG  34  -6.098  11.751  -5.534
  254    H    PHE  35           H        PHE  35 -11.975   8.797  -2.019
  255    HA   PHE  35           HA       PHE  35 -14.341   7.758  -3.366
  256    HD1  PHE  35           HD2      PHE  35 -16.779   8.557  -2.061
  257    HD2  PHE  35           HD1      PHE  35 -13.284   9.919  -0.055
  258    HE1  PHE  35           HE2      PHE  35 -17.745   7.856   0.091
  259    HE2  PHE  35           HE1      PHE  35 -14.242   9.219   2.100
  260    HZ   PHE  35           HZ       PHE  35 -16.475   8.188   2.172
  261    HB2  PHE  35           HB2      PHE  35 -13.679  10.519  -2.320
  262    HB3  PHE  35           HB3      PHE  35 -15.186  10.102  -3.131
  263    H    PHE  36           H        PHE  36 -14.987   8.330  -5.415
  264    HA   PHE  36           HA       PHE  36 -13.125   9.982  -6.978
  265    HD1  PHE  36           HD2      PHE  36 -11.122   8.974  -8.753
  266    HD2  PHE  36           HD1      PHE  36 -12.866   5.978  -6.290
  267    HE1  PHE  36           HE2      PHE  36  -8.883   8.102  -8.235
  268    HE2  PHE  36           HE1      PHE  36 -10.629   5.100  -5.767
  269    HZ   PHE  36           HZ       PHE  36  -8.633   6.163  -6.741
  270    HB2  PHE  36           HB2      PHE  36 -14.220   7.275  -7.745
  271    HB3  PHE  36           HB3      PHE  36 -13.513   8.388  -8.908
  272    H    ALA  37           H        ALA  37 -14.065  10.887  -8.924
  273    HA   ALA  37           HA       ALA  37 -16.601  12.017  -8.420
  274    HB1  ALA  37           HB1      ALA  37 -16.354  13.108 -10.562
  275    HB2  ALA  37           HB2      ALA  37 -15.056  11.998 -11.007
  276    HB3  ALA  37           HB3      ALA  37 -14.824  13.146  -9.688
  277    H    THR  38           H        THR  38 -15.537   9.536 -10.718
  278    HA   THR  38           HA       THR  38 -18.374   8.847 -11.152
  279    HB   THR  38           HB       THR  38 -16.411   7.930 -13.154
  280    HG1  THR  38           HG1      THR  38 -17.233  10.656 -13.238
  281   HG21  THR  38          HG21      THR  38 -19.091   9.303 -13.380
  282   HG22  THR  38          HG22      THR  38 -18.827   7.560 -13.382
  283   HG23  THR  38          HG23      THR  38 -18.198   8.547 -14.702
  284    H    ARG  39           H        ARG  39 -18.865   6.602 -11.322
  285    HA   ARG  39           HA       ARG  39 -17.470   4.847  -9.652
  286    HE   ARG  39           HE       ARG  39 -20.177   0.113  -9.791
  287    HB2  ARG  39           HB2      ARG  39 -19.813   4.553 -10.312
  288    HB3  ARG  39           HB3      ARG  39 -19.318   4.198 -11.953
  289    HG2  ARG  39           HG2      ARG  39 -18.108   2.210 -11.126
  290    HG3  ARG  39           HG3      ARG  39 -18.734   2.549  -9.510
  291    HD2  ARG  39           HD2      ARG  39 -20.995   2.267 -10.271
  292    HD3  ARG  39           HD3      ARG  39 -20.455   2.094 -11.942
  293   HH11  ARG  39          HH11      ARG  39 -19.694   1.021 -13.135
  294   HH12  ARG  39          HH12      ARG  39 -19.402  -0.604 -13.677
  295   HH21  ARG  39          HH21      ARG  39 -19.826  -2.043 -10.498
  296   HH22  ARG  39          HH22      ARG  39 -19.505  -2.351 -12.178
  297    H    GLU  40           H        GLU  40 -17.211   5.456 -13.076
  298    HA   GLU  40           HA       GLU  40 -15.574   3.324 -13.850
  299    HB2  GLU  40           HB2      GLU  40 -15.745   6.144 -14.911
  300    HB3  GLU  40           HB3      GLU  40 -14.958   4.801 -15.730
  301    HG2  GLU  40           HG2      GLU  40 -17.024   3.633 -15.913
  302    HG3  GLU  40           HG3      GLU  40 -17.848   4.830 -14.931
  303    H    GLU  41           H        GLU  41 -14.828   6.476 -12.548
  304    HA   GLU  41           HA       GLU  41 -12.063   6.530 -12.783
  305    HB2  GLU  41           HB2      GLU  41 -13.860   7.608 -10.610
  306    HB3  GLU  41           HB3      GLU  41 -12.145   7.971 -10.712
  307    HG2  GLU  41           HG2      GLU  41 -14.130   8.586 -12.883
  308    HG3  GLU  41           HG3      GLU  41 -13.618   9.731 -11.641
  309    H    ALA  42           H        ALA  42 -14.106   4.818 -10.551
  310    HA   ALA  42           HA       ALA  42 -11.988   4.049  -8.761
  311    HB1  ALA  42           HB1      ALA  42 -14.792   2.971  -9.043
  312    HB2  ALA  42           HB2      ALA  42 -14.289   4.278  -7.971
  313    HB3  ALA  42           HB3      ALA  42 -13.687   2.640  -7.711
  314    H    GLU  43           H        GLU  43 -13.832   2.520 -11.360
  315    HA   GLU  43           HA       GLU  43 -12.703  -0.037 -11.262
  316    HB2  GLU  43           HB2      GLU  43 -13.638   1.488 -13.707
  317    HB3  GLU  43           HB3      GLU  43 -13.413  -0.251 -13.605
  318    HG2  GLU  43           HG2      GLU  43 -15.204  -0.426 -11.999
  319    HG3  GLU  43           HG3      GLU  43 -15.389   1.328 -11.978
  320    H    SER  44           H        SER  44 -11.745   2.825 -13.106
  321    HA   SER  44           HA       SER  44  -9.560   1.672 -14.442
  322    HG   SER  44           HG       SER  44 -11.499   4.598 -15.143
  323    HB2  SER  44           HB2      SER  44  -9.983   4.574 -13.695
  324    HB3  SER  44           HB3      SER  44  -8.948   3.967 -14.984
  325    H    PHE  45           H        PHE  45  -9.875   3.047 -11.233
  326    HA   PHE  45           HA       PHE  45  -7.056   3.413 -10.858
  327    HD1  PHE  45           HD1      PHE  45  -6.596   5.751  -9.644
  328    HD2  PHE  45           HD2      PHE  45  -7.856   2.856  -6.796
  329    HE1  PHE  45           HE1      PHE  45  -4.823   6.498  -8.110
  330    HE2  PHE  45           HE2      PHE  45  -6.083   3.592  -5.255
  331    HZ   PHE  45           HZ       PHE  45  -4.565   5.415  -5.913
  332    HB2  PHE  45           HB2      PHE  45  -8.907   4.687  -9.663
  333    HB3  PHE  45           HB3      PHE  45  -9.155   3.240  -8.693
  334    H    MET  46           H        MET  46  -9.428   0.940 -10.098
  335    HA   MET  46           HA       MET  46  -7.819  -0.622  -8.386
  336    HB2  MET  46           HB2      MET  46 -10.242  -0.881  -8.488
  337    HB3  MET  46           HB3      MET  46 -10.135  -1.422 -10.155
  338    HG2  MET  46           HG2      MET  46 -10.504  -3.276  -8.623
  339    HG3  MET  46           HG3      MET  46  -8.961  -3.424  -9.461
  340    HE1  MET  46           HE1      MET  46  -9.335  -1.991  -5.090
  341    HE2  MET  46           HE2      MET  46 -10.723  -2.406  -6.096
  342    HE3  MET  46           HE3      MET  46  -9.746  -0.989  -6.480
  343    H    THR  47           H        THR  47  -7.903  -0.292 -11.828
  344    HA   THR  47           HA       THR  47  -6.925  -2.791 -12.633
  345    HB   THR  47           HB       THR  47  -6.269  -0.173 -13.991
  346    HG1  THR  47           HG1      THR  47  -8.696  -1.296 -13.428
  347   HG21  THR  47          HG21      THR  47  -6.821  -2.952 -15.045
  348   HG22  THR  47          HG22      THR  47  -5.242  -2.173 -14.958
  349   HG23  THR  47          HG23      THR  47  -6.483  -1.528 -16.030
  350    H    LYS  48           H        LYS  48  -5.142   0.206 -11.875
  351    HA   LYS  48           HA       LYS  48  -2.597  -1.002 -12.303
  352    HB2  LYS  48           HB2      LYS  48  -1.708   1.071 -11.252
  353    HB3  LYS  48           HB3      LYS  48  -2.766   1.343 -12.628
  354    HG2  LYS  48           HG2      LYS  48  -4.622   1.707 -10.958
  355    HG3  LYS  48           HG3      LYS  48  -3.362   1.744  -9.721
  356    HD2  LYS  48           HD2      LYS  48  -3.456   3.529 -12.148
  357    HD3  LYS  48           HD3      LYS  48  -3.990   3.984 -10.536
  358    HE2  LYS  48           HE2      LYS  48  -1.761   3.732  -9.666
  359    HE3  LYS  48           HE3      LYS  48  -1.193   3.089 -11.207
  360    HZ1  LYS  48           HZ1      LYS  48  -2.289   5.832 -10.841
  361    HZ2  LYS  48           HZ2      LYS  48  -1.569   5.199 -12.244
  362    HZ3  LYS  48           HZ3      LYS  48  -0.633   5.458 -10.856
  363    H    LEU  49           H        LEU  49  -4.717  -0.639  -9.580
  364    HA   LEU  49           HA       LEU  49  -2.920  -1.277  -7.511
  365    HG   LEU  49           HG       LEU  49  -6.026  -0.009  -5.948
  366    HB2  LEU  49           HB2      LEU  49  -5.872  -1.382  -7.872
  367    HB3  LEU  49           HB3      LEU  49  -5.193  -2.301  -6.546
  368   HD11  LEU  49          HD11      LEU  49  -3.112  -0.588  -5.460
  369   HD12  LEU  49          HD12      LEU  49  -4.473  -1.190  -4.517
  370   HD13  LEU  49          HD13      LEU  49  -4.104   0.535  -4.530
  371   HD21  LEU  49          HD21      LEU  49  -5.288   1.182  -7.939
  372   HD22  LEU  49          HD22      LEU  49  -3.605   0.881  -7.510
  373   HD23  LEU  49          HD23      LEU  49  -4.608   1.905  -6.481
  374    H    LYS  50           H        LYS  50  -4.858  -3.314  -9.677
  375    HA   LYS  50           HA       LYS  50  -4.330  -5.792  -8.521
  376    HB2  LYS  50           HB2      LYS  50  -4.792  -4.974 -11.386
  377    HB3  LYS  50           HB3      LYS  50  -4.797  -6.641 -10.834
  378    HG2  LYS  50           HG2      LYS  50  -6.745  -6.358  -9.592
  379    HG3  LYS  50           HG3      LYS  50  -6.591  -4.598  -9.588
  380    HD2  LYS  50           HD2      LYS  50  -7.419  -4.378 -11.692
  381    HD3  LYS  50           HD3      LYS  50  -6.810  -5.949 -12.199
  382    HE2  LYS  50           HE2      LYS  50  -8.570  -6.993 -10.744
  383    HE3  LYS  50           HE3      LYS  50  -9.231  -5.375 -10.496
  384    HZ1  LYS  50           HZ1      LYS  50 -10.396  -6.547 -12.252
  385    HZ2  LYS  50           HZ2      LYS  50  -8.950  -6.763 -13.109
  386    HZ3  LYS  50           HZ3      LYS  50  -9.576  -5.203 -12.887
  387    H    GLU  51           H        GLU  51  -2.552  -4.058 -11.073
  388    HA   GLU  51           HA       GLU  51  -0.540  -5.954 -11.492
  389    HB2  GLU  51           HB2      GLU  51  -0.627  -2.975 -11.845
  390    HB3  GLU  51           HB3      GLU  51   0.829  -3.899 -12.197
  391    HG2  GLU  51           HG2      GLU  51  -1.838  -4.536 -13.416
  392    HG3  GLU  51           HG3      GLU  51  -0.688  -3.420 -14.142
  393    H    LEU  52           H        LEU  52  -0.676  -3.200  -9.297
  394    HA   LEU  52           HA       LEU  52   1.906  -3.502  -8.222
  395    HG   LEU  52           HG       LEU  52   0.392  -1.117  -9.138
  396    HB2  LEU  52           HB2      LEU  52  -0.585  -2.212  -7.122
  397    HB3  LEU  52           HB3      LEU  52   0.981  -2.100  -6.346
  398   HD11  LEU  52          HD11      LEU  52   0.637   0.410  -6.552
  399   HD12  LEU  52          HD12      LEU  52  -0.826   0.206  -7.516
  400   HD13  LEU  52          HD13      LEU  52   0.532   1.127  -8.160
  401   HD21  LEU  52          HD21      LEU  52   2.793  -0.741  -7.350
  402   HD22  LEU  52          HD22      LEU  52   2.559  -0.000  -8.935
  403   HD23  LEU  52          HD23      LEU  52   2.723  -1.752  -8.793
  404    H    ALA  53           H        ALA  53  -1.232  -4.797  -7.226
  405    HA   ALA  53           HA       ALA  53  -0.364  -5.940  -4.794
  406    HB1  ALA  53           HB1      ALA  53  -2.414  -7.236  -4.864
  407    HB2  ALA  53           HB2      ALA  53  -2.634  -6.833  -6.567
  408    HB3  ALA  53           HB3      ALA  53  -2.727  -5.569  -5.341
  409    H    ALA  54           H        ALA  54  -0.494  -7.182  -8.095
  410    HA   ALA  54           HA       ALA  54   0.189  -9.856  -7.481
  411    HB1  ALA  54           HB1      ALA  54   0.637 -10.092  -9.862
  412    HB2  ALA  54           HB2      ALA  54   0.613  -8.339 -10.051
  413    HB3  ALA  54           HB3      ALA  54  -0.857  -9.197  -9.590
  414    H    ALA  55           H        ALA  55   2.100  -6.974  -7.990
  415    HA   ALA  55           HA       ALA  55   4.583  -8.447  -8.189
  416    HB1  ALA  55           HB1      ALA  55   4.252  -6.364  -9.450
  417    HB2  ALA  55           HB2      ALA  55   5.642  -6.275  -8.368
  418    HB3  ALA  55           HB3      ALA  55   4.134  -5.474  -7.930
  419    H    ALA  56           H        ALA  56   2.714  -6.837  -5.737
  420    HA   ALA  56           HA       ALA  56   4.880  -6.641  -3.856
  421    HB1  ALA  56           HB1      ALA  56   3.213  -5.815  -2.302
  422    HB2  ALA  56           HB2      ALA  56   1.922  -6.283  -3.410
  423    HB3  ALA  56           HB3      ALA  56   3.058  -5.013  -3.863
  424    H    SER  57           H        SER  57   2.078  -8.770  -4.279
  425    HA   SER  57           HA       SER  57   2.535 -10.171  -1.840
  426    HG   SER  57           HG       SER  57   0.563  -9.922  -4.881
  427    HB2  SER  57           HB2      SER  57   0.835 -11.780  -2.765
  428    HB3  SER  57           HB3      SER  57   0.288 -10.107  -2.694
  429    H    SER  58           H        SER  58   3.781 -11.854  -1.436
  430    HA   SER  58           HA       SER  58   5.213 -13.092  -3.694
  431    HG   SER  58           HG       SER  58   6.066 -11.008  -2.077
  432    HB2  SER  58           HB2      SER  58   5.941 -13.030  -0.754
  433    HB3  SER  58           HB3      SER  58   6.922 -13.703  -2.054
  434    H    ALA  59           H        ALA  59   2.511 -13.675  -2.473
  435    HA   ALA  59           HA       ALA  59   2.808 -16.283  -1.266
  436    HB1  ALA  59           HB1      ALA  59   0.393 -16.236  -1.034
  437    HB2  ALA  59           HB2      ALA  59   0.300 -14.804  -2.061
  438    HB3  ALA  59           HB3      ALA  59   1.089 -14.712  -0.485
  439    H    ASP  60           H        ASP  60   3.190 -15.368  -4.296
  440    HA   ASP  60           HA       ASP  60   3.396 -16.508  -6.235
  441    HB2  ASP  60           HB2      ASP  60   2.520 -18.830  -4.530
  442    HB3  ASP  60           HB3      ASP  60   2.888 -18.997  -6.243
  443    H    GLU  61           H        GLU  61   0.497 -18.062  -4.869
  444    HA   GLU  61           HA       GLU  61  -0.845 -18.041  -7.361
  445    HB2  GLU  61           HB2      GLU  61  -1.951 -18.416  -4.572
  446    HB3  GLU  61           HB3      GLU  61  -2.827 -18.754  -6.059
  447    HG2  GLU  61           HG2      GLU  61  -1.187 -20.462  -6.644
  448    HG3  GLU  61           HG3      GLU  61  -0.297 -20.117  -5.161
  449    H    GLY  62           H        GLY  62  -0.862 -15.864  -4.612
  450    HA2  GLY  62           HA2      GLY  62  -1.349 -13.521  -5.698
  451    HA3  GLY  62           HA3      GLY  62  -2.951 -14.232  -5.838
  452    H    ALA  63           H        ALA  63  -3.819 -12.653  -4.460
  453    HA   ALA  63           HA       ALA  63  -3.477 -13.284  -1.640
  454    HB1  ALA  63           HB1      ALA  63  -3.182 -10.472  -2.709
  455    HB2  ALA  63           HB2      ALA  63  -1.905 -11.450  -1.982
  456    HB3  ALA  63           HB3      ALA  63  -3.275 -10.918  -1.006
  457    H    SER  64           H        SER  64  -5.254 -12.476  -0.347
  458    HA   SER  64           HA       SER  64  -7.748 -12.615  -1.731
  459    HG   SER  64           HG       SER  64  -7.453 -14.330  -0.286
  460    HB2  SER  64           HB2      SER  64  -7.100 -11.977   1.152
  461    HB3  SER  64           HB3      SER  64  -8.718 -12.280   0.524
  462    H    VAL  65           H        VAL  65  -8.351 -10.915  -2.946
  463    HA   VAL  65           HA       VAL  65  -8.124  -8.258  -1.699
  464    HB   VAL  65           HB       VAL  65  -6.724  -8.282  -3.636
  465   HG11  VAL  65          HG11      VAL  65  -7.499  -8.837  -5.870
  466   HG12  VAL  65          HG12      VAL  65  -9.105  -9.206  -5.244
  467   HG13  VAL  65          HG13      VAL  65  -7.730 -10.210  -4.786
  468   HG21  VAL  65          HG21      VAL  65  -8.025  -6.250  -3.259
  469   HG22  VAL  65          HG22      VAL  65  -9.306  -6.872  -4.300
  470   HG23  VAL  65          HG23      VAL  65  -7.719  -6.506  -4.977
  471    H    ALA  66           H        ALA  66  -9.983  -7.568  -0.968
  472    HA   ALA  66           HA       ALA  66 -12.459  -8.321  -2.348
  473    HB1  ALA  66           HB1      ALA  66 -12.042  -7.023   0.343
  474    HB2  ALA  66           HB2      ALA  66 -12.428  -8.719   0.052
  475    HB3  ALA  66           HB3      ALA  66 -13.604  -7.466  -0.347
  476    H    TYR  67           H        TYR  67 -12.576  -6.971  -4.075
  477    HA   TYR  67           HA       TYR  67 -12.197  -4.106  -3.634
  478    HD1  TYR  67           HD1      TYR  67 -13.981  -5.765  -7.254
  479    HD2  TYR  67           HD2      TYR  67 -10.214  -6.930  -5.663
  480    HE1  TYR  67           HE1      TYR  67 -14.131  -7.897  -8.472
  481    HE2  TYR  67           HE2      TYR  67 -10.354  -9.063  -6.873
  482    HH   TYR  67           HH       TYR  67 -11.988 -10.526  -7.851
  483    HB2  TYR  67           HB2      TYR  67 -12.426  -4.116  -6.238
  484    HB3  TYR  67           HB3      TYR  67 -10.930  -4.658  -5.490
  485    H    LYS  68           H        LYS  68 -13.869  -2.873  -3.288
  486    HA   LYS  68           HA       LYS  68 -16.409  -3.553  -4.597
  487    HB2  LYS  68           HB2      LYS  68 -15.946  -2.652  -1.762
  488    HB3  LYS  68           HB3      LYS  68 -17.504  -2.469  -2.556
  489    HG2  LYS  68           HG2      LYS  68 -17.670  -4.849  -2.859
  490    HG3  LYS  68           HG3      LYS  68 -16.058  -5.073  -2.186
  491    HD2  LYS  68           HD2      LYS  68 -16.797  -4.222  -0.043
  492    HD3  LYS  68           HD3      LYS  68 -18.393  -3.870  -0.705
  493    HE2  LYS  68           HE2      LYS  68 -18.726  -6.266  -1.129
  494    HE3  LYS  68           HE3      LYS  68 -17.140  -6.597  -0.435
  495    HZ1  LYS  68           HZ1      LYS  68 -19.033  -6.934   1.118
  496    HZ2  LYS  68           HZ2      LYS  68 -19.339  -5.269   1.048
  497    HZ3  LYS  68           HZ3      LYS  68 -17.870  -5.834   1.682
  498    H    ILE  69           H        ILE  69 -17.660  -1.865  -5.253
  499    HA   ILE  69           HA       ILE  69 -16.514   0.837  -5.056
  500    HB   ILE  69           HB       ILE  69 -17.748  -0.321  -7.569
  501   HG12  ILE  69          HG12      ILE  69 -14.855   0.383  -7.009
  502   HG13  ILE  69          HG13      ILE  69 -15.497  -1.253  -7.099
  503   HG21  ILE  69          HG21      ILE  69 -17.038   1.776  -8.611
  504   HG22  ILE  69          HG22      ILE  69 -16.425   2.344  -7.057
  505   HG23  ILE  69          HG23      ILE  69 -18.154   2.067  -7.276
  506   HD11  ILE  69          HD11      ILE  69 -16.087  -0.891  -9.438
  507   HD12  ILE  69          HD12      ILE  69 -14.364  -0.646  -9.149
  508   HD13  ILE  69          HD13      ILE  69 -15.432   0.744  -9.346
  509    H    LYS  70           H        LYS  70 -18.007   1.816  -3.766
  510    HA   LYS  70           HA       LYS  70 -20.796   1.071  -4.073
  511    HB2  LYS  70           HB2      LYS  70 -19.849   1.388  -1.813
  512    HB3  LYS  70           HB3      LYS  70 -19.601   3.089  -2.175
  513    HG2  LYS  70           HG2      LYS  70 -21.645   2.625  -0.840
  514    HG3  LYS  70           HG3      LYS  70 -21.958   3.465  -2.362
  515    HD2  LYS  70           HD2      LYS  70 -22.541   1.288  -3.395
  516    HD3  LYS  70           HD3      LYS  70 -22.323   0.517  -1.825
  517    HE2  LYS  70           HE2      LYS  70 -24.262   2.773  -2.292
  518    HE3  LYS  70           HE3      LYS  70 -24.701   1.075  -2.472
  519    HZ1  LYS  70           HZ1      LYS  70 -24.063   0.716  -0.159
  520    HZ2  LYS  70           HZ2      LYS  70 -25.291   1.876  -0.288
  521    HZ3  LYS  70           HZ3      LYS  70 -23.695   2.363   0.012
  522    H    ASP  71           H        ASP  71 -22.001   1.951  -5.454
  523    HA   ASP  71           HA       ASP  71 -21.360   4.416  -6.779
  524    HB2  ASP  71           HB2      ASP  71 -23.525   3.877  -8.013
  525    HB3  ASP  71           HB3      ASP  71 -22.227   2.705  -8.177
  526    H    LEU  72           H        LEU  72 -21.712   6.221  -5.677
  527    HA   LEU  72           HA       LEU  72 -24.166   6.476  -4.077
  528    HG   LEU  72           HG       LEU  72 -21.300   5.826  -3.035
  529    HB2  LEU  72           HB2      LEU  72 -21.630   8.111  -3.966
  530    HB3  LEU  72           HB3      LEU  72 -23.019   8.300  -2.914
  531   HD11  LEU  72          HD11      LEU  72 -20.364   6.571  -0.922
  532   HD12  LEU  72          HD12      LEU  72 -21.325   8.047  -0.996
  533   HD13  LEU  72          HD13      LEU  72 -20.054   7.762  -2.186
  534   HD21  LEU  72          HD21      LEU  72 -23.454   6.684  -1.105
  535   HD22  LEU  72          HD22      LEU  72 -22.463   5.231  -0.966
  536   HD23  LEU  72          HD23      LEU  72 -23.590   5.406  -2.312
  537    H    GLU  73           H        GLU  73 -24.545   9.086  -3.897
  538    HA   GLU  73           HA       GLU  73 -25.314   9.814  -6.599
  539    HB2  GLU  73           HB2      GLU  73 -26.892  10.009  -4.698
  540    HB3  GLU  73           HB3      GLU  73 -25.853  11.238  -3.992
  541    HG2  GLU  73           HG2      GLU  73 -26.235  12.688  -5.893
  542    HG3  GLU  73           HG3      GLU  73 -27.220  11.442  -6.663
  543    H    GLY  74           H        GLY  74 -23.676  10.618  -7.750
  544    HA2  GLY  74           HA2      GLY  74 -22.658  12.639  -8.478
  545    HA3  GLY  74           HA3      GLY  74 -22.609  13.185  -6.808
  546    H    GLN  75           H        GLN  75 -21.567  10.326  -6.208
  547    HA   GLN  75           HA       GLN  75 -18.938  10.345  -7.369
  548    HB2  GLN  75           HB2      GLN  75 -17.725  10.657  -5.254
  549    HB3  GLN  75           HB3      GLN  75 -18.645  12.090  -5.684
  550    HG2  GLN  75           HG2      GLN  75 -20.412  11.378  -4.100
  551    HG3  GLN  75           HG3      GLN  75 -19.383  10.030  -3.615
  552   HE21  GLN  75          HE21      GLN  75 -19.223  10.753  -1.490
  553   HE22  GLN  75          HE22      GLN  75 -18.276  12.137  -1.056
  554    H    VAL  76           H        VAL  76 -17.557   8.621  -6.218
  555    HA   VAL  76           HA       VAL  76 -19.258   6.491  -5.106
  556    HB   VAL  76           HB       VAL  76 -18.049   4.801  -6.423
  557   HG11  VAL  76          HG11      VAL  76 -19.471   6.905  -8.045
  558   HG12  VAL  76          HG12      VAL  76 -20.198   5.516  -7.238
  559   HG13  VAL  76          HG13      VAL  76 -19.119   5.274  -8.612
  560   HG21  VAL  76          HG21      VAL  76 -16.873   7.158  -7.894
  561   HG22  VAL  76          HG22      VAL  76 -16.701   5.463  -8.355
  562   HG23  VAL  76          HG23      VAL  76 -15.996   6.042  -6.846
  563    H    GLU  77           H        GLU  77 -17.998   4.779  -4.051
  564    HA   GLU  77           HA       GLU  77 -15.446   5.789  -3.000
  565    HB2  GLU  77           HB2      GLU  77 -17.123   5.735  -1.245
  566    HB3  GLU  77           HB3      GLU  77 -17.514   4.065  -1.628
  567    HG2  GLU  77           HG2      GLU  77 -15.317   3.352  -0.911
  568    HG3  GLU  77           HG3      GLU  77 -14.848   5.024  -0.611
  569    H    LEU  78           H        LEU  78 -13.796   4.720  -3.783
  570    HA   LEU  78           HA       LEU  78 -14.071   1.940  -4.622
  571    HG   LEU  78           HG       LEU  78 -11.059   2.297  -6.726
  572    HB2  LEU  78           HB2      LEU  78 -12.801   3.628  -5.985
  573    HB3  LEU  78           HB3      LEU  78 -11.642   3.750  -4.680
  574   HD11  LEU  78          HD11      LEU  78  -9.724   2.332  -4.693
  575   HD12  LEU  78          HD12      LEU  78  -9.828   0.697  -5.351
  576   HD13  LEU  78          HD13      LEU  78 -10.802   1.149  -3.952
  577   HD21  LEU  78          HD21      LEU  78 -13.153   1.079  -6.865
  578   HD22  LEU  78          HD22      LEU  78 -12.885   0.403  -5.256
  579   HD23  LEU  78          HD23      LEU  78 -11.808  -0.026  -6.586
  580    H    ASP  79           H        ASP  79 -13.845   0.416  -3.173
  581    HA   ASP  79           HA       ASP  79 -12.094   0.894  -0.856
  582    HB2  ASP  79           HB2      ASP  79 -14.436   1.183  -0.182
  583    HB3  ASP  79           HB3      ASP  79 -14.830  -0.403  -0.834
  584    H    ALA  80           H        ALA  80 -10.542  -0.579  -0.755
  585    HA   ALA  80           HA       ALA  80 -11.136  -3.294  -1.723
  586    HB1  ALA  80           HB1      ALA  80  -9.861  -2.118  -3.436
  587    HB2  ALA  80           HB2      ALA  80  -8.919  -3.430  -2.727
  588    HB3  ALA  80           HB3      ALA  80  -8.597  -1.762  -2.257
  589    H    ALA  81           H        ALA  81 -10.575  -4.868  -0.402
  590    HA   ALA  81           HA       ALA  81  -8.779  -4.296   1.851
  591    HB1  ALA  81           HB1      ALA  81 -11.030  -5.024   2.493
  592    HB2  ALA  81           HB2      ALA  81  -9.814  -6.213   2.964
  593    HB3  ALA  81           HB3      ALA  81 -10.822  -6.496   1.545
  594    H    PHE  82           H        PHE  82  -6.759  -4.873   1.326
  595    HA   PHE  82           HA       PHE  82  -6.334  -7.278  -0.305
  596    HD1  PHE  82           HD1      PHE  82  -4.681  -6.616  -2.741
  597    HD2  PHE  82           HD2      PHE  82  -5.689  -3.266  -0.321
  598    HE1  PHE  82           HE1      PHE  82  -5.263  -5.338  -4.762
  599    HE2  PHE  82           HE2      PHE  82  -6.278  -1.983  -2.335
  600    HZ   PHE  82           HZ       PHE  82  -6.063  -3.017  -4.560
  601    HB2  PHE  82           HB2      PHE  82  -4.410  -5.103   0.568
  602    HB3  PHE  82           HB3      PHE  82  -3.978  -6.484  -0.431
  603    H    THR  83           H        THR  83  -6.144  -9.094   0.783
  604    HA   THR  83           HA       THR  83  -4.955  -9.059   3.468
  605    HB   THR  83           HB       THR  83  -6.443 -11.330   2.142
  606    HG1  THR  83           HG1      THR  83  -7.577  -9.179   2.522
  607   HG21  THR  83          HG21      THR  83  -6.781 -12.104   4.437
  608   HG22  THR  83          HG22      THR  83  -5.873 -10.720   5.050
  609   HG23  THR  83          HG23      THR  83  -5.063 -11.948   4.078
  610    H    PHE  84           H        PHE  84  -2.808  -9.321   3.350
  611    HA   PHE  84           HA       PHE  84  -1.676 -11.091   1.313
  612    HD1  PHE  84           HD2      PHE  84   0.184  -9.758  -0.376
  613    HD2  PHE  84           HD1      PHE  84  -1.469  -7.139   2.541
  614    HE1  PHE  84           HE2      PHE  84  -0.117  -8.034  -2.103
  615    HE2  PHE  84           HE1      PHE  84  -1.773  -5.409   0.817
  616    HZ   PHE  84           HZ       PHE  84  -1.094  -5.857  -1.505
  617    HB2  PHE  84           HB2      PHE  84  -0.376  -9.128   3.213
  618    HB3  PHE  84           HB3      PHE  84   0.505 -10.123   2.059
  619    H    SER  85           H        SER  85   0.642 -11.911   2.511
  620    HA   SER  85           HA       SER  85  -0.378 -13.793   4.517
  621    HG   SER  85           HG       SER  85   1.187 -14.191   1.371
  622    HB2  SER  85           HB2      SER  85   2.305 -13.917   3.132
  623    HB3  SER  85           HB3      SER  85   1.415 -15.228   3.907
  624    H    CYS  86           H        CYS  86   2.233 -11.528   3.840
  625    HA   CYS  86           HA       CYS  86   2.891 -11.476   6.717
  626    HG   CYS  86           HG       CYS  86   5.081 -13.192   3.745
  627    HB2  CYS  86           HB2      CYS  86   4.706 -10.736   4.414
  628    HB3  CYS  86           HB3      CYS  86   5.153 -10.886   6.110
  629    H    GLN  87           H        GLN  87   3.197  -9.471   7.691
  630    HA   GLN  87           HA       GLN  87   1.707  -7.292   6.745
  631    HB2  GLN  87           HB2      GLN  87   2.201  -7.574   9.104
  632    HB3  GLN  87           HB3      GLN  87   3.922  -7.390   8.799
  633    HG2  GLN  87           HG2      GLN  87   3.714  -5.104   8.349
  634    HG3  GLN  87           HG3      GLN  87   1.967  -5.212   8.141
  635   HE21  GLN  87          HE21      GLN  87   0.669  -5.505   9.973
  636   HE22  GLN  87          HE22      GLN  87   1.228  -5.084  11.559
  637    H    ALA  88           H        ALA  88   5.062  -8.173   6.355
  638    HA   ALA  88           HA       ALA  88   6.166  -5.844   5.376
  639    HB1  ALA  88           HB1      ALA  88   7.452  -7.883   5.766
  640    HB2  ALA  88           HB2      ALA  88   7.730  -7.261   4.141
  641    HB3  ALA  88           HB3      ALA  88   6.671  -8.649   4.384
  642    H    GLU  89           H        GLU  89   4.286  -8.289   3.609
  643    HA   GLU  89           HA       GLU  89   4.548  -7.098   1.055
  644    HB2  GLU  89           HB2      GLU  89   2.266  -8.824   2.038
  645    HB3  GLU  89           HB3      GLU  89   2.765  -8.580   0.370
  646    HG2  GLU  89           HG2      GLU  89   4.806  -9.771   0.747
  647    HG3  GLU  89           HG3      GLU  89   4.464  -9.895   2.473
  648    H    MET  90           H        MET  90   2.247  -6.712   3.673
  649    HA   MET  90           HA       MET  90   0.335  -5.147   2.312
  650    HB2  MET  90           HB2      MET  90  -0.292  -6.116   4.393
  651    HB3  MET  90           HB3      MET  90   1.074  -5.389   5.228
  652    HG2  MET  90           HG2      MET  90   0.078  -3.171   4.893
  653    HG3  MET  90           HG3      MET  90  -1.303  -3.928   4.095
  654    HE1  MET  90           HE1      MET  90  -1.354  -1.917   6.665
  655    HE2  MET  90           HE2      MET  90  -2.632  -2.667   7.622
  656    HE3  MET  90           HE3      MET  90  -2.814  -2.508   5.873
  657    H    ILE  91           H        ILE  91   2.963  -4.152   4.507
  658    HA   ILE  91           HA       ILE  91   2.434  -1.411   4.188
  659    HB   ILE  91           HB       ILE  91   4.716  -1.097   5.225
  660   HG12  ILE  91          HG12      ILE  91   4.578  -4.098   5.529
  661   HG13  ILE  91          HG13      ILE  91   5.650  -3.272   4.410
  662   HG21  ILE  91          HG21      ILE  91   2.668  -1.096   6.519
  663   HG22  ILE  91          HG22      ILE  91   3.959  -1.895   7.418
  664   HG23  ILE  91          HG23      ILE  91   2.712  -2.856   6.622
  665   HD11  ILE  91          HD11      ILE  91   5.685  -3.007   7.407
  666   HD12  ILE  91          HD12      ILE  91   6.769  -2.184   6.287
  667   HD13  ILE  91          HD13      ILE  91   6.820  -3.940   6.431
  668    H    ILE  92           H        ILE  92   4.770  -3.540   2.528
  669    HA   ILE  92           HA       ILE  92   6.100  -1.445   1.165
  670    HB   ILE  92           HB       ILE  92   6.913  -3.139  -0.399
  671   HG12  ILE  92          HG12      ILE  92   5.105  -5.065   1.064
  672   HG13  ILE  92          HG13      ILE  92   4.843  -4.472  -0.572
  673   HG21  ILE  92          HG21      ILE  92   8.089  -4.559   1.219
  674   HG22  ILE  92          HG22      ILE  92   6.976  -4.020   2.476
  675   HG23  ILE  92          HG23      ILE  92   8.063  -2.865   1.705
  676   HD11  ILE  92          HD11      ILE  92   5.789  -6.704  -0.580
  677   HD12  ILE  92          HD12      ILE  92   7.175  -6.133   0.348
  678   HD13  ILE  92          HD13      ILE  92   6.910  -5.544  -1.295
  679    H    PHE  93           H        PHE  93   3.141  -3.173   0.575
  680    HA   PHE  93           HA       PHE  93   2.801  -2.457  -2.143
  681    HD1  PHE  93           HD1      PHE  93   1.063  -3.706  -3.697
  682    HD2  PHE  93           HD2      PHE  93  -1.268  -2.443  -0.369
  683    HE1  PHE  93           HE1      PHE  93  -0.862  -3.352  -5.181
  684    HE2  PHE  93           HE2      PHE  93  -3.197  -2.086  -1.851
  685    HZ   PHE  93           HZ       PHE  93  -2.995  -2.543  -4.261
  686    HB2  PHE  93           HB2      PHE  93   1.578  -4.315  -1.218
  687    HB3  PHE  93           HB3      PHE  93   0.836  -3.285  -0.003
  688    H    GLU  94           H        GLU  94   1.456  -1.087   0.865
  689    HA   GLU  94           HA       GLU  94   0.101   0.980  -0.558
  690    HB2  GLU  94           HB2      GLU  94  -0.285   1.915   1.772
  691    HB3  GLU  94           HB3      GLU  94  -0.962   0.334   1.415
  692    HG2  GLU  94           HG2      GLU  94   1.017  -0.680   2.537
  693    HG3  GLU  94           HG3      GLU  94   1.496   0.945   3.030
  694    H    LEU  95           H        LEU  95   3.245   0.742   0.979
  695    HA   LEU  95           HA       LEU  95   3.830   3.523   0.838
  696    HG   LEU  95           HG       LEU  95   4.514   1.424   2.982
  697    HB2  LEU  95           HB2      LEU  95   5.644   1.111   0.837
  698    HB3  LEU  95           HB3      LEU  95   6.229   2.763   0.888
  699   HD11  LEU  95          HD11      LEU  95   6.484   1.574   4.392
  700   HD12  LEU  95          HD12      LEU  95   7.399   2.290   3.062
  701   HD13  LEU  95          HD13      LEU  95   6.825   0.625   2.944
  702   HD21  LEU  95          HD21      LEU  95   4.897   3.463   4.296
  703   HD22  LEU  95          HD22      LEU  95   3.992   3.791   2.818
  704   HD23  LEU  95          HD23      LEU  95   5.706   4.194   2.910
  705    H    SER  96           H        SER  96   4.351   0.812  -1.371
  706    HA   SER  96           HA       SER  96   5.597   2.215  -3.442
  707    HG   SER  96           HG       SER  96   5.102  -0.584  -5.518
  708    HB2  SER  96           HB2      SER  96   5.427  -0.267  -3.297
  709    HB3  SER  96           HB3      SER  96   3.717  -0.145  -3.707
  710    H    LEU  97           H        LEU  97   2.174   1.782  -2.662
  711    HA   LEU  97           HA       LEU  97   0.989   2.917  -4.891
  712    HG   LEU  97           HG       LEU  97   0.162   0.884  -2.636
  713    HB2  LEU  97           HB2      LEU  97   0.182   3.252  -2.002
  714    HB3  LEU  97           HB3      LEU  97  -0.836   3.637  -3.375
  715   HD11  LEU  97          HD11      LEU  97  -1.546   1.743  -1.115
  716   HD12  LEU  97          HD12      LEU  97  -2.171   0.427  -2.109
  717   HD13  LEU  97          HD13      LEU  97  -2.594   2.096  -2.488
  718   HD21  LEU  97          HD21      LEU  97  -1.303   0.092  -4.416
  719   HD22  LEU  97          HD22      LEU  97  -0.063   1.170  -5.056
  720   HD23  LEU  97          HD23      LEU  97  -1.710   1.756  -4.832
  721    H    ARG  98           H        ARG  98   2.191   4.549  -1.982
  722    HA   ARG  98           HA       ARG  98   1.579   7.167  -2.841
  723    HE   ARG  98           HE       ARG  98   0.523   6.049   2.154
  724    HB2  ARG  98           HB2      ARG  98   3.623   6.204  -0.841
  725    HB3  ARG  98           HB3      ARG  98   3.159   7.884  -1.066
  726    HG2  ARG  98           HG2      ARG  98   0.844   7.289  -0.460
  727    HG3  ARG  98           HG3      ARG  98   1.388   5.640  -0.130
  728    HD2  ARG  98           HD2      ARG  98   2.966   6.533   1.529
  729    HD3  ARG  98           HD3      ARG  98   2.349   8.155   1.228
  730   HH11  ARG  98          HH11      ARG  98   2.142   9.116   2.667
  731   HH12  ARG  98          HH12      ARG  98   1.221   9.516   4.086
  732   HH21  ARG  98          HH21      ARG  98  -0.714   6.577   3.991
  733   HH22  ARG  98          HH22      ARG  98  -0.417   8.065   4.841
  734    H    SER  99           H        SER  99   4.439   5.145  -3.163
  735    HA   SER  99           HA       SER  99   6.186   7.135  -4.136
  736    HG   SER  99           HG       SER  99   7.776   6.006  -5.643
  737    HB2  SER  99           HB2      SER  99   6.941   4.945  -3.242
  738    HB3  SER  99           HB3      SER  99   6.259   4.151  -4.661
  739    H    LEU 100           H        LEU 100   4.035   4.846  -5.773
  740    HA   LEU 100           HA       LEU 100   4.855   5.579  -8.400
  741    HG   LEU 100           HG       LEU 100   2.357   4.945  -9.967
  742    HB2  LEU 100           HB2      LEU 100   3.738   3.442  -7.743
  743    HB3  LEU 100           HB3      LEU 100   2.244   4.331  -7.562
  744   HD11  LEU 100          HD11      LEU 100   4.746   4.787 -10.303
  745   HD12  LEU 100          HD12      LEU 100   3.906   3.708 -11.417
  746   HD13  LEU 100          HD13      LEU 100   4.703   3.053  -9.986
  747   HD21  LEU 100          HD21      LEU 100   1.725   2.751 -10.817
  748   HD22  LEU 100          HD22      LEU 100   1.036   3.034  -9.217
  749   HD23  LEU 100          HD23      LEU 100   2.444   1.986  -9.399
  750    H    ALA 101           H        ALA 101   2.335   6.660  -6.215
  751    HA   ALA 101           HA       ALA 101   0.847   8.215  -8.022
  752    HB1  ALA 101           HB1      ALA 101  -0.046   9.341  -6.047
  753    HB2  ALA 101           HB2      ALA 101   1.227   8.623  -5.058
  754    HB3  ALA 101           HB3      ALA 101   0.011   7.594  -5.814
  755    H    LEU 102           H        LEU 102   3.901   8.763  -6.472
  756    HA   LEU 102           HA       LEU 102   3.794  11.584  -7.316
  757    HG   LEU 102           HG       LEU 102   5.280   9.091  -5.050
  758    HB2  LEU 102           HB2      LEU 102   5.693  11.967  -5.761
  759    HB3  LEU 102           HB3      LEU 102   4.208  11.471  -4.979
  760   HD11  LEU 102          HD11      LEU 102   7.197   9.692  -6.436
  761   HD12  LEU 102          HD12      LEU 102   7.697   9.100  -4.852
  762   HD13  LEU 102          HD13      LEU 102   7.734  10.828  -5.199
  763   HD21  LEU 102          HD21      LEU 102   6.252  11.241  -3.177
  764   HD22  LEU 102          HD22      LEU 102   6.282   9.506  -2.867
  765   HD23  LEU 102          HD23      LEU 102   4.740  10.346  -3.031
  766    H    GLU 103           H        GLU 103   5.001   8.634  -8.202
  767    HA   GLU 103           HA       GLU 103   6.398   7.919  -9.826
  768    HB2  GLU 103           HB2      GLU 103   6.736  10.858 -10.437
  769    HB3  GLU 103           HB3      GLU 103   7.353   9.549 -11.435
  770    HG2  GLU 103           HG2      GLU 103   5.104   8.771 -11.861
  771    HG3  GLU 103           HG3      GLU 103   4.449  10.016 -10.796
  772    H    HIS 104           H        HIS 104   7.945  10.907  -8.680
  773    HA   HIS 104           HA       HIS 104   9.933   9.522  -7.177
  774    HD1  HIS 104           HD1      HIS 104  13.088  11.873  -9.165
  775    HD2  HIS 104           HD2      HIS 104  12.485   8.206  -7.299
  776    HE1  HIS 104           HE1      HIS 104  15.249  11.348  -7.982
  777    HE2  HIS 104           HE2      HIS 104  14.807   9.200  -6.736
  778    HB2  HIS 104           HB2      HIS 104  10.761   9.173  -9.524
  779    HB3  HIS 104           HB3      HIS 104  10.872  10.921  -9.693
  780    H    HIS 105           H        HIS 105  10.899  10.903  -5.736
  781    HA   HIS 105           HA       HIS 105  11.223  12.776  -4.503
  782    HD1  HIS 105           HD1      HIS 105  12.575  14.183  -8.312
  783    HD2  HIS 105           HD2      HIS 105  13.143  14.735  -4.225
  784    HE1  HIS 105           HE1      HIS 105  15.042  14.589  -8.010
  785    HE2  HIS 105           HE2      HIS 105  15.351  15.008  -5.543
  786    HB2  HIS 105           HB2      HIS 105  10.441  14.129  -7.057
  787    HB3  HIS 105           HB3      HIS 105  10.468  15.059  -5.562
  788    H    HIS 106           H        HIS 106  10.014  13.054  -2.815
  789    HA   HIS 106           HA       HIS 106   7.340  12.211  -2.805
  790    HD1  HIS 106           HD1      HIS 106   7.351  10.331  -0.424
  791    HD2  HIS 106           HD2      HIS 106   6.047  14.143   0.589
  792    HE1  HIS 106           HE1      HIS 106   5.298   9.990   0.994
  793    HE2  HIS 106           HE2      HIS 106   4.496  12.313   1.561
  794    HB2  HIS 106           HB2      HIS 106   9.071  12.217  -0.890
  795    HB3  HIS 106           HB3      HIS 106   8.545  13.874  -0.608
  796    H    HIS 107           H        HIS 107   5.751  13.279  -3.735
  797    HA   HIS 107           HA       HIS 107   5.629  16.199  -3.555
  798    HD1  HIS 107           HD1      HIS 107   1.965  16.064  -5.853
  799    HD2  HIS 107           HD2      HIS 107   5.773  17.744  -5.893
  800    HE1  HIS 107           HE1      HIS 107   1.694  18.352  -6.867
  801    HE2  HIS 107           HE2      HIS 107   4.037  19.271  -7.053
  802    HB2  HIS 107           HB2      HIS 107   5.303  14.789  -5.731
  803    HB3  HIS 107           HB3      HIS 107   3.699  14.467  -5.084
  804    H    HIS 108           H        HIS 108   4.658  16.888  -1.738
  805    HA   HIS 108           HA       HIS 108   2.982  15.189  -0.180
  806    HD1  HIS 108           HD1      HIS 108   3.194  15.946   3.016
  807    HD2  HIS 108           HD2      HIS 108   6.412  16.833   0.538
  808    HE1  HIS 108           HE1      HIS 108   5.237  15.120   4.236
  809    HE2  HIS 108           HE2      HIS 108   7.151  15.508   2.636
  810    HB2  HIS 108           HB2      HIS 108   3.873  18.035   0.055
  811    HB3  HIS 108           HB3      HIS 108   2.575  17.445   1.086
  812    H    HIS 109           H        HIS 109   2.278  18.161  -2.024
  813    HA   HIS 109           HA       HIS 109  -0.504  17.233  -2.166
  814    HD1  HIS 109           HD1      HIS 109  -1.308  21.351  -3.065
  815    HD2  HIS 109           HD2      HIS 109  -3.095  18.298  -0.878
  816    HE1  HIS 109           HE1      HIS 109  -3.786  21.639  -3.395
  817    HE2  HIS 109           HE2      HIS 109  -4.836  19.683  -2.200
  818    HB2  HIS 109           HB2      HIS 109  -0.333  18.987  -0.426
  819    HB3  HIS 109           HB3      HIS 109   0.328  20.092  -1.626
  Start of MODEL   14
    1    HA   MET   1           HA       MET   1  43.786 -37.929 -26.492
    2    H1   MET   1           H1       MET   1  44.281 -38.715 -23.679
    3    H2   MET   1           H2       MET   1  44.688 -37.217 -24.355
    4    H3   MET   1           H3       MET   1  45.426 -38.631 -24.928
    5    HB2  MET   1           HB2      MET   1  42.872 -40.320 -24.876
    6    HB3  MET   1           HB3      MET   1  42.324 -39.936 -26.501
    7    HG2  MET   1           HG2      MET   1  44.634 -40.164 -27.309
    8    HG3  MET   1           HG3      MET   1  45.135 -40.624 -25.682
    9    HE1  MET   1           HE1      MET   1  45.760 -42.409 -28.228
   10    HE2  MET   1           HE2      MET   1  45.372 -44.014 -27.608
   11    HE3  MET   1           HE3      MET   1  46.219 -42.853 -26.583
   12    H    ALA   2           H        ALA   2  42.206 -38.692 -23.385
   13    HA   ALA   2           HA       ALA   2  39.780 -37.355 -24.154
   14    HB1  ALA   2           HB1      ALA   2  39.031 -37.860 -21.876
   15    HB2  ALA   2           HB2      ALA   2  40.656 -38.403 -21.461
   16    HB3  ALA   2           HB3      ALA   2  39.711 -39.285 -22.662
   17    H    MET   3           H        MET   3  39.339 -35.271 -23.965
   18    HA   MET   3           HA       MET   3  40.648 -33.679 -21.894
   19    HB2  MET   3           HB2      MET   3  41.207 -31.902 -23.512
   20    HB3  MET   3           HB3      MET   3  42.091 -33.388 -23.824
   21    HG2  MET   3           HG2      MET   3  40.410 -33.931 -25.585
   22    HG3  MET   3           HG3      MET   3  39.715 -32.329 -25.338
   23    HE1  MET   3           HE1      MET   3  42.768 -30.031 -26.314
   24    HE2  MET   3           HE2      MET   3  42.424 -30.677 -24.710
   25    HE3  MET   3           HE3      MET   3  41.111 -30.063 -25.714
   26    H    LYS   4           H        LYS   4  39.561 -31.647 -21.490
   27    HA   LYS   4           HA       LYS   4  36.953 -31.293 -22.733
   28    HB2  LYS   4           HB2      LYS   4  36.536 -32.885 -20.885
   29    HB3  LYS   4           HB3      LYS   4  37.216 -31.728 -19.750
   30    HG2  LYS   4           HG2      LYS   4  35.435 -30.151 -20.261
   31    HG3  LYS   4           HG3      LYS   4  34.766 -31.274 -21.444
   32    HD2  LYS   4           HD2      LYS   4  33.471 -31.521 -19.478
   33    HD3  LYS   4           HD3      LYS   4  34.526 -32.931 -19.556
   34    HE2  LYS   4           HE2      LYS   4  34.511 -32.141 -17.300
   35    HE3  LYS   4           HE3      LYS   4  36.083 -31.766 -18.004
   36    HZ1  LYS   4           HZ1      LYS   4  35.171 -29.925 -16.699
   37    HZ2  LYS   4           HZ2      LYS   4  33.833 -29.838 -17.740
   38    HZ3  LYS   4           HZ3      LYS   4  35.390 -29.492 -18.323
   39    H    ASP   5           H        ASP   5  36.909 -29.228 -23.241
   40    HA   ASP   5           HA       ASP   5  37.671 -27.283 -21.176
   41    HB2  ASP   5           HB2      ASP   5  39.480 -27.236 -22.800
   42    HB3  ASP   5           HB3      ASP   5  38.331 -27.077 -24.125
   43    H    VAL   6           H        VAL   6  35.747 -26.542 -20.568
   44    HA   VAL   6           HA       VAL   6  33.812 -25.843 -22.667
   45    HB   VAL   6           HB       VAL   6  32.101 -25.819 -20.870
   46   HG11  VAL   6          HG11      VAL   6  33.642 -28.389 -21.185
   47   HG12  VAL   6          HG12      VAL   6  32.358 -27.793 -22.236
   48   HG13  VAL   6          HG13      VAL   6  31.992 -28.267 -20.577
   49   HG21  VAL   6          HG21      VAL   6  34.308 -26.941 -19.148
   50   HG22  VAL   6          HG22      VAL   6  32.607 -26.825 -18.698
   51   HG23  VAL   6          HG23      VAL   6  33.551 -25.359 -18.964
   52    H    VAL   7           H        VAL   7  33.052 -23.784 -22.846
   53    HA   VAL   7           HA       VAL   7  34.335 -21.781 -21.105
   54    HB   VAL   7           HB       VAL   7  33.180 -21.328 -23.867
   55   HG11  VAL   7          HG11      VAL   7  33.228 -19.335 -22.467
   56   HG12  VAL   7          HG12      VAL   7  34.411 -19.213 -23.768
   57   HG13  VAL   7          HG13      VAL   7  34.939 -19.599 -22.129
   58   HG21  VAL   7          HG21      VAL   7  36.065 -21.691 -23.061
   59   HG22  VAL   7          HG22      VAL   7  35.489 -21.248 -24.667
   60   HG23  VAL   7          HG23      VAL   7  35.100 -22.833 -23.998
   61    H    ASP   8           H        ASP   8  32.720 -21.976 -19.498
   62    HA   ASP   8           HA       ASP   8  30.328 -20.451 -20.114
   63    HB2  ASP   8           HB2      ASP   8  29.562 -22.742 -20.472
   64    HB3  ASP   8           HB3      ASP   8  30.187 -23.216 -18.896
   65    H    LYS   9           H        LYS   9  30.591 -18.871 -18.871
   66    HA   LYS   9           HA       LYS   9  30.316 -19.311 -16.025
   67    HB2  LYS   9           HB2      LYS   9  32.590 -17.759 -17.258
   68    HB3  LYS   9           HB3      LYS   9  32.012 -17.434 -15.639
   69    HG2  LYS   9           HG2      LYS   9  32.454 -19.835 -15.086
   70    HG3  LYS   9           HG3      LYS   9  33.229 -19.977 -16.663
   71    HD2  LYS   9           HD2      LYS   9  34.817 -18.219 -16.035
   72    HD3  LYS   9           HD3      LYS   9  34.049 -18.100 -14.449
   73    HE2  LYS   9           HE2      LYS   9  34.601 -20.507 -14.084
   74    HE3  LYS   9           HE3      LYS   9  35.506 -20.480 -15.598
   75    HZ1  LYS   9           HZ1      LYS   9  36.064 -18.828 -13.193
   76    HZ2  LYS   9           HZ2      LYS   9  36.915 -18.732 -14.659
   77    HZ3  LYS   9           HZ3      LYS   9  36.976 -20.151 -13.733
   78    H    CYS  10           H        CYS  10  28.230 -18.585 -16.340
   79    HA   CYS  10           HA       CYS  10  27.673 -16.208 -17.834
   80    HG   CYS  10           HG       CYS  10  26.547 -19.410 -15.544
   81    HB2  CYS  10           HB2      CYS  10  25.333 -16.575 -17.027
   82    HB3  CYS  10           HB3      CYS  10  26.038 -17.956 -17.862
   83    H    SER  11           H        SER  11  27.106 -14.199 -17.130
   84    HA   SER  11           HA       SER  11  27.751 -13.599 -14.334
   85    HG   SER  11           HG       SER  11  29.119 -12.357 -17.295
   86    HB2  SER  11           HB2      SER  11  27.260 -11.662 -16.609
   87    HB3  SER  11           HB3      SER  11  27.974 -11.298 -15.038
   88    H    THR  12           H        THR  12  25.991 -13.952 -13.097
   89    HA   THR  12           HA       THR  12  23.441 -12.766 -13.966
   90    HB   THR  12           HB       THR  12  22.449 -14.414 -12.257
   91    HG1  THR  12           HG1      THR  12  24.397 -16.246 -12.636
   92   HG21  THR  12          HG21      THR  12  23.759 -15.446 -14.776
   93   HG22  THR  12          HG22      THR  12  22.165 -14.700 -14.656
   94   HG23  THR  12          HG23      THR  12  22.467 -16.263 -13.896
   95    H    LYS  13           H        LYS  13  22.108 -12.870 -11.539
   96    HA   LYS  13           HA       LYS  13  21.758 -11.818  -9.574
   97    HB2  LYS  13           HB2      LYS  13  24.764 -11.622  -9.518
   98    HB3  LYS  13           HB3      LYS  13  23.752 -10.921  -8.265
   99    HG2  LYS  13           HG2      LYS  13  24.431 -12.988  -7.419
  100    HG3  LYS  13           HG3      LYS  13  22.775 -13.249  -7.966
  101    HD2  LYS  13           HD2      LYS  13  23.617 -14.249 -10.030
  102    HD3  LYS  13           HD3      LYS  13  25.276 -13.974  -9.493
  103    HE2  LYS  13           HE2      LYS  13  24.857 -15.422  -7.549
  104    HE3  LYS  13           HE3      LYS  13  23.229 -15.730  -8.150
  105    HZ1  LYS  13           HZ1      LYS  13  24.754 -17.510  -8.739
  106    HZ2  LYS  13           HZ2      LYS  13  25.747 -16.413  -9.575
  107    HZ3  LYS  13           HZ3      LYS  13  24.176 -16.729 -10.127
  108    H    GLY  14           H        GLY  14  21.211  -9.792  -8.908
  109    HA2  GLY  14           HA2      GLY  14  22.195  -7.355  -9.225
  110    HA3  GLY  14           HA3      GLY  14  21.681  -7.687 -10.873
  111    H    CYS  15           H        CYS  15  20.717  -6.707  -7.750
  112    HA   CYS  15           HA       CYS  15  17.917  -6.611  -8.645
  113    HG   CYS  15           HG       CYS  15  18.608  -9.944  -6.195
  114    HB2  CYS  15           HB2      CYS  15  18.855  -7.393  -5.880
  115    HB3  CYS  15           HB3      CYS  15  17.176  -7.202  -6.380
  116    H    ALA  16           H        ALA  16  16.663  -4.931  -7.802
  117    HA   ALA  16           HA       ALA  16  17.862  -3.027  -5.963
  118    HB1  ALA  16           HB1      ALA  16  17.409  -1.098  -7.403
  119    HB2  ALA  16           HB2      ALA  16  16.905  -2.180  -8.701
  120    HB3  ALA  16           HB3      ALA  16  18.580  -2.184  -8.150
  121    H    ILE  17           H        ILE  17  16.213  -3.804  -4.585
  122    HA   ILE  17           HA       ILE  17  13.542  -2.768  -5.182
  123    HB   ILE  17           HB       ILE  17  12.519  -4.876  -4.279
  124   HG12  ILE  17          HG12      ILE  17  15.276  -6.015  -4.785
  125   HG13  ILE  17          HG13      ILE  17  14.563  -5.754  -3.196
  126   HG21  ILE  17          HG21      ILE  17  14.068  -5.105  -6.854
  127   HG22  ILE  17          HG22      ILE  17  12.458  -4.414  -6.649
  128   HG23  ILE  17          HG23      ILE  17  12.718  -6.138  -6.384
  129   HD11  ILE  17          HD11      ILE  17  12.804  -7.366  -3.734
  130   HD12  ILE  17          HD12      ILE  17  14.413  -8.080  -3.845
  131   HD13  ILE  17          HD13      ILE  17  13.543  -7.636  -5.313
  132    H    ASP  18           H        ASP  18  12.134  -3.516  -3.113
  133    HA   ASP  18           HA       ASP  18  11.667  -3.387  -0.908
  134    HB2  ASP  18           HB2      ASP  18  13.623  -4.849  -0.553
  135    HB3  ASP  18           HB3      ASP  18  14.652  -3.427  -0.459
  136    H    ILE  19           H        ILE  19  11.065  -1.713   0.329
  137    HA   ILE  19           HA       ILE  19  12.177   0.906  -0.423
  138    HB   ILE  19           HB       ILE  19   9.578   0.539   1.044
  139   HG12  ILE  19          HG12      ILE  19   9.848   0.442  -1.970
  140   HG13  ILE  19          HG13      ILE  19   9.580  -0.978  -0.965
  141   HG21  ILE  19          HG21      ILE  19   8.987   2.604  -0.125
  142   HG22  ILE  19          HG22      ILE  19  10.540   2.578  -0.964
  143   HG23  ILE  19          HG23      ILE  19  10.486   2.792   0.786
  144   HD11  ILE  19          HD11      ILE  19   7.733   1.384  -1.213
  145   HD12  ILE  19          HD12      ILE  19   7.454  -0.050  -0.225
  146   HD13  ILE  19          HD13      ILE  19   7.521  -0.188  -1.982
  147    H    GLY  20           H        GLY  20  12.924  -1.166   1.818
  148    HA2  GLY  20           HA2      GLY  20  13.857  -0.922   3.927
  149    HA3  GLY  20           HA3      GLY  20  13.369   0.768   3.921
  150    H    THR  21           H        THR  21  11.038   1.168   4.135
  151    HA   THR  21           HA       THR  21   8.948   0.890   4.931
  152    HB   THR  21           HB       THR  21   9.627  -2.011   5.368
  153    HG1  THR  21           HG1      THR  21   9.061  -2.340   3.303
  154   HG21  THR  21          HG21      THR  21   7.644  -1.245   6.578
  155   HG22  THR  21          HG22      THR  21   7.200  -2.324   5.256
  156   HG23  THR  21          HG23      THR  21   6.985  -0.582   5.084
  157    H    VAL  22           H        VAL  22   8.526   1.846   6.732
  158    HA   VAL  22           HA       VAL  22   9.418   0.659   9.264
  159    HB   VAL  22           HB       VAL  22   9.305   2.964  10.223
  160   HG11  VAL  22          HG11      VAL  22  11.445   1.955   9.600
  161   HG12  VAL  22          HG12      VAL  22  11.459   3.701   9.354
  162   HG13  VAL  22          HG13      VAL  22  11.282   2.619   7.974
  163   HG21  VAL  22          HG21      VAL  22   9.377   4.886   8.705
  164   HG22  VAL  22          HG22      VAL  22   7.862   3.994   8.549
  165   HG23  VAL  22          HG23      VAL  22   9.125   3.808   7.333
  166    H    ILE  23           H        ILE  23   7.870   1.980  11.028
  167    HA   ILE  23           HA       ILE  23   5.803   2.166  11.941
  168    HB   ILE  23           HB       ILE  23   4.844   2.210   9.083
  169   HG12  ILE  23          HG12      ILE  23   5.221   4.462  11.066
  170   HG13  ILE  23          HG13      ILE  23   6.329   4.083   9.750
  171   HG21  ILE  23          HG21      ILE  23   2.746   3.123   9.986
  172   HG22  ILE  23          HG22      ILE  23   3.346   2.852  11.621
  173   HG23  ILE  23          HG23      ILE  23   3.049   1.481  10.552
  174   HD11  ILE  23          HD11      ILE  23   4.557   4.565   8.134
  175   HD12  ILE  23          HD12      ILE  23   4.898   5.950   9.172
  176   HD13  ILE  23          HD13      ILE  23   3.465   4.964   9.460
  177    H    ASP  24           H        ASP  24   5.024   0.524  13.037
  178    HA   ASP  24           HA       ASP  24   4.897  -2.106  11.842
  179    HB2  ASP  24           HB2      ASP  24   4.269  -1.196  14.656
  180    HB3  ASP  24           HB3      ASP  24   4.325  -2.871  14.121
  181    H    ASN  25           H        ASN  25   3.177  -2.380  10.539
  182    HA   ASN  25           HA       ASN  25   0.576  -1.382  11.073
  183    HB2  ASN  25           HB2      ASN  25   1.631  -2.106   8.833
  184    HB3  ASN  25           HB3      ASN  25   1.220  -3.746   9.320
  185   HD21  ASN  25          HD21      ASN  25   0.277  -2.153   7.094
  186   HD22  ASN  25          HD22      ASN  25  -1.439  -2.087   7.248
  187    H    ASP  26           H        ASP  26  -1.139  -2.350  12.079
  188    HA   ASP  26           HA       ASP  26  -0.441  -4.480  13.906
  189    HB2  ASP  26           HB2      ASP  26  -2.914  -2.773  13.643
  190    HB3  ASP  26           HB3      ASP  26  -2.741  -4.048  14.843
  191    H    ASN  27           H        ASN  27  -1.736  -4.432  10.821
  192    HA   ASN  27           HA       ASN  27  -2.648  -7.166  11.175
  193    HB2  ASN  27           HB2      ASN  27  -4.791  -6.925  10.220
  194    HB3  ASN  27           HB3      ASN  27  -4.672  -5.635  11.404
  195   HD21  ASN  27          HD21      ASN  27  -3.052  -3.886   9.745
  196   HD22  ASN  27          HD22      ASN  27  -4.092  -3.300   8.498
  197    H    CYS  28           H        CYS  28  -3.157  -8.171   8.959
  198    HA   CYS  28           HA       CYS  28  -0.993  -7.294   7.176
  199    HG   CYS  28           HG       CYS  28  -0.460  -9.153   9.588
  200    HB2  CYS  28           HB2      CYS  28  -2.352  -9.980   7.464
  201    HB3  CYS  28           HB3      CYS  28  -1.108  -9.618   6.271
  202    H    THR  29           H        THR  29  -4.007  -6.512   7.332
  203    HA   THR  29           HA       THR  29  -4.606  -6.969   4.495
  204    HB   THR  29           HB       THR  29  -6.474  -5.930   6.636
  205    HG1  THR  29           HG1      THR  29  -7.192  -7.962   6.879
  206   HG21  THR  29          HG21      THR  29  -8.228  -6.450   4.999
  207   HG22  THR  29          HG22      THR  29  -6.989  -6.915   3.833
  208   HG23  THR  29          HG23      THR  29  -7.097  -5.244   4.383
  209    H    SER  30           H        SER  30  -4.528  -5.323   3.105
  210    HA   SER  30           HA       SER  30  -3.888  -2.665   4.149
  211    HG   SER  30           HG       SER  30  -2.493  -1.441   2.506
  212    HB2  SER  30           HB2      SER  30  -2.383  -3.694   2.437
  213    HB3  SER  30           HB3      SER  30  -3.734  -3.702   1.302
  214    H    LYS  31           H        LYS  31  -5.532  -1.303   4.379
  215    HA   LYS  31           HA       LYS  31  -7.900  -1.598   2.668
  216    HB2  LYS  31           HB2      LYS  31  -7.450  -0.097   5.251
  217    HB3  LYS  31           HB3      LYS  31  -8.895   0.107   4.278
  218    HG2  LYS  31           HG2      LYS  31  -9.340  -1.394   6.102
  219    HG3  LYS  31           HG3      LYS  31  -9.403  -2.285   4.581
  220    HD2  LYS  31           HD2      LYS  31  -7.461  -3.437   5.021
  221    HD3  LYS  31           HD3      LYS  31  -6.847  -2.190   6.105
  222    HE2  LYS  31           HE2      LYS  31  -9.157  -4.036   6.708
  223    HE3  LYS  31           HE3      LYS  31  -7.505  -4.264   7.282
  224    HZ1  LYS  31           HZ1      LYS  31  -7.707  -2.044   8.370
  225    HZ2  LYS  31           HZ2      LYS  31  -8.738  -3.228   9.008
  226    HZ3  LYS  31           HZ3      LYS  31  -9.359  -2.040   7.967
  227    H    PHE  32           H        PHE  32  -7.872  -0.436   0.896
  228    HA   PHE  32           HA       PHE  32  -6.726   2.274   1.022
  229    HD1  PHE  32           HD2      PHE  32  -4.647   3.202  -0.062
  230    HD2  PHE  32           HD1      PHE  32  -7.014   1.721  -3.275
  231    HE1  PHE  32           HE2      PHE  32  -4.016   5.153  -1.421
  232    HE2  PHE  32           HE1      PHE  32  -6.388   3.671  -4.637
  233    HZ   PHE  32           HZ       PHE  32  -4.897   5.391  -3.709
  234    HB2  PHE  32           HB2      PHE  32  -5.366   0.704  -0.348
  235    HB3  PHE  32           HB3      PHE  32  -6.764   0.435  -1.384
  236    H    SER  33           H        SER  33  -8.199   3.796   0.788
  237    HA   SER  33           HA       SER  33 -10.641   3.201  -0.748
  238    HG   SER  33           HG       SER  33 -11.251   2.326   1.739
  239    HB2  SER  33           HB2      SER  33 -10.570   5.094   1.599
  240    HB3  SER  33           HB3      SER  33 -11.962   4.291   0.874
  241    H    ARG  34           H        ARG  34 -11.159   4.607  -2.308
  242    HA   ARG  34           HA       ARG  34  -9.943   7.277  -2.280
  243    HE   ARG  34           HE       ARG  34  -5.792   7.268  -2.349
  244    HB2  ARG  34           HB2      ARG  34  -9.676   5.181  -4.387
  245    HB3  ARG  34           HB3      ARG  34  -9.688   6.874  -4.844
  246    HG2  ARG  34           HG2      ARG  34  -7.767   5.563  -2.943
  247    HG3  ARG  34           HG3      ARG  34  -7.421   6.089  -4.594
  248    HD2  ARG  34           HD2      ARG  34  -8.019   8.403  -3.911
  249    HD3  ARG  34           HD3      ARG  34  -8.172   7.825  -2.254
  250   HH11  ARG  34          HH11      ARG  34  -7.108   9.496  -4.682
  251   HH12  ARG  34          HH12      ARG  34  -5.582  10.248  -5.043
  252   HH21  ARG  34          HH21      ARG  34  -3.767   8.254  -2.776
  253   HH22  ARG  34          HH22      ARG  34  -3.655   9.507  -3.969
  254    H    PHE  35           H        PHE  35 -11.038   8.847  -3.549
  255    HA   PHE  35           HA       PHE  35 -13.805   8.124  -4.217
  256    HD1  PHE  35           HD2      PHE  35 -15.659   9.102  -2.447
  257    HD2  PHE  35           HD1      PHE  35 -11.846  10.699  -1.435
  258    HE1  PHE  35           HE2      PHE  35 -16.156   8.767  -0.061
  259    HE2  PHE  35           HE1      PHE  35 -12.336  10.368   0.953
  260    HZ   PHE  35           HZ       PHE  35 -14.499   9.399   1.641
  261    HB2  PHE  35           HB2      PHE  35 -12.616  10.845  -3.634
  262    HB3  PHE  35           HB3      PHE  35 -14.302  10.537  -4.028
  263    H    PHE  36           H        PHE  36 -14.543   8.369  -6.249
  264    HA   PHE  36           HA       PHE  36 -12.813   9.739  -8.193
  265    HD1  PHE  36           HD2      PHE  36 -10.820   8.517  -9.491
  266    HD2  PHE  36           HD1      PHE  36 -12.890   5.614  -7.173
  267    HE1  PHE  36           HE2      PHE  36  -8.671   7.538  -8.805
  268    HE2  PHE  36           HE1      PHE  36 -10.746   4.633  -6.482
  269    HZ   PHE  36           HZ       PHE  36  -8.633   5.596  -7.296
  270    HB2  PHE  36           HB2      PHE  36 -14.087   7.020  -8.584
  271    HB3  PHE  36           HB3      PHE  36 -13.270   7.940  -9.844
  272    H    ALA  37           H        ALA  37 -14.009  10.085 -10.309
  273    HA   ALA  37           HA       ALA  37 -16.370  11.543  -9.739
  274    HB1  ALA  37           HB1      ALA  37 -16.427  12.031 -12.110
  275    HB2  ALA  37           HB2      ALA  37 -15.270  10.739 -12.432
  276    HB3  ALA  37           HB3      ALA  37 -14.773  12.160 -11.511
  277    H    THR  38           H        THR  38 -15.856   8.650 -11.760
  278    HA   THR  38           HA       THR  38 -18.669   7.928 -11.274
  279    HB   THR  38           HB       THR  38 -18.751   6.932 -13.520
  280    HG1  THR  38           HG1      THR  38 -16.723   8.006 -14.775
  281   HG21  THR  38          HG21      THR  38 -18.790   8.991 -14.839
  282   HG22  THR  38          HG22      THR  38 -17.852   9.816 -13.595
  283   HG23  THR  38          HG23      THR  38 -19.489   9.263 -13.242
  284    H    ARG  39           H        ARG  39 -19.067   5.558 -11.614
  285    HA   ARG  39           HA       ARG  39 -17.280   4.003 -10.082
  286    HE   ARG  39           HE       ARG  39 -19.260  -1.143 -10.882
  287    HB2  ARG  39           HB2      ARG  39 -19.602   3.440 -10.101
  288    HB3  ARG  39           HB3      ARG  39 -19.613   3.247 -11.843
  289    HG2  ARG  39           HG2      ARG  39 -18.137   1.291 -11.612
  290    HG3  ARG  39           HG3      ARG  39 -18.180   1.492  -9.859
  291    HD2  ARG  39           HD2      ARG  39 -20.689   1.296 -10.025
  292    HD3  ARG  39           HD3      ARG  39 -20.450   0.794 -11.700
  293   HH11  ARG  39          HH11      ARG  39 -21.072   0.697  -8.515
  294   HH12  ARG  39          HH12      ARG  39 -21.126  -0.597  -7.361
  295   HH21  ARG  39          HH21      ARG  39 -19.348  -2.873  -9.358
  296   HH22  ARG  39          HH22      ARG  39 -20.168  -2.621  -7.837
  297    H    GLU  40           H        GLU  40 -17.649   4.581 -13.480
  298    HA   GLU  40           HA       GLU  40 -16.042   2.580 -14.578
  299    HB2  GLU  40           HB2      GLU  40 -16.354   5.467 -15.414
  300    HB3  GLU  40           HB3      GLU  40 -15.675   4.190 -16.411
  301    HG2  GLU  40           HG2      GLU  40 -17.752   3.075 -16.548
  302    HG3  GLU  40           HG3      GLU  40 -18.462   4.098 -15.303
  303    H    GLU  41           H        GLU  41 -15.215   5.804 -13.417
  304    HA   GLU  41           HA       GLU  41 -12.457   5.737 -13.875
  305    HB2  GLU  41           HB2      GLU  41 -13.944   7.162 -11.661
  306    HB3  GLU  41           HB3      GLU  41 -12.317   7.534 -12.202
  307    HG2  GLU  41           HG2      GLU  41 -14.829   7.803 -13.834
  308    HG3  GLU  41           HG3      GLU  41 -13.935   9.116 -13.069
  309    H    ALA  42           H        ALA  42 -14.391   4.328 -11.370
  310    HA   ALA  42           HA       ALA  42 -12.266   3.949  -9.483
  311    HB1  ALA  42           HB1      ALA  42 -14.952   2.583  -9.627
  312    HB2  ALA  42           HB2      ALA  42 -14.618   4.101  -8.793
  313    HB3  ALA  42           HB3      ALA  42 -13.863   2.605  -8.240
  314    H    GLU  43           H        GLU  43 -13.876   1.916 -11.893
  315    HA   GLU  43           HA       GLU  43 -12.504  -0.480 -11.326
  316    HB2  GLU  43           HB2      GLU  43 -13.596   0.447 -13.986
  317    HB3  GLU  43           HB3      GLU  43 -13.225  -1.212 -13.535
  318    HG2  GLU  43           HG2      GLU  43 -14.969  -1.163 -11.848
  319    HG3  GLU  43           HG3      GLU  43 -15.327   0.516 -12.254
  320    H    SER  44           H        SER  44 -11.749   2.290 -13.313
  321    HA   SER  44           HA       SER  44  -9.537   1.295 -14.700
  322    HG   SER  44           HG       SER  44  -8.535   3.464 -15.983
  323    HB2  SER  44           HB2      SER  44 -10.587   3.425 -15.277
  324    HB3  SER  44           HB3      SER  44 -10.095   4.112 -13.729
  325    H    PHE  45           H        PHE  45  -9.837   2.641 -11.449
  326    HA   PHE  45           HA       PHE  45  -6.985   2.720 -11.061
  327    HD1  PHE  45           HD1      PHE  45  -6.624   5.305 -10.410
  328    HD2  PHE  45           HD2      PHE  45  -7.414   2.826  -7.042
  329    HE1  PHE  45           HE1      PHE  45  -4.706   6.303  -9.233
  330    HE2  PHE  45           HE2      PHE  45  -5.500   3.818  -5.860
  331    HZ   PHE  45           HZ       PHE  45  -4.145   5.557  -6.953
  332    HB2  PHE  45           HB2      PHE  45  -8.872   4.208  -9.984
  333    HB3  PHE  45           HB3      PHE  45  -8.941   2.904  -8.803
  334    H    MET  46           H        MET  46  -9.626   0.545 -10.391
  335    HA   MET  46           HA       MET  46  -8.255  -1.158  -8.582
  336    HB2  MET  46           HB2      MET  46 -10.688  -1.202  -8.771
  337    HB3  MET  46           HB3      MET  46 -10.571  -1.725 -10.444
  338    HG2  MET  46           HG2      MET  46 -11.140  -3.562  -8.939
  339    HG3  MET  46           HG3      MET  46  -9.604  -3.829  -9.760
  340    HE1  MET  46           HE1      MET  46 -10.256  -1.410  -6.731
  341    HE2  MET  46           HE2      MET  46  -9.906  -2.464  -5.361
  342    HE3  MET  46           HE3      MET  46 -11.318  -2.773  -6.372
  343    H    THR  47           H        THR  47  -8.341  -0.875 -12.054
  344    HA   THR  47           HA       THR  47  -7.259  -3.385 -12.731
  345    HB   THR  47           HB       THR  47  -6.856  -0.780 -14.226
  346    HG1  THR  47           HG1      THR  47  -9.102  -1.287 -13.745
  347   HG21  THR  47          HG21      THR  47  -6.700  -2.220 -16.200
  348   HG22  THR  47          HG22      THR  47  -6.900  -3.649 -15.186
  349   HG23  THR  47          HG23      THR  47  -5.459  -2.645 -15.020
  350    H    LYS  48           H        LYS  48  -5.664  -0.243 -12.147
  351    HA   LYS  48           HA       LYS  48  -3.047  -1.339 -12.409
  352    HB2  LYS  48           HB2      LYS  48  -2.250   0.805 -11.511
  353    HB3  LYS  48           HB3      LYS  48  -3.355   0.993 -12.863
  354    HG2  LYS  48           HG2      LYS  48  -5.106   1.699 -11.462
  355    HG3  LYS  48           HG3      LYS  48  -4.238   1.200 -10.008
  356    HD2  LYS  48           HD2      LYS  48  -3.273   3.340 -11.889
  357    HD3  LYS  48           HD3      LYS  48  -4.229   3.648 -10.443
  358    HE2  LYS  48           HE2      LYS  48  -2.512   2.686  -9.046
  359    HE3  LYS  48           HE3      LYS  48  -1.575   2.229 -10.468
  360    HZ1  LYS  48           HZ1      LYS  48  -2.251   5.033  -9.782
  361    HZ2  LYS  48           HZ2      LYS  48  -1.173   4.494 -10.977
  362    HZ3  LYS  48           HZ3      LYS  48  -0.802   4.280  -9.339
  363    H    LEU  49           H        LEU  49  -5.281  -0.939  -9.765
  364    HA   LEU  49           HA       LEU  49  -3.508  -1.323  -7.624
  365    HG   LEU  49           HG       LEU  49  -6.510  -0.579  -5.740
  366    HB2  LEU  49           HB2      LEU  49  -6.367  -1.342  -8.033
  367    HB3  LEU  49           HB3      LEU  49  -5.894  -2.635  -6.946
  368   HD11  LEU  49          HD11      LEU  49  -3.599  -1.333  -5.545
  369   HD12  LEU  49          HD12      LEU  49  -4.943  -2.106  -4.704
  370   HD13  LEU  49          HD13      LEU  49  -4.502  -0.441  -4.323
  371   HD21  LEU  49          HD21      LEU  49  -5.053   1.381  -5.853
  372   HD22  LEU  49          HD22      LEU  49  -5.807   1.049  -7.413
  373   HD23  LEU  49          HD23      LEU  49  -4.120   0.614  -7.140
  374    H    LYS  50           H        LYS  50  -5.223  -3.624  -9.699
  375    HA   LYS  50           HA       LYS  50  -4.374  -5.993  -8.495
  376    HB2  LYS  50           HB2      LYS  50  -5.052  -5.275 -11.341
  377    HB3  LYS  50           HB3      LYS  50  -4.682  -6.920 -10.845
  378    HG2  LYS  50           HG2      LYS  50  -6.628  -7.166  -9.699
  379    HG3  LYS  50           HG3      LYS  50  -6.743  -5.450  -9.306
  380    HD2  LYS  50           HD2      LYS  50  -7.637  -4.908 -11.374
  381    HD3  LYS  50           HD3      LYS  50  -7.020  -6.374 -12.127
  382    HE2  LYS  50           HE2      LYS  50  -8.631  -7.710 -10.870
  383    HE3  LYS  50           HE3      LYS  50  -9.222  -6.258 -10.065
  384    HZ1  LYS  50           HZ1      LYS  50 -10.004  -5.416 -12.163
  385    HZ2  LYS  50           HZ2      LYS  50 -10.643  -6.967 -11.910
  386    HZ3  LYS  50           HZ3      LYS  50  -9.355  -6.745 -12.993
  387    H    GLU  51           H        GLU  51  -2.805  -3.955 -10.934
  388    HA   GLU  51           HA       GLU  51  -0.565  -5.614 -11.375
  389    HB2  GLU  51           HB2      GLU  51  -0.761  -2.605 -11.607
  390    HB3  GLU  51           HB3      GLU  51   0.507  -3.607 -12.300
  391    HG2  GLU  51           HG2      GLU  51  -1.256  -4.768 -13.630
  392    HG3  GLU  51           HG3      GLU  51  -2.401  -3.561 -13.046
  393    H    LEU  52           H        LEU  52  -1.131  -2.911  -9.162
  394    HA   LEU  52           HA       LEU  52   1.419  -2.838  -7.997
  395    HG   LEU  52           HG       LEU  52  -0.758  -0.747  -8.770
  396    HB2  LEU  52           HB2      LEU  52  -1.254  -2.125  -6.788
  397    HB3  LEU  52           HB3      LEU  52   0.301  -1.696  -6.103
  398   HD11  LEU  52          HD11      LEU  52  -1.937   0.241  -6.865
  399   HD12  LEU  52          HD12      LEU  52  -0.931   1.429  -7.694
  400   HD13  LEU  52          HD13      LEU  52  -0.393   0.730  -6.167
  401   HD21  LEU  52          HD21      LEU  52   1.760  -0.023  -7.279
  402   HD22  LEU  52          HD22      LEU  52   1.192   0.727  -8.769
  403   HD23  LEU  52          HD23      LEU  52   1.670  -0.971  -8.761
  404    H    ALA  53           H        ALA  53  -1.490  -4.650  -7.123
  405    HA   ALA  53           HA       ALA  53  -0.467  -5.839  -4.785
  406    HB1  ALA  53           HB1      ALA  53  -2.858  -5.778  -5.329
  407    HB2  ALA  53           HB2      ALA  53  -2.305  -7.417  -4.987
  408    HB3  ALA  53           HB3      ALA  53  -2.581  -6.910  -6.654
  409    H    ALA  54           H        ALA  54  -0.463  -6.884  -8.167
  410    HA   ALA  54           HA       ALA  54   0.679  -9.420  -7.782
  411    HB1  ALA  54           HB1      ALA  54   0.921  -7.620 -10.193
  412    HB2  ALA  54           HB2      ALA  54  -0.409  -8.732  -9.871
  413    HB3  ALA  54           HB3      ALA  54   1.214  -9.360 -10.156
  414    H    ALA  55           H        ALA  55   2.157  -6.266  -8.401
  415    HA   ALA  55           HA       ALA  55   4.826  -7.214  -8.531
  416    HB1  ALA  55           HB1      ALA  55   4.141  -5.081  -9.511
  417    HB2  ALA  55           HB2      ALA  55   5.472  -4.871  -8.373
  418    HB3  ALA  55           HB3      ALA  55   3.830  -4.436  -7.899
  419    H    ALA  56           H        ALA  56   2.794  -6.034  -5.931
  420    HA   ALA  56           HA       ALA  56   4.868  -5.813  -3.999
  421    HB1  ALA  56           HB1      ALA  56   2.769  -4.564  -3.822
  422    HB2  ALA  56           HB2      ALA  56   3.067  -5.543  -2.386
  423    HB3  ALA  56           HB3      ALA  56   1.893  -6.078  -3.587
  424    H    SER  57           H        SER  57   2.330  -8.240  -4.550
  425    HA   SER  57           HA       SER  57   3.025  -9.839  -2.351
  426    HG   SER  57           HG       SER  57   1.132  -9.625  -5.457
  427    HB2  SER  57           HB2      SER  57   1.600 -11.574  -3.458
  428    HB3  SER  57           HB3      SER  57   0.815 -10.004  -3.303
  429    H    SER  58           H        SER  58   4.465 -11.343  -2.054
  430    HA   SER  58           HA       SER  58   5.970 -12.372  -4.377
  431    HG   SER  58           HG       SER  58   6.472 -10.012  -2.878
  432    HB2  SER  58           HB2      SER  58   7.065 -11.998  -1.580
  433    HB3  SER  58           HB3      SER  58   7.969 -12.404  -3.039
  434    H    ALA  59           H        ALA  59   3.901 -12.983  -1.862
  435    HA   ALA  59           HA       ALA  59   4.782 -15.451  -0.863
  436    HB1  ALA  59           HB1      ALA  59   3.145 -14.064   0.279
  437    HB2  ALA  59           HB2      ALA  59   2.521 -15.692   0.009
  438    HB3  ALA  59           HB3      ALA  59   1.981 -14.358  -1.013
  439    H    ASP  60           H        ASP  60   2.157 -14.835  -3.231
  440    HA   ASP  60           HA       ASP  60   2.721 -17.474  -4.351
  441    HB2  ASP  60           HB2      ASP  60   0.914 -17.710  -2.671
  442    HB3  ASP  60           HB3      ASP  60  -0.058 -16.580  -3.609
  443    H    GLU  61           H        GLU  61  -0.121 -15.571  -5.061
  444    HA   GLU  61           HA       GLU  61   1.089 -14.777  -7.627
  445    HB2  GLU  61           HB2      GLU  61  -0.547 -16.658  -7.880
  446    HB3  GLU  61           HB3      GLU  61  -1.785 -15.625  -7.179
  447    HG2  GLU  61           HG2      GLU  61  -1.348 -14.014  -9.055
  448    HG3  GLU  61           HG3      GLU  61  -0.354 -15.269  -9.790
  449    H    GLY  62           H        GLY  62  -0.716 -14.017  -4.840
  450    HA2  GLY  62           HA2      GLY  62  -0.655 -11.240  -5.214
  451    HA3  GLY  62           HA3      GLY  62  -2.217 -11.822  -5.772
  452    H    ALA  63           H        ALA  63  -3.546 -11.084  -4.234
  453    HA   ALA  63           HA       ALA  63  -3.227 -12.149  -1.540
  454    HB1  ALA  63           HB1      ALA  63  -2.123  -9.957  -1.480
  455    HB2  ALA  63           HB2      ALA  63  -3.585  -9.973  -0.494
  456    HB3  ALA  63           HB3      ALA  63  -3.598  -9.199  -2.079
  457    H    SER  64           H        SER  64  -5.198 -11.955  -0.276
  458    HA   SER  64           HA       SER  64  -7.561 -12.399  -1.794
  459    HG   SER  64           HG       SER  64  -7.547 -14.357  -0.196
  460    HB2  SER  64           HB2      SER  64  -7.210 -11.884   1.172
  461    HB3  SER  64           HB3      SER  64  -8.671 -12.507   0.408
  462    H    VAL  65           H        VAL  65  -8.534 -10.796  -2.860
  463    HA   VAL  65           HA       VAL  65  -8.465  -8.113  -1.705
  464    HB   VAL  65           HB       VAL  65  -7.588  -8.160  -3.926
  465   HG11  VAL  65          HG11      VAL  65  -8.853  -8.923  -5.868
  466   HG12  VAL  65          HG12      VAL  65 -10.177  -9.423  -4.817
  467   HG13  VAL  65          HG13      VAL  65  -8.614 -10.233  -4.711
  468   HG21  VAL  65          HG21      VAL  65 -10.371  -7.000  -3.930
  469   HG22  VAL  65          HG22      VAL  65  -9.106  -6.607  -5.093
  470   HG23  VAL  65          HG23      VAL  65  -8.895  -6.198  -3.391
  471    H    ALA  66           H        ALA  66 -10.140  -7.551  -0.556
  472    HA   ALA  66           HA       ALA  66 -12.828  -8.255  -1.552
  473    HB1  ALA  66           HB1      ALA  66 -12.388  -9.277   0.625
  474    HB2  ALA  66           HB2      ALA  66 -13.637  -8.038   0.750
  475    HB3  ALA  66           HB3      ALA  66 -11.995  -7.695   1.297
  476    H    TYR  67           H        TYR  67 -13.553  -6.530  -2.628
  477    HA   TYR  67           HA       TYR  67 -13.134  -3.885  -1.413
  478    HD1  TYR  67           HD2      TYR  67 -11.798  -6.393  -4.526
  479    HD2  TYR  67           HD1      TYR  67 -14.053  -2.893  -5.406
  480    HE1  TYR  67           HE2      TYR  67 -12.398  -7.335  -6.714
  481    HE2  TYR  67           HE1      TYR  67 -14.659  -3.828  -7.601
  482    HH   TYR  67           HH       TYR  67 -14.111  -7.112  -8.412
  483    HB2  TYR  67           HB2      TYR  67 -12.553  -2.918  -3.545
  484    HB3  TYR  67           HB3      TYR  67 -11.484  -4.282  -3.249
  485    H    LYS  68           H        LYS  68 -14.680  -2.266  -2.058
  486    HA   LYS  68           HA       LYS  68 -16.905  -3.253  -3.678
  487    HB2  LYS  68           HB2      LYS  68 -18.572  -2.549  -2.253
  488    HB3  LYS  68           HB3      LYS  68 -17.378  -3.129  -1.110
  489    HG2  LYS  68           HG2      LYS  68 -17.460  -0.245  -1.889
  490    HG3  LYS  68           HG3      LYS  68 -18.562  -0.884  -0.677
  491    HD2  LYS  68           HD2      LYS  68 -15.570  -1.164  -0.526
  492    HD3  LYS  68           HD3      LYS  68 -16.469   0.158   0.223
  493    HE2  LYS  68           HE2      LYS  68 -17.836  -1.669   1.373
  494    HE3  LYS  68           HE3      LYS  68 -16.563  -2.775   0.859
  495    HZ1  LYS  68           HZ1      LYS  68 -16.278  -0.419   2.642
  496    HZ2  LYS  68           HZ2      LYS  68 -14.961  -1.292   2.024
  497    HZ3  LYS  68           HZ3      LYS  68 -16.075  -2.051   3.056
  498    H    ILE  69           H        ILE  69 -17.868  -1.737  -4.955
  499    HA   ILE  69           HA       ILE  69 -16.585   0.906  -5.061
  500    HB   ILE  69           HB       ILE  69 -18.133  -0.437  -7.286
  501   HG12  ILE  69          HG12      ILE  69 -15.128  -0.197  -6.980
  502   HG13  ILE  69          HG13      ILE  69 -16.050  -1.681  -6.763
  503   HG21  ILE  69          HG21      ILE  69 -16.360   2.004  -7.248
  504   HG22  ILE  69          HG22      ILE  69 -18.116   1.987  -7.397
  505   HG23  ILE  69          HG23      ILE  69 -17.118   1.312  -8.684
  506   HD11  ILE  69          HD11      ILE  69 -15.788  -0.105  -9.315
  507   HD12  ILE  69          HD12      ILE  69 -16.745  -1.572  -9.111
  508   HD13  ILE  69          HD13      ILE  69 -14.991  -1.633  -8.937
  509    H    LYS  70           H        LYS  70 -17.841   2.250  -3.919
  510    HA   LYS  70           HA       LYS  70 -20.707   1.736  -3.862
  511    HB2  LYS  70           HB2      LYS  70 -19.588   2.072  -1.720
  512    HB3  LYS  70           HB3      LYS  70 -19.046   3.661  -2.240
  513    HG2  LYS  70           HG2      LYS  70 -20.989   3.734  -0.724
  514    HG3  LYS  70           HG3      LYS  70 -21.298   4.481  -2.289
  515    HD2  LYS  70           HD2      LYS  70 -23.211   3.165  -1.682
  516    HD3  LYS  70           HD3      LYS  70 -22.386   2.368  -3.021
  517    HE2  LYS  70           HE2      LYS  70 -21.290   0.859  -1.403
  518    HE3  LYS  70           HE3      LYS  70 -22.197   1.632  -0.103
  519    HZ1  LYS  70           HZ1      LYS  70 -23.196  -0.092  -2.281
  520    HZ2  LYS  70           HZ2      LYS  70 -24.237   0.994  -1.492
  521    HZ3  LYS  70           HZ3      LYS  70 -23.454  -0.220  -0.606
  522    H    ASP  71           H        ASP  71 -22.011   2.725  -5.119
  523    HA   ASP  71           HA       ASP  71 -21.241   4.971  -6.741
  524    HB2  ASP  71           HB2      ASP  71 -23.990   3.741  -6.402
  525    HB3  ASP  71           HB3      ASP  71 -23.427   4.733  -7.736
  526    H    LEU  72           H        LEU  72 -20.943   6.754  -5.429
  527    HA   LEU  72           HA       LEU  72 -22.845   7.330  -3.307
  528    HG   LEU  72           HG       LEU  72 -19.914   6.519  -3.039
  529    HB2  LEU  72           HB2      LEU  72 -20.293   8.712  -4.132
  530    HB3  LEU  72           HB3      LEU  72 -21.283   9.194  -2.769
  531   HD11  LEU  72          HD11      LEU  72 -19.162   8.949  -1.421
  532   HD12  LEU  72          HD12      LEU  72 -18.275   8.283  -2.792
  533   HD13  LEU  72          HD13      LEU  72 -18.401   7.364  -1.293
  534   HD21  LEU  72          HD21      LEU  72 -20.480   6.284  -0.659
  535   HD22  LEU  72          HD22      LEU  72 -21.918   6.410  -1.672
  536   HD23  LEU  72          HD23      LEU  72 -21.376   7.800  -0.732
  537    H    GLU  73           H        GLU  73 -22.738  10.063  -3.209
  538    HA   GLU  73           HA       GLU  73 -24.553  10.722  -5.387
  539    HB2  GLU  73           HB2      GLU  73 -23.953  12.222  -2.833
  540    HB3  GLU  73           HB3      GLU  73 -25.235  12.596  -3.978
  541    HG2  GLU  73           HG2      GLU  73 -26.276  10.428  -3.507
  542    HG3  GLU  73           HG3      GLU  73 -25.002  10.080  -2.339
  543    H    GLY  74           H        GLY  74 -23.284  11.262  -7.106
  544    HA2  GLY  74           HA2      GLY  74 -22.393  13.030  -8.377
  545    HA3  GLY  74           HA3      GLY  74 -21.906  13.830  -6.891
  546    H    GLN  75           H        GLN  75 -20.967  10.809  -6.384
  547    HA   GLN  75           HA       GLN  75 -18.629  10.621  -8.023
  548    HB2  GLN  75           HB2      GLN  75 -17.016  10.781  -6.110
  549    HB3  GLN  75           HB3      GLN  75 -17.767  12.314  -6.532
  550    HG2  GLN  75           HG2      GLN  75 -19.233  12.189  -4.652
  551    HG3  GLN  75           HG3      GLN  75 -18.696  10.551  -4.280
  552   HE21  GLN  75          HE21      GLN  75 -18.106  11.174  -2.201
  553   HE22  GLN  75          HE22      GLN  75 -16.673  12.098  -1.898
  554    H    VAL  76           H        VAL  76 -17.144   8.815  -6.841
  555    HA   VAL  76           HA       VAL  76 -18.928   6.883  -5.515
  556    HB   VAL  76           HB       VAL  76 -17.898   5.035  -6.752
  557   HG11  VAL  76          HG11      VAL  76 -19.126   7.109  -8.562
  558   HG12  VAL  76          HG12      VAL  76 -20.005   5.951  -7.563
  559   HG13  VAL  76          HG13      VAL  76 -19.008   5.383  -8.902
  560   HG21  VAL  76          HG21      VAL  76 -15.763   6.032  -7.292
  561   HG22  VAL  76          HG22      VAL  76 -16.550   7.195  -8.359
  562   HG23  VAL  76          HG23      VAL  76 -16.561   5.477  -8.765
  563    H    GLU  77           H        GLU  77 -17.841   5.311  -4.213
  564    HA   GLU  77           HA       GLU  77 -15.123   6.129  -3.445
  565    HB2  GLU  77           HB2      GLU  77 -16.700   6.413  -1.606
  566    HB3  GLU  77           HB3      GLU  77 -17.229   4.742  -1.772
  567    HG2  GLU  77           HG2      GLU  77 -15.054   3.942  -1.111
  568    HG3  GLU  77           HG3      GLU  77 -14.429   5.588  -1.065
  569    H    LEU  78           H        LEU  78 -13.612   4.828  -4.074
  570    HA   LEU  78           HA       LEU  78 -14.211   2.003  -4.573
  571    HG   LEU  78           HG       LEU  78 -11.476   1.843  -7.079
  572    HB2  LEU  78           HB2      LEU  78 -13.065   3.379  -6.334
  573    HB3  LEU  78           HB3      LEU  78 -11.717   3.588  -5.237
  574   HD11  LEU  78          HD11      LEU  78 -11.030   0.972  -4.232
  575   HD12  LEU  78          HD12      LEU  78  -9.939   1.965  -5.198
  576   HD13  LEU  78          HD13      LEU  78 -10.245   0.290  -5.657
  577   HD21  LEU  78          HD21      LEU  78 -13.661   0.819  -6.904
  578   HD22  LEU  78          HD22      LEU  78 -13.318   0.317  -5.248
  579   HD23  LEU  78          HD23      LEU  78 -12.403  -0.375  -6.587
  580    H    ASP  79           H        ASP  79 -13.903   0.716  -2.892
  581    HA   ASP  79           HA       ASP  79 -11.695   1.359  -1.039
  582    HB2  ASP  79           HB2      ASP  79 -13.729   1.966   0.100
  583    HB3  ASP  79           HB3      ASP  79 -14.487   0.436  -0.333
  584    H    ALA  80           H        ALA  80 -10.236  -0.183  -1.101
  585    HA   ALA  80           HA       ALA  80 -11.128  -2.950  -1.590
  586    HB1  ALA  80           HB1      ALA  80  -9.144  -3.334  -2.917
  587    HB2  ALA  80           HB2      ALA  80  -8.601  -1.680  -2.632
  588    HB3  ALA  80           HB3      ALA  80 -10.058  -1.980  -3.579
  589    H    ALA  81           H        ALA  81 -10.588  -4.338  -0.068
  590    HA   ALA  81           HA       ALA  81  -8.316  -3.708   1.687
  591    HB1  ALA  81           HB1      ALA  81 -10.455  -3.948   2.851
  592    HB2  ALA  81           HB2      ALA  81  -9.329  -5.226   3.308
  593    HB3  ALA  81           HB3      ALA  81 -10.641  -5.568   2.180
  594    H    PHE  82           H        PHE  82  -6.532  -4.696   1.048
  595    HA   PHE  82           HA       PHE  82  -6.712  -7.335  -0.241
  596    HD1  PHE  82           HD1      PHE  82  -5.956  -3.658  -1.250
  597    HD2  PHE  82           HD2      PHE  82  -5.087  -7.458  -2.959
  598    HE1  PHE  82           HE1      PHE  82  -6.727  -2.847  -3.441
  599    HE2  PHE  82           HE2      PHE  82  -5.859  -6.651  -5.150
  600    HZ   PHE  82           HZ       PHE  82  -6.681  -4.339  -5.392
  601    HB2  PHE  82           HB2      PHE  82  -4.485  -5.289  -0.130
  602    HB3  PHE  82           HB3      PHE  82  -4.277  -6.901  -0.798
  603    H    THR  83           H        THR  83  -6.556  -8.981   1.146
  604    HA   THR  83           HA       THR  83  -4.788  -8.775   3.462
  605    HB   THR  83           HB       THR  83  -6.576 -11.057   2.593
  606    HG1  THR  83           HG1      THR  83  -6.937  -8.891   4.405
  607   HG21  THR  83          HG21      THR  83  -4.740 -11.818   4.018
  608   HG22  THR  83          HG22      THR  83  -6.269 -11.876   4.893
  609   HG23  THR  83          HG23      THR  83  -5.129 -10.567   5.202
  610    H    PHE  84           H        PHE  84  -2.708  -9.023   2.941
  611    HA   PHE  84           HA       PHE  84  -1.868 -10.717   0.770
  612    HD1  PHE  84           HD2      PHE  84  -1.710  -7.101   1.980
  613    HD2  PHE  84           HD1      PHE  84   0.589  -9.489  -0.687
  614    HE1  PHE  84           HE2      PHE  84  -1.866  -5.336   0.273
  615    HE2  PHE  84           HE1      PHE  84   0.436  -7.731  -2.400
  616    HZ   PHE  84           HZ       PHE  84  -0.788  -5.653  -1.919
  617    HB2  PHE  84           HB2      PHE  84  -0.388  -9.017   2.771
  618    HB3  PHE  84           HB3      PHE  84   0.452 -10.053   1.621
  619    H    SER  85           H        SER  85   0.149 -12.166   1.265
  620    HA   SER  85           HA       SER  85  -0.811 -14.039   3.329
  621    HG   SER  85           HG       SER  85  -1.545 -14.075   0.902
  622    HB2  SER  85           HB2      SER  85   0.995 -14.597   0.963
  623    HB3  SER  85           HB3      SER  85   0.273 -15.790   2.042
  624    H    CYS  86           H        CYS  86   1.784 -12.003   2.385
  625    HA   CYS  86           HA       CYS  86   3.252 -12.872   4.793
  626    HG   CYS  86           HG       CYS  86   6.177 -12.744   4.944
  627    HB2  CYS  86           HB2      CYS  86   4.561 -13.383   2.796
  628    HB3  CYS  86           HB3      CYS  86   4.374 -11.735   2.216
  629    H    GLN  87           H        GLN  87   4.174 -11.172   6.052
  630    HA   GLN  87           HA       GLN  87   2.566  -8.798   6.027
  631    HB2  GLN  87           HB2      GLN  87   3.288  -9.720   8.155
  632    HB3  GLN  87           HB3      GLN  87   4.975  -9.510   7.708
  633    HG2  GLN  87           HG2      GLN  87   4.865  -7.187   7.894
  634    HG3  GLN  87           HG3      GLN  87   3.106  -7.170   7.844
  635   HE21  GLN  87          HE21      GLN  87   1.951  -7.746   9.692
  636   HE22  GLN  87          HE22      GLN  87   2.680  -7.748  11.260
  637    H    ALA  88           H        ALA  88   5.762  -9.659   4.934
  638    HA   ALA  88           HA       ALA  88   6.863  -7.086   4.689
  639    HB1  ALA  88           HB1      ALA  88   7.463  -9.513   3.001
  640    HB2  ALA  88           HB2      ALA  88   8.181  -9.162   4.572
  641    HB3  ALA  88           HB3      ALA  88   8.490  -8.093   3.204
  642    H    GLU  89           H        GLU  89   5.139  -9.086   2.310
  643    HA   GLU  89           HA       GLU  89   5.272  -7.221   0.196
  644    HB2  GLU  89           HB2      GLU  89   3.348  -8.584  -0.744
  645    HB3  GLU  89           HB3      GLU  89   4.800  -9.489  -0.356
  646    HG2  GLU  89           HG2      GLU  89   3.770 -10.207   1.747
  647    HG3  GLU  89           HG3      GLU  89   2.300  -9.340   1.298
  648    H    MET  90           H        MET  90   3.165  -7.507   2.929
  649    HA   MET  90           HA       MET  90   1.093  -5.845   1.872
  650    HB2  MET  90           HB2      MET  90   0.577  -7.496   3.578
  651    HB3  MET  90           HB3      MET  90   1.689  -6.730   4.698
  652    HG2  MET  90           HG2      MET  90  -0.595  -5.165   3.599
  653    HG3  MET  90           HG3      MET  90  -0.873  -6.332   4.889
  654    HE1  MET  90           HE1      MET  90   1.475  -4.968   7.716
  655    HE2  MET  90           HE2      MET  90   1.928  -6.124   6.463
  656    HE3  MET  90           HE3      MET  90   0.348  -6.239   7.240
  657    H    ILE  91           H        ILE  91   3.767  -5.315   4.178
  658    HA   ILE  91           HA       ILE  91   3.032  -2.624   4.692
  659    HB   ILE  91           HB       ILE  91   5.421  -2.462   5.608
  660   HG12  ILE  91          HG12      ILE  91   5.257  -5.445   5.159
  661   HG13  ILE  91          HG13      ILE  91   6.359  -4.350   4.341
  662   HG21  ILE  91          HG21      ILE  91   3.474  -2.724   7.007
  663   HG22  ILE  91          HG22      ILE  91   4.797  -3.716   7.624
  664   HG23  ILE  91          HG23      ILE  91   3.476  -4.464   6.725
  665   HD11  ILE  91          HD11      ILE  91   6.332  -4.910   7.299
  666   HD12  ILE  91          HD12      ILE  91   7.469  -3.865   6.443
  667   HD13  ILE  91          HD13      ILE  91   7.455  -5.600   6.125
  668    H    ILE  92           H        ILE  92   5.254  -4.092   2.358
  669    HA   ILE  92           HA       ILE  92   6.322  -1.592   1.502
  670    HB   ILE  92           HB       ILE  92   7.180  -2.801  -0.453
  671   HG12  ILE  92          HG12      ILE  92   6.829  -5.450  -0.091
  672   HG13  ILE  92          HG13      ILE  92   5.258  -4.856   0.435
  673   HG21  ILE  92          HG21      ILE  92   7.588  -4.251   2.146
  674   HG22  ILE  92          HG22      ILE  92   8.454  -2.814   1.603
  675   HG23  ILE  92          HG23      ILE  92   8.654  -4.342   0.745
  676   HD11  ILE  92          HD11      ILE  92   6.543  -4.311  -2.229
  677   HD12  ILE  92          HD12      ILE  92   4.965  -3.727  -1.702
  678   HD13  ILE  92          HD13      ILE  92   5.239  -5.456  -1.917
  679    H    PHE  93           H        PHE  93   3.511  -3.477   0.685
  680    HA   PHE  93           HA       PHE  93   2.723  -2.102  -1.652
  681    HD1  PHE  93           HD1      PHE  93   1.169  -3.383  -3.280
  682    HD2  PHE  93           HD2      PHE  93  -1.175  -2.727   0.212
  683    HE1  PHE  93           HE1      PHE  93  -0.812  -3.005  -4.684
  684    HE2  PHE  93           HE2      PHE  93  -3.161  -2.346  -1.191
  685    HZ   PHE  93           HZ       PHE  93  -2.979  -2.483  -3.642
  686    HB2  PHE  93           HB2      PHE  93   1.773  -4.267  -0.892
  687    HB3  PHE  93           HB3      PHE  93   0.993  -3.437   0.447
  688    H    GLU  94           H        GLU  94   2.031  -1.612   1.768
  689    HA   GLU  94           HA       GLU  94   0.323   0.557   1.663
  690    HB2  GLU  94           HB2      GLU  94   2.505  -0.066   3.661
  691    HB3  GLU  94           HB3      GLU  94   1.280   1.167   3.904
  692    HG2  GLU  94           HG2      GLU  94   0.560  -1.694   3.399
  693    HG3  GLU  94           HG3      GLU  94   0.944  -1.098   5.014
  694    H    LEU  95           H        LEU  95   3.867   0.521   1.639
  695    HA   LEU  95           HA       LEU  95   4.136   3.349   1.573
  696    HG   LEU  95           HG       LEU  95   5.620   1.174   3.240
  697    HB2  LEU  95           HB2      LEU  95   6.070   1.153   0.853
  698    HB3  LEU  95           HB3      LEU  95   6.494   2.852   0.889
  699   HD11  LEU  95          HD11      LEU  95   7.886   1.602   4.050
  700   HD12  LEU  95          HD12      LEU  95   8.251   2.477   2.563
  701   HD13  LEU  95          HD13      LEU  95   7.903   0.749   2.507
  702   HD21  LEU  95          HD21      LEU  95   6.376   4.095   3.141
  703   HD22  LEU  95          HD22      LEU  95   6.040   3.161   4.598
  704   HD23  LEU  95          HD23      LEU  95   4.756   3.458   3.426
  705    H    SER  96           H        SER  96   4.379   0.847  -0.939
  706    HA   SER  96           HA       SER  96   4.951   2.450  -3.116
  707    HG   SER  96           HG       SER  96   5.182  -0.499  -2.204
  708    HB2  SER  96           HB2      SER  96   3.182  -0.008  -3.093
  709    HB3  SER  96           HB3      SER  96   3.994   0.668  -4.503
  710    H    LEU  97           H        LEU  97   1.796   1.760  -1.657
  711    HA   LEU  97           HA       LEU  97   0.144   2.915  -3.583
  712    HG   LEU  97           HG       LEU  97  -0.115   0.592  -1.435
  713    HB2  LEU  97           HB2      LEU  97  -0.208   2.870  -0.586
  714    HB3  LEU  97           HB3      LEU  97  -1.470   3.273  -1.731
  715   HD11  LEU  97          HD11      LEU  97  -1.681   1.126   0.354
  716   HD12  LEU  97          HD12      LEU  97  -2.316  -0.145  -0.690
  717   HD13  LEU  97          HD13      LEU  97  -2.926   1.503  -0.838
  718   HD21  LEU  97          HD21      LEU  97  -0.658   1.034  -3.771
  719   HD22  LEU  97          HD22      LEU  97  -2.305   1.478  -3.320
  720   HD23  LEU  97          HD23      LEU  97  -1.747  -0.180  -3.096
  721    H    ARG  98           H        ARG  98   1.646   4.427  -0.743
  722    HA   ARG  98           HA       ARG  98   0.375   6.956  -1.265
  723    HE   ARG  98           HE       ARG  98  -1.975   5.773   2.292
  724    HB2  ARG  98           HB2      ARG  98   2.327   5.968   0.781
  725    HB3  ARG  98           HB3      ARG  98   2.022   7.691   0.609
  726    HG2  ARG  98           HG2      ARG  98   0.660   6.818   2.367
  727    HG3  ARG  98           HG3      ARG  98  -0.377   7.267   1.016
  728    HD2  ARG  98           HD2      ARG  98  -0.530   4.938   0.339
  729    HD3  ARG  98           HD3      ARG  98   0.571   4.473   1.635
  730   HH11  ARG  98          HH11      ARG  98   0.120   2.985   2.397
  731   HH12  ARG  98          HH12      ARG  98  -0.836   2.135   3.584
  732   HH21  ARG  98          HH21      ARG  98  -3.251   4.666   3.856
  733   HH22  ARG  98          HH22      ARG  98  -2.748   3.100   4.411
  734    H    SER  99           H        SER  99   3.462   5.504  -1.919
  735    HA   SER  99           HA       SER  99   4.732   8.019  -2.544
  736    HG   SER  99           HG       SER  99   5.479   5.272  -0.908
  737    HB2  SER  99           HB2      SER  99   5.749   5.218  -3.066
  738    HB3  SER  99           HB3      SER  99   6.700   6.703  -3.002
  739    H    LEU 100           H        LEU 100   2.503   6.251  -4.147
  740    HA   LEU 100           HA       LEU 100   3.657   6.872  -6.785
  741    HG   LEU 100           HG       LEU 100   1.567   5.614  -8.525
  742    HB2  LEU 100           HB2      LEU 100   3.220   4.466  -6.274
  743    HB3  LEU 100           HB3      LEU 100   1.519   4.848  -6.146
  744   HD11  LEU 100          HD11      LEU 100   4.330   4.415  -8.469
  745   HD12  LEU 100          HD12      LEU 100   3.933   6.115  -8.714
  746   HD13  LEU 100          HD13      LEU 100   3.459   4.917  -9.919
  747   HD21  LEU 100          HD21      LEU 100   1.575   3.373  -9.472
  748   HD22  LEU 100          HD22      LEU 100   0.787   3.376  -7.892
  749   HD23  LEU 100          HD23      LEU 100   2.433   2.764  -8.058
  750    H    ALA 101           H        ALA 101   0.495   6.520  -5.171
  751    HA   ALA 101           HA       ALA 101  -0.667   8.298  -7.187
  752    HB1  ALA 101           HB1      ALA 101  -1.719   6.105  -6.794
  753    HB2  ALA 101           HB2      ALA 101  -2.813   7.447  -6.460
  754    HB3  ALA 101           HB3      ALA 101  -2.048   6.580  -5.128
  755    H    LEU 102           H        LEU 102   0.996   9.222  -4.895
  756    HA   LEU 102           HA       LEU 102  -0.542  10.331  -2.863
  757    HG   LEU 102           HG       LEU 102   2.325  10.589  -5.080
  758    HB2  LEU 102           HB2      LEU 102   1.327  12.026  -2.665
  759    HB3  LEU 102           HB3      LEU 102   1.755  10.337  -2.509
  760   HD11  LEU 102          HD11      LEU 102   2.639  13.396  -4.033
  761   HD12  LEU 102          HD12      LEU 102   1.559  12.870  -5.325
  762   HD13  LEU 102          HD13      LEU 102   3.306  12.791  -5.549
  763   HD21  LEU 102          HD21      LEU 102   4.086  11.620  -2.866
  764   HD22  LEU 102          HD22      LEU 102   4.631  11.057  -4.446
  765   HD23  LEU 102          HD23      LEU 102   3.875   9.930  -3.319
  766    H    GLU 103           H        GLU 103   0.189  11.656  -6.050
  767    HA   GLU 103           HA       GLU 103  -0.701  13.355  -7.252
  768    HB2  GLU 103           HB2      GLU 103  -2.827  12.065  -5.950
  769    HB3  GLU 103           HB3      GLU 103  -3.132  13.779  -5.737
  770    HG2  GLU 103           HG2      GLU 103  -2.493  12.646  -8.431
  771    HG3  GLU 103           HG3      GLU 103  -4.129  12.593  -7.776
  772    H    HIS 104           H        HIS 104  -1.997  15.603  -6.849
  773    HA   HIS 104           HA       HIS 104  -2.138  17.653  -5.868
  774    HD1  HIS 104           HD1      HIS 104  -2.354  14.282  -3.254
  775    HD2  HIS 104           HD2      HIS 104  -4.567  17.790  -3.643
  776    HE1  HIS 104           HE1      HIS 104  -4.732  13.650  -2.727
  777    HE2  HIS 104           HE2      HIS 104  -6.071  15.754  -3.086
  778    HB2  HIS 104           HB2      HIS 104  -0.917  16.399  -3.395
  779    HB3  HIS 104           HB3      HIS 104  -1.740  17.951  -3.484
  780    H    HIS 105           H        HIS 105   0.791  16.330  -4.376
  781    HA   HIS 105           HA       HIS 105   2.697  17.519  -6.000
  782    HD1  HIS 105           HD1      HIS 105   4.846  19.550  -3.195
  783    HD2  HIS 105           HD2      HIS 105   3.446  20.497  -7.001
  784    HE1  HIS 105           HE1      HIS 105   6.718  20.789  -4.322
  785    HE2  HIS 105           HE2      HIS 105   5.768  21.539  -6.529
  786    HB2  HIS 105           HB2      HIS 105   1.604  19.640  -5.044
  787    HB3  HIS 105           HB3      HIS 105   2.310  19.178  -3.501
  788    H    HIS 106           H        HIS 106   1.615  16.257  -3.005
  789    HA   HIS 106           HA       HIS 106   3.902  14.638  -2.615
  790    HD1  HIS 106           HD1      HIS 106   4.188  16.596   1.621
  791    HD2  HIS 106           HD2      HIS 106   2.081  18.342  -1.509
  792    HE1  HIS 106           HE1      HIS 106   2.684  18.305   2.688
  793    HE2  HIS 106           HE2      HIS 106   1.539  19.461   0.762
  794    HB2  HIS 106           HB2      HIS 106   4.748  15.556  -0.535
  795    HB3  HIS 106           HB3      HIS 106   4.810  16.810  -1.769
  796    H    HIS 107           H        HIS 107   3.681  13.514  -0.347
  797    HA   HIS 107           HA       HIS 107   0.800  13.258   0.214
  798    HD1  HIS 107           HD1      HIS 107   2.520   9.589   2.327
  799    HD2  HIS 107           HD2      HIS 107   4.727  11.437  -0.688
  800    HE1  HIS 107           HE1      HIS 107   4.876   8.755   2.588
  801    HE2  HIS 107           HE2      HIS 107   6.147   9.737   0.650
  802    HB2  HIS 107           HB2      HIS 107   1.093  10.937   0.794
  803    HB3  HIS 107           HB3      HIS 107   1.757  11.202  -0.807
  804    H    HIS 108           H        HIS 108   0.107  13.505   2.239
  805    HA   HIS 108           HA       HIS 108   1.985  14.491   4.209
  806    HD1  HIS 108           HD1      HIS 108   0.219  17.343   5.291
  807    HD2  HIS 108           HD2      HIS 108  -0.126  13.755   7.373
  808    HE1  HIS 108           HE1      HIS 108   0.367  17.951   7.730
  809    HE2  HIS 108           HE2      HIS 108   0.028  15.780   8.973
  810    HB2  HIS 108           HB2      HIS 108  -0.345  15.444   3.802
  811    HB3  HIS 108           HB3      HIS 108  -0.979  13.993   4.568
  812    H    HIS 109           H        HIS 109  -0.182  11.765   3.745
  813    HA   HIS 109           HA       HIS 109   1.581  10.195   5.464
  814    HD1  HIS 109           HD1      HIS 109  -2.329  11.931   6.671
  815    HD2  HIS 109           HD2      HIS 109  -2.485   8.575   4.215
  816    HE1  HIS 109           HE1      HIS 109  -4.645  11.907   5.691
  817    HE2  HIS 109           HE2      HIS 109  -4.765   9.788   4.326
  818    HB2  HIS 109           HB2      HIS 109  -0.409   8.864   6.261
  819    HB3  HIS 109           HB3      HIS 109  -0.300  10.491   6.907
  Start of MODEL   15
    1    HA   MET   1           HA       MET   1  47.395 -34.823   9.199
    2    H1   MET   1           H1       MET   1  49.523 -35.624   8.491
    3    H2   MET   1           H2       MET   1  49.111 -36.332   9.975
    4    H3   MET   1           H3       MET   1  50.253 -35.077   9.923
    5    HB2  MET   1           HB2      MET   1  47.660 -35.149  11.598
    6    HB3  MET   1           HB3      MET   1  48.924 -33.930  11.655
    7    HG2  MET   1           HG2      MET   1  46.821 -33.072  12.514
    8    HG3  MET   1           HG3      MET   1  47.319 -32.208  11.062
    9    HE1  MET   1           HE1      MET   1  44.877 -31.196  10.900
   10    HE2  MET   1           HE2      MET   1  44.341 -32.111  12.309
   11    HE3  MET   1           HE3      MET   1  43.409 -32.169  10.814
   12    H    ALA   2           H        ALA   2  47.340 -33.436   7.554
   13    HA   ALA   2           HA       ALA   2  48.616 -30.844   7.900
   14    HB1  ALA   2           HB1      ALA   2  49.132 -32.531   5.450
   15    HB2  ALA   2           HB2      ALA   2  50.310 -32.141   6.704
   16    HB3  ALA   2           HB3      ALA   2  49.646 -30.861   5.688
   17    H    MET   3           H        MET   3  46.878 -29.585   7.779
   18    HA   MET   3           HA       MET   3  44.867 -30.175   5.730
   19    HB2  MET   3           HB2      MET   3  43.352 -28.716   6.981
   20    HB3  MET   3           HB3      MET   3  43.979 -30.000   7.998
   21    HG2  MET   3           HG2      MET   3  45.080 -27.205   7.976
   22    HG3  MET   3           HG3      MET   3  43.821 -27.753   9.077
   23    HE1  MET   3           HE1      MET   3  46.551 -26.408  10.013
   24    HE2  MET   3           HE2      MET   3  46.981 -27.435  11.379
   25    HE3  MET   3           HE3      MET   3  45.302 -26.951  11.137
   26    H    LYS   4           H        LYS   4  44.579 -28.899   4.037
   27    HA   LYS   4           HA       LYS   4  46.131 -26.398   3.937
   28    HB2  LYS   4           HB2      LYS   4  45.150 -28.130   1.656
   29    HB3  LYS   4           HB3      LYS   4  46.050 -26.630   1.481
   30    HG2  LYS   4           HG2      LYS   4  47.932 -27.666   2.710
   31    HG3  LYS   4           HG3      LYS   4  47.030 -29.181   2.738
   32    HD2  LYS   4           HD2      LYS   4  47.005 -29.217   0.295
   33    HD3  LYS   4           HD3      LYS   4  47.893 -27.693   0.260
   34    HE2  LYS   4           HE2      LYS   4  48.868 -30.313   1.390
   35    HE3  LYS   4           HE3      LYS   4  49.402 -29.558  -0.110
   36    HZ1  LYS   4           HZ1      LYS   4  49.823 -28.552   2.652
   37    HZ2  LYS   4           HZ2      LYS   4  50.182 -27.656   1.264
   38    HZ3  LYS   4           HZ3      LYS   4  51.006 -29.108   1.573
   39    H    ASP   5           H        ASP   5  44.757 -24.903   4.657
   40    HA   ASP   5           HA       ASP   5  42.069 -24.791   3.451
   41    HB2  ASP   5           HB2      ASP   5  41.230 -23.841   5.494
   42    HB3  ASP   5           HB3      ASP   5  42.128 -25.295   5.917
   43    H    VAL   6           H        VAL   6  41.182 -22.672   3.129
   44    HA   VAL   6           HA       VAL   6  42.794 -20.342   3.465
   45    HB   VAL   6           HB       VAL   6  43.903 -21.086   1.480
   46   HG11  VAL   6          HG11      VAL   6  42.722 -21.529  -0.634
   47   HG12  VAL   6          HG12      VAL   6  41.181 -21.358   0.211
   48   HG13  VAL   6          HG13      VAL   6  42.279 -22.671   0.635
   49   HG21  VAL   6          HG21      VAL   6  43.418 -19.244  -0.071
   50   HG22  VAL   6          HG22      VAL   6  43.471 -18.703   1.607
   51   HG23  VAL   6          HG23      VAL   6  41.918 -18.921   0.800
   52    H    VAL   7           H        VAL   7  41.349 -18.954   4.169
   53    HA   VAL   7           HA       VAL   7  38.603 -19.152   3.134
   54    HB   VAL   7           HB       VAL   7  39.521 -17.832   5.692
   55   HG11  VAL   7          HG11      VAL   7  37.453 -16.891   4.798
   56   HG12  VAL   7          HG12      VAL   7  37.145 -17.813   6.269
   57   HG13  VAL   7          HG13      VAL   7  36.753 -18.508   4.697
   58   HG21  VAL   7          HG21      VAL   7  38.214 -20.520   5.277
   59   HG22  VAL   7          HG22      VAL   7  38.560 -19.771   6.836
   60   HG23  VAL   7          HG23      VAL   7  39.885 -20.243   5.772
   61    H    ASP   8           H        ASP   8  38.749 -17.866   1.323
   62    HA   ASP   8           HA       ASP   8  39.050 -14.989   1.898
   63    HB2  ASP   8           HB2      ASP   8  40.911 -15.746   0.453
   64    HB3  ASP   8           HB3      ASP   8  39.747 -16.382  -0.705
   65    H    LYS   9           H        LYS   9  36.981 -14.362   2.071
   66    HA   LYS   9           HA       LYS   9  35.333 -14.412  -0.272
   67    HB2  LYS   9           HB2      LYS   9  34.873 -16.654   0.729
   68    HB3  LYS   9           HB3      LYS   9  34.316 -15.847   2.188
   69    HG2  LYS   9           HG2      LYS   9  32.531 -14.775   0.941
   70    HG3  LYS   9           HG3      LYS   9  33.105 -15.526  -0.548
   71    HD2  LYS   9           HD2      LYS   9  32.693 -17.745   0.448
   72    HD3  LYS   9           HD3      LYS   9  32.045 -16.956   1.888
   73    HE2  LYS   9           HE2      LYS   9  30.286 -15.928   0.546
   74    HE3  LYS   9           HE3      LYS   9  30.948 -16.671  -0.910
   75    HZ1  LYS   9           HZ1      LYS   9  29.107 -17.963  -0.143
   76    HZ2  LYS   9           HZ2      LYS   9  29.757 -18.079   1.421
   77    HZ3  LYS   9           HZ3      LYS   9  30.523 -18.861   0.124
   78    H    CYS  10           H        CYS  10  33.902 -12.754  -0.266
   79    HA   CYS  10           HA       CYS  10  33.060 -11.503   2.189
   80    HG   CYS  10           HG       CYS  10  34.223  -8.779   3.370
   81    HB2  CYS  10           HB2      CYS  10  35.338 -10.543   1.792
   82    HB3  CYS  10           HB3      CYS  10  34.765  -9.917   0.251
   83    H    SER  11           H        SER  11  31.483  -9.795   1.778
   84    HA   SER  11           HA       SER  11  30.526  -9.471  -0.936
   85    HG   SER  11           HG       SER  11  28.356  -9.630  -1.372
   86    HB2  SER  11           HB2      SER  11  29.440 -11.574  -0.038
   87    HB3  SER  11           HB3      SER  11  28.673 -10.571   1.194
   88    H    THR  12           H        THR  12  29.333  -7.554  -1.169
   89    HA   THR  12           HA       THR  12  28.408  -6.139   1.144
   90    HB   THR  12           HB       THR  12  30.678  -5.533   1.439
   91    HG1  THR  12           HG1      THR  12  28.817  -3.752   1.016
   92   HG21  THR  12          HG21      THR  12  31.574  -6.101  -0.744
   93   HG22  THR  12          HG22      THR  12  32.038  -4.456  -0.308
   94   HG23  THR  12          HG23      THR  12  30.740  -4.727  -1.471
   95    H    LYS  13           H        LYS  13  26.489  -6.246   0.029
   96    HA   LYS  13           HA       LYS  13  26.071  -3.919  -1.627
   97    HB2  LYS  13           HB2      LYS  13  25.754  -6.674  -2.701
   98    HB3  LYS  13           HB3      LYS  13  24.494  -5.511  -3.094
   99    HG2  LYS  13           HG2      LYS  13  26.364  -3.978  -3.869
  100    HG3  LYS  13           HG3      LYS  13  27.414  -5.392  -3.768
  101    HD2  LYS  13           HD2      LYS  13  26.088  -6.566  -5.391
  102    HD3  LYS  13           HD3      LYS  13  24.871  -5.287  -5.382
  103    HE2  LYS  13           HE2      LYS  13  26.546  -3.718  -6.272
  104    HE3  LYS  13           HE3      LYS  13  27.730  -5.023  -6.317
  105    HZ1  LYS  13           HZ1      LYS  13  25.188  -4.921  -7.850
  106    HZ2  LYS  13           HZ2      LYS  13  26.301  -6.200  -7.882
  107    HZ3  LYS  13           HZ3      LYS  13  26.743  -4.680  -8.483
  108    H    GLY  14           H        GLY  14  24.262  -2.928  -1.061
  109    HA2  GLY  14           HA2      GLY  14  21.884  -4.177  -0.224
  110    HA3  GLY  14           HA3      GLY  14  22.835  -3.768   1.198
  111    H    CYS  15           H        CYS  15  22.227  -2.119  -1.900
  112    HA   CYS  15           HA       CYS  15  21.739   0.359  -0.470
  113    HG   CYS  15           HG       CYS  15  21.436   0.225  -5.062
  114    HB2  CYS  15           HB2      CYS  15  21.594   1.336  -2.757
  115    HB3  CYS  15           HB3      CYS  15  23.106   0.488  -2.458
  116    H    ALA  16           H        ALA  16  19.862  -1.689   0.014
  117    HA   ALA  16           HA       ALA  16  17.537  -1.530  -1.558
  118    HB1  ALA  16           HB1      ALA  16  16.405  -2.606   0.285
  119    HB2  ALA  16           HB2      ALA  16  17.723  -2.191   1.381
  120    HB3  ALA  16           HB3      ALA  16  17.997  -3.334   0.065
  121    H    ILE  17           H        ILE  17  15.797  -0.222  -1.510
  122    HA   ILE  17           HA       ILE  17  16.067   2.183   0.144
  123    HB   ILE  17           HB       ILE  17  14.465   3.198  -1.564
  124   HG12  ILE  17          HG12      ILE  17  14.793   2.107  -3.877
  125   HG13  ILE  17          HG13      ILE  17  15.225   0.652  -2.991
  126   HG21  ILE  17          HG21      ILE  17  17.250   2.393  -2.377
  127   HG22  ILE  17          HG22      ILE  17  16.789   3.808  -1.429
  128   HG23  ILE  17          HG23      ILE  17  16.306   3.685  -3.119
  129   HD11  ILE  17          HD11      ILE  17  12.597   2.108  -2.825
  130   HD12  ILE  17          HD12      ILE  17  13.027   0.649  -1.933
  131   HD13  ILE  17          HD13      ILE  17  12.908   0.605  -3.691
  132    H    ASP  18           H        ASP  18  14.137   3.233   0.879
  133    HA   ASP  18           HA       ASP  18  11.673   1.715   1.012
  134    HB2  ASP  18           HB2      ASP  18  12.729   0.710   2.902
  135    HB3  ASP  18           HB3      ASP  18  13.378   2.251   3.451
  136    H    ILE  19           H        ILE  19   9.901   3.023   1.450
  137    HA   ILE  19           HA       ILE  19  10.312   5.831   0.992
  138    HB   ILE  19           HB       ILE  19   7.751   4.373   1.678
  139   HG12  ILE  19          HG12      ILE  19   8.685   3.460  -0.364
  140   HG13  ILE  19          HG13      ILE  19   7.308   4.477  -0.765
  141   HG21  ILE  19          HG21      ILE  19   8.195   7.100   0.468
  142   HG22  ILE  19          HG22      ILE  19   7.582   6.761   2.087
  143   HG23  ILE  19          HG23      ILE  19   6.632   6.311   0.671
  144   HD11  ILE  19          HD11      ILE  19  10.202   5.263  -1.008
  145   HD12  ILE  19          HD12      ILE  19   8.815   6.274  -1.416
  146   HD13  ILE  19          HD13      ILE  19   9.130   4.801  -2.332
  147    H    GLY  20           H        GLY  20   9.736   3.751   3.716
  148    HA2  GLY  20           HA2      GLY  20  10.349   4.349   5.919
  149    HA3  GLY  20           HA3      GLY  20  10.175   6.045   5.485
  150    H    THR  21           H        THR  21   8.163   3.108   5.672
  151    HA   THR  21           HA       THR  21   6.378   4.488   7.485
  152    HB   THR  21           HB       THR  21   5.290   3.318   4.934
  153    HG1  THR  21           HG1      THR  21   6.277   5.762   5.479
  154   HG21  THR  21          HG21      THR  21   3.914   4.797   7.177
  155   HG22  THR  21          HG22      THR  21   3.774   3.073   6.839
  156   HG23  THR  21          HG23      THR  21   3.151   4.250   5.684
  157    H    VAL  22           H        VAL  22   7.188   2.962   8.886
  158    HA   VAL  22           HA       VAL  22   5.709   0.435   8.796
  159    HB   VAL  22           HB       VAL  22   8.557   0.598   9.816
  160   HG11  VAL  22          HG11      VAL  22   7.156  -1.051  10.945
  161   HG12  VAL  22          HG12      VAL  22   8.398  -1.831   9.967
  162   HG13  VAL  22          HG13      VAL  22   6.733  -1.766   9.390
  163   HG21  VAL  22          HG21      VAL  22   8.565   0.799   7.386
  164   HG22  VAL  22          HG22      VAL  22   7.556  -0.641   7.251
  165   HG23  VAL  22          HG23      VAL  22   9.196  -0.771   7.886
  166    H    ILE  23           H        ILE  23   4.229   1.046  10.292
  167    HA   ILE  23           HA       ILE  23   4.820   2.861  12.383
  168    HB   ILE  23           HB       ILE  23   2.399   1.082  12.056
  169   HG12  ILE  23          HG12      ILE  23   1.381   3.369  11.369
  170   HG13  ILE  23          HG13      ILE  23   3.047   3.861  11.092
  171   HG21  ILE  23          HG21      ILE  23   2.847   3.489  13.811
  172   HG22  ILE  23          HG22      ILE  23   2.617   1.821  14.341
  173   HG23  ILE  23          HG23      ILE  23   1.296   2.690  13.559
  174   HD11  ILE  23          HD11      ILE  23   3.300   2.073   9.455
  175   HD12  ILE  23          HD12      ILE  23   1.967   3.149   9.035
  176   HD13  ILE  23          HD13      ILE  23   1.637   1.568   9.746
  177    H    ASP  24           H        ASP  24   3.562  -0.445  12.708
  178    HA   ASP  24           HA       ASP  24   5.627  -1.254  14.527
  179    HB2  ASP  24           HB2      ASP  24   4.159   0.189  15.989
  180    HB3  ASP  24           HB3      ASP  24   2.841  -0.934  15.679
  181    H    ASN  25           H        ASN  25   2.308  -2.246  14.872
  182    HA   ASN  25           HA       ASN  25   2.706  -4.362  12.889
  183    HB2  ASN  25           HB2      ASN  25   1.584  -5.991  14.233
  184    HB3  ASN  25           HB3      ASN  25   2.826  -5.273  15.242
  185   HD21  ASN  25          HD21      ASN  25  -0.543  -5.733  14.736
  186   HD22  ASN  25          HD22      ASN  25  -1.079  -5.039  16.226
  187    H    ASP  26           H        ASP  26   1.252  -4.217  11.319
  188    HA   ASP  26           HA       ASP  26  -1.170  -2.637  11.843
  189    HB2  ASP  26           HB2      ASP  26   0.762  -2.257   9.540
  190    HB3  ASP  26           HB3      ASP  26  -0.782  -1.425   9.711
  191    H    ASN  27           H        ASN  27  -0.801  -5.487  11.561
  192    HA   ASN  27           HA       ASN  27  -1.949  -7.232  10.700
  193    HB2  ASN  27           HB2      ASN  27  -3.424  -5.142   9.075
  194    HB3  ASN  27           HB3      ASN  27  -3.882  -6.838   9.202
  195   HD21  ASN  27          HD21      ASN  27  -3.800  -3.765  10.785
  196   HD22  ASN  27          HD22      ASN  27  -4.788  -4.201  12.137
  197    H    CYS  28           H        CYS  28  -2.451  -8.340   8.537
  198    HA   CYS  28           HA       CYS  28  -0.277  -7.723   6.649
  199    HG   CYS  28           HG       CYS  28  -2.868 -10.350   8.356
  200    HB2  CYS  28           HB2      CYS  28  -0.527 -10.065   5.874
  201    HB3  CYS  28           HB3      CYS  28  -0.126  -9.967   7.584
  202    H    THR  29           H        THR  29  -3.526  -7.362   7.090
  203    HA   THR  29           HA       THR  29  -4.271  -7.646   4.291
  204    HB   THR  29           HB       THR  29  -5.996  -6.639   6.560
  205    HG1  THR  29           HG1      THR  29  -5.977  -9.309   5.604
  206   HG21  THR  29          HG21      THR  29  -6.681  -7.914   3.908
  207   HG22  THR  29          HG22      THR  29  -6.856  -6.205   4.306
  208   HG23  THR  29          HG23      THR  29  -7.840  -7.410   5.138
  209    H    SER  30           H        SER  30  -3.936  -6.001   2.938
  210    HA   SER  30           HA       SER  30  -3.665  -3.297   4.045
  211    HG   SER  30           HG       SER  30  -1.605  -2.158   2.202
  212    HB2  SER  30           HB2      SER  30  -1.841  -4.199   2.582
  213    HB3  SER  30           HB3      SER  30  -2.998  -4.273   1.253
  214    H    LYS  31           H        LYS  31  -5.381  -2.041   3.983
  215    HA   LYS  31           HA       LYS  31  -7.461  -2.607   1.989
  216    HB2  LYS  31           HB2      LYS  31  -9.017  -1.389   3.460
  217    HB3  LYS  31           HB3      LYS  31  -8.283  -2.760   4.276
  218    HG2  LYS  31           HG2      LYS  31  -7.155  -0.004   4.576
  219    HG3  LYS  31           HG3      LYS  31  -8.519  -0.551   5.551
  220    HD2  LYS  31           HD2      LYS  31  -7.214  -2.405   6.380
  221    HD3  LYS  31           HD3      LYS  31  -5.857  -1.942   5.360
  222    HE2  LYS  31           HE2      LYS  31  -7.028  -0.211   7.534
  223    HE3  LYS  31           HE3      LYS  31  -5.608  -1.237   7.731
  224    HZ1  LYS  31           HZ1      LYS  31  -4.908   0.985   7.269
  225    HZ2  LYS  31           HZ2      LYS  31  -5.887   1.076   5.883
  226    HZ3  LYS  31           HZ3      LYS  31  -4.554   0.031   5.909
  227    H    PHE  32           H        PHE  32  -8.636  -0.743   1.174
  228    HA   PHE  32           HA       PHE  32  -7.218   1.777   1.080
  229    HD1  PHE  32           HD1      PHE  32  -5.302   2.919  -0.574
  230    HD2  PHE  32           HD2      PHE  32  -8.410   1.380  -3.036
  231    HE1  PHE  32           HE1      PHE  32  -5.133   4.901  -2.022
  232    HE2  PHE  32           HE2      PHE  32  -8.249   3.356  -4.490
  233    HZ   PHE  32           HZ       PHE  32  -6.607   5.120  -3.984
  234    HB2  PHE  32           HB2      PHE  32  -5.962   0.490  -0.576
  235    HB3  PHE  32           HB3      PHE  32  -7.455   0.023  -1.380
  236    H    SER  33           H        SER  33  -8.799   3.223   1.230
  237    HA   SER  33           HA       SER  33 -11.128   2.897  -0.516
  238    HG   SER  33           HG       SER  33 -11.422   2.904   3.425
  239    HB2  SER  33           HB2      SER  33 -12.460   4.009   1.415
  240    HB3  SER  33           HB3      SER  33 -12.115   2.284   1.510
  241    H    ARG  34           H        ARG  34 -10.877   4.448  -1.932
  242    HA   ARG  34           HA       ARG  34 -10.377   7.170  -0.947
  243    HE   ARG  34           HE       ARG  34  -8.627   9.511  -5.396
  244    HB2  ARG  34           HB2      ARG  34  -8.342   6.442  -2.024
  245    HB3  ARG  34           HB3      ARG  34  -9.236   5.862  -3.422
  246    HG2  ARG  34           HG2      ARG  34  -9.884   8.168  -3.952
  247    HG3  ARG  34           HG3      ARG  34  -8.962   8.737  -2.560
  248    HD2  ARG  34           HD2      ARG  34  -6.908   8.071  -3.530
  249    HD3  ARG  34           HD3      ARG  34  -7.723   7.126  -4.775
  250   HH11  ARG  34          HH11      ARG  34  -5.393   8.688  -4.330
  251   HH12  ARG  34          HH12      ARG  34  -4.628   9.880  -5.336
  252   HH21  ARG  34          HH21      ARG  34  -7.629  11.082  -6.727
  253   HH22  ARG  34          HH22      ARG  34  -5.902  11.255  -6.683
  254    H    PHE  35           H        PHE  35 -11.575   8.779  -1.876
  255    HA   PHE  35           HA       PHE  35 -13.853   7.940  -3.459
  256    HD1  PHE  35           HD1      PHE  35 -16.352   8.937  -2.163
  257    HD2  PHE  35           HD2      PHE  35 -12.771   9.877  -0.060
  258    HE1  PHE  35           HE1      PHE  35 -17.409   8.249  -0.051
  259    HE2  PHE  35           HE2      PHE  35 -13.821   9.190   2.051
  260    HZ   PHE  35           HZ       PHE  35 -16.143   8.373   2.061
  261    HB2  PHE  35           HB2      PHE  35 -13.122  10.644  -2.314
  262    HB3  PHE  35           HB3      PHE  35 -14.613  10.291  -3.180
  263    H    PHE  36           H        PHE  36 -14.132   8.334  -5.552
  264    HA   PHE  36           HA       PHE  36 -12.005   9.823  -6.950
  265    HD1  PHE  36           HD1      PHE  36 -10.082   8.371  -8.580
  266    HD2  PHE  36           HD2      PHE  36 -12.609   5.882  -6.233
  267    HE1  PHE  36           HE1      PHE  36  -8.127   7.056  -7.874
  268    HE2  PHE  36           HE2      PHE  36 -10.657   4.563  -5.523
  269    HZ   PHE  36           HZ       PHE  36  -8.414   5.149  -6.345
  270    HB2  PHE  36           HB2      PHE  36 -13.536   7.374  -7.847
  271    HB3  PHE  36           HB3      PHE  36 -12.506   8.329  -8.908
  272    H    ALA  37           H        ALA  37 -12.698  10.787  -9.020
  273    HA   ALA  37           HA       ALA  37 -14.905  12.469  -8.656
  274    HB1  ALA  37           HB1      ALA  37 -13.477  11.825 -11.237
  275    HB2  ALA  37           HB2      ALA  37 -12.975  13.042 -10.063
  276    HB3  ALA  37           HB3      ALA  37 -14.499  13.230 -10.932
  277    H    THR  38           H        THR  38 -14.537   9.539 -10.640
  278    HA   THR  38           HA       THR  38 -17.451   9.246 -10.585
  279    HB   THR  38           HB       THR  38 -16.143   8.565 -13.173
  280    HG1  THR  38           HG1      THR  38 -16.077  10.639 -13.885
  281   HG21  THR  38          HG21      THR  38 -18.818   9.763 -12.436
  282   HG22  THR  38          HG22      THR  38 -18.499   8.063 -12.786
  283   HG23  THR  38          HG23      THR  38 -18.322   9.273 -14.056
  284    H    ARG  39           H        ARG  39 -18.062   6.975 -11.348
  285    HA   ARG  39           HA       ARG  39 -16.611   5.089  -9.856
  286    HE   ARG  39           HE       ARG  39 -18.728   0.529 -12.077
  287    HB2  ARG  39           HB2      ARG  39 -18.953   4.755 -10.243
  288    HB3  ARG  39           HB3      ARG  39 -18.725   4.745 -11.981
  289    HG2  ARG  39           HG2      ARG  39 -17.510   2.656 -11.839
  290    HG3  ARG  39           HG3      ARG  39 -17.660   2.668 -10.082
  291    HD2  ARG  39           HD2      ARG  39 -20.033   2.417 -10.219
  292    HD3  ARG  39           HD3      ARG  39 -20.011   2.658 -11.966
  293   HH11  ARG  39          HH11      ARG  39 -20.789   1.206  -9.311
  294   HH12  ARG  39          HH12      ARG  39 -21.084  -0.476  -8.964
  295   HH21  ARG  39          HH21      ARG  39 -19.136  -1.675 -11.634
  296   HH22  ARG  39          HH22      ARG  39 -20.150  -2.116 -10.294
  297    H    GLU  40           H        GLU  40 -16.461   6.021 -13.212
  298    HA   GLU  40           HA       GLU  40 -14.914   4.027 -14.337
  299    HB2  GLU  40           HB2      GLU  40 -14.648   7.017 -14.679
  300    HB3  GLU  40           HB3      GLU  40 -13.963   5.816 -15.757
  301    HG2  GLU  40           HG2      GLU  40 -16.162   5.067 -16.387
  302    HG3  GLU  40           HG3      GLU  40 -16.899   6.160 -15.215
  303    H    GLU  41           H        GLU  41 -13.853   6.894 -12.582
  304    HA   GLU  41           HA       GLU  41 -11.104   6.493 -12.653
  305    HB2  GLU  41           HB2      GLU  41 -12.690   7.762 -10.412
  306    HB3  GLU  41           HB3      GLU  41 -11.009   8.060 -10.797
  307    HG2  GLU  41           HG2      GLU  41 -13.392   8.809 -12.463
  308    HG3  GLU  41           HG3      GLU  41 -12.348   9.895 -11.549
  309    H    ALA  42           H        ALA  42 -13.569   5.112 -10.618
  310    HA   ALA  42           HA       ALA  42 -11.763   4.121  -8.613
  311    HB1  ALA  42           HB1      ALA  42 -14.640   3.388  -9.131
  312    HB2  ALA  42           HB2      ALA  42 -14.083   4.682  -8.073
  313    HB3  ALA  42           HB3      ALA  42 -13.712   3.004  -7.680
  314    H    GLU  43           H        GLU  43 -13.714   2.596 -11.172
  315    HA   GLU  43           HA       GLU  43 -12.770  -0.019 -10.732
  316    HB2  GLU  43           HB2      GLU  43 -13.898   1.232 -13.244
  317    HB3  GLU  43           HB3      GLU  43 -13.670  -0.494 -12.995
  318    HG2  GLU  43           HG2      GLU  43 -15.215  -0.373 -11.064
  319    HG3  GLU  43           HG3      GLU  43 -15.505   1.321 -11.454
  320    H    SER  44           H        SER  44 -11.594   2.599 -12.761
  321    HA   SER  44           HA       SER  44  -9.656   1.090 -14.163
  322    HG   SER  44           HG       SER  44  -7.864   3.895 -14.848
  323    HB2  SER  44           HB2      SER  44 -10.518   3.413 -14.753
  324    HB3  SER  44           HB3      SER  44  -9.457   4.031 -13.489
  325    H    PHE  45           H        PHE  45  -9.697   2.606 -11.006
  326    HA   PHE  45           HA       PHE  45  -6.851   2.508 -10.651
  327    HD1  PHE  45           HD2      PHE  45  -6.502   5.145  -9.992
  328    HD2  PHE  45           HD1      PHE  45  -7.088   2.560  -6.665
  329    HE1  PHE  45           HE2      PHE  45  -4.528   6.122  -8.893
  330    HE2  PHE  45           HE1      PHE  45  -5.117   3.530  -5.559
  331    HZ   PHE  45           HZ       PHE  45  -3.833   5.315  -6.672
  332    HB2  PHE  45           HB2      PHE  45  -8.713   4.011  -9.493
  333    HB3  PHE  45           HB3      PHE  45  -8.723   2.689  -8.330
  334    H    MET  46           H        MET  46  -9.580   0.439  -9.980
  335    HA   MET  46           HA       MET  46  -8.342  -1.354  -8.197
  336    HB2  MET  46           HB2      MET  46 -10.741  -1.378  -8.493
  337    HB3  MET  46           HB3      MET  46 -10.569  -1.785 -10.194
  338    HG2  MET  46           HG2      MET  46 -11.255  -3.680  -8.757
  339    HG3  MET  46           HG3      MET  46  -9.772  -3.972  -9.662
  340    HE1  MET  46           HE1      MET  46  -9.724  -2.792  -5.199
  341    HE2  MET  46           HE2      MET  46 -11.212  -2.889  -6.138
  342    HE3  MET  46           HE3      MET  46 -10.009  -1.659  -6.521
  343    H    THR  47           H        THR  47  -8.380  -1.159 -11.697
  344    HA   THR  47           HA       THR  47  -7.256  -3.646 -12.302
  345    HB   THR  47           HB       THR  47  -6.841  -1.060 -13.809
  346    HG1  THR  47           HG1      THR  47  -8.908  -1.188 -14.256
  347   HG21  THR  47          HG21      THR  47  -5.423  -2.894 -14.591
  348   HG22  THR  47          HG22      THR  47  -6.680  -2.535 -15.776
  349   HG23  THR  47          HG23      THR  47  -6.832  -3.944 -14.726
  350    H    LYS  48           H        LYS  48  -5.666  -0.497 -11.785
  351    HA   LYS  48           HA       LYS  48  -3.055  -1.561 -12.116
  352    HB2  LYS  48           HB2      LYS  48  -2.273   0.617 -11.264
  353    HB3  LYS  48           HB3      LYS  48  -3.416   0.748 -12.590
  354    HG2  LYS  48           HG2      LYS  48  -5.196   1.155 -10.880
  355    HG3  LYS  48           HG3      LYS  48  -3.907   1.270  -9.683
  356    HD2  LYS  48           HD2      LYS  48  -4.322   3.004 -12.109
  357    HD3  LYS  48           HD3      LYS  48  -4.436   3.474 -10.418
  358    HE2  LYS  48           HE2      LYS  48  -2.091   3.215 -10.098
  359    HE3  LYS  48           HE3      LYS  48  -1.907   2.447 -11.675
  360    HZ1  LYS  48           HZ1      LYS  48  -1.177   4.665 -11.895
  361    HZ2  LYS  48           HZ2      LYS  48  -2.537   5.291 -11.107
  362    HZ3  LYS  48           HZ3      LYS  48  -2.695   4.603 -12.648
  363    H    LEU  49           H        LEU  49  -5.187  -1.193  -9.401
  364    HA   LEU  49           HA       LEU  49  -3.347  -1.670  -7.325
  365    HG   LEU  49           HG       LEU  49  -6.494  -0.451  -5.887
  366    HB2  LEU  49           HB2      LEU  49  -6.280  -1.901  -7.676
  367    HB3  LEU  49           HB3      LEU  49  -5.584  -2.839  -6.372
  368   HD11  LEU  49          HD11      LEU  49  -3.768  -1.311  -4.935
  369   HD12  LEU  49          HD12      LEU  49  -5.313  -1.841  -4.270
  370   HD13  LEU  49          HD13      LEU  49  -4.825  -0.151  -4.133
  371   HD21  LEU  49          HD21      LEU  49  -3.755   0.185  -6.984
  372   HD22  LEU  49          HD22      LEU  49  -4.786   1.300  -6.089
  373   HD23  LEU  49          HD23      LEU  49  -5.297   0.703  -7.667
  374    H    LYS  50           H        LYS  50  -5.136  -3.885  -9.460
  375    HA   LYS  50           HA       LYS  50  -4.277  -6.286  -8.282
  376    HB2  LYS  50           HB2      LYS  50  -4.967  -5.638 -11.151
  377    HB3  LYS  50           HB3      LYS  50  -4.814  -7.262 -10.495
  378    HG2  LYS  50           HG2      LYS  50  -6.747  -7.094  -9.254
  379    HG3  LYS  50           HG3      LYS  50  -6.706  -5.327  -9.244
  380    HD2  LYS  50           HD2      LYS  50  -7.515  -5.159 -11.389
  381    HD3  LYS  50           HD3      LYS  50  -6.979  -6.774 -11.819
  382    HE2  LYS  50           HE2      LYS  50  -8.721  -7.667 -10.250
  383    HE3  LYS  50           HE3      LYS  50  -9.309  -6.015 -10.072
  384    HZ1  LYS  50           HZ1      LYS  50  -9.265  -7.656 -12.544
  385    HZ2  LYS  50           HZ2      LYS  50  -9.609  -5.995 -12.535
  386    HZ3  LYS  50           HZ3      LYS  50 -10.627  -7.075 -11.711
  387    H    GLU  51           H        GLU  51  -2.850  -4.253 -10.814
  388    HA   GLU  51           HA       GLU  51  -0.623  -5.810 -11.462
  389    HB2  GLU  51           HB2      GLU  51  -0.760  -2.792 -11.255
  390    HB3  GLU  51           HB3      GLU  51   0.456  -3.701 -12.135
  391    HG2  GLU  51           HG2      GLU  51  -1.305  -4.543 -13.639
  392    HG3  GLU  51           HG3      GLU  51  -2.478  -3.546 -12.778
  393    H    LEU  52           H        LEU  52  -0.990  -3.263  -9.034
  394    HA   LEU  52           HA       LEU  52   1.600  -3.411  -7.964
  395    HG   LEU  52           HG       LEU  52  -0.213  -1.137  -8.713
  396    HB2  LEU  52           HB2      LEU  52  -0.992  -2.454  -6.761
  397    HB3  LEU  52           HB3      LEU  52   0.572  -2.221  -6.011
  398   HD11  LEU  52          HD11      LEU  52  -1.472  -0.056  -6.938
  399   HD12  LEU  52          HD12      LEU  52  -0.260   1.040  -7.601
  400   HD13  LEU  52          HD13      LEU  52   0.019   0.251  -6.048
  401   HD21  LEU  52          HD21      LEU  52   2.182  -1.574  -8.485
  402   HD22  LEU  52          HD22      LEU  52   2.216  -0.622  -7.000
  403   HD23  LEU  52          HD23      LEU  52   1.843   0.157  -8.538
  404    H    ALA  53           H        ALA  53  -1.428  -4.961  -6.950
  405    HA   ALA  53           HA       ALA  53  -0.474  -6.149  -4.601
  406    HB1  ALA  53           HB1      ALA  53  -2.853  -5.990  -5.198
  407    HB2  ALA  53           HB2      ALA  53  -2.385  -7.629  -4.743
  408    HB3  ALA  53           HB3      ALA  53  -2.609  -7.215  -6.443
  409    H    ALA  54           H        ALA  54  -0.382  -7.271  -7.945
  410    HA   ALA  54           HA       ALA  54   0.487  -9.903  -7.394
  411    HB1  ALA  54           HB1      ALA  54   0.998 -10.046  -9.757
  412    HB2  ALA  54           HB2      ALA  54   0.904  -8.291  -9.907
  413    HB3  ALA  54           HB3      ALA  54  -0.544  -9.221  -9.524
  414    H    ALA  55           H        ALA  55   2.203  -6.872  -7.876
  415    HA   ALA  55           HA       ALA  55   4.771  -8.193  -8.076
  416    HB1  ALA  55           HB1      ALA  55   5.691  -5.976  -8.367
  417    HB2  ALA  55           HB2      ALA  55   4.154  -5.247  -7.905
  418    HB3  ALA  55           HB3      ALA  55   4.274  -6.177  -9.399
  419    H    ALA  56           H        ALA  56   2.856  -6.647  -5.617
  420    HA   ALA  56           HA       ALA  56   5.086  -6.215  -3.838
  421    HB1  ALA  56           HB1      ALA  56   2.134  -5.993  -3.279
  422    HB2  ALA  56           HB2      ALA  56   3.157  -4.691  -3.885
  423    HB3  ALA  56           HB3      ALA  56   3.444  -5.365  -2.280
  424    H    SER  57           H        SER  57   2.801  -8.752  -4.419
  425    HA   SER  57           HA       SER  57   3.142  -9.865  -1.761
  426    HG   SER  57           HG       SER  57   1.057  -9.913  -4.786
  427    HB2  SER  57           HB2      SER  57   1.502 -11.583  -2.566
  428    HB3  SER  57           HB3      SER  57   0.900  -9.925  -2.619
  429    H    SER  58           H        SER  58   4.405 -11.479  -1.241
  430    HA   SER  58           HA       SER  58   6.136 -12.696  -3.200
  431    HG   SER  58           HG       SER  58   6.284 -11.135  -0.501
  432    HB2  SER  58           HB2      SER  58   5.851 -13.349  -0.261
  433    HB3  SER  58           HB3      SER  58   7.228 -13.702  -1.304
  434    H    ALA  59           H        ALA  59   3.054 -13.224  -2.601
  435    HA   ALA  59           HA       ALA  59   3.042 -16.094  -2.274
  436    HB1  ALA  59           HB1      ALA  59   0.612 -15.895  -2.401
  437    HB2  ALA  59           HB2      ALA  59   0.769 -14.193  -2.841
  438    HB3  ALA  59           HB3      ALA  59   1.283 -14.744  -1.246
  439    H    ASP  60           H        ASP  60   3.761 -14.157  -4.767
  440    HA   ASP  60           HA       ASP  60   4.247 -14.607  -6.933
  441    HB2  ASP  60           HB2      ASP  60   4.723 -16.912  -6.243
  442    HB3  ASP  60           HB3      ASP  60   3.021 -17.324  -6.424
  443    H    GLU  61           H        GLU  61   1.114 -16.229  -6.348
  444    HA   GLU  61           HA       GLU  61   0.060 -15.361  -8.852
  445    HB2  GLU  61           HB2      GLU  61  -1.430 -16.437  -6.454
  446    HB3  GLU  61           HB3      GLU  61  -2.043 -16.337  -8.099
  447    HG2  GLU  61           HG2      GLU  61  -0.172 -17.863  -8.776
  448    HG3  GLU  61           HG3      GLU  61   0.162 -18.090  -7.060
  449    H    GLY  62           H        GLY  62  -0.072 -14.147  -5.575
  450    HA2  GLY  62           HA2      GLY  62  -0.388 -11.572  -5.839
  451    HA3  GLY  62           HA3      GLY  62  -1.986 -12.079  -6.372
  452    H    ALA  63           H        ALA  63  -3.360 -11.591  -4.785
  453    HA   ALA  63           HA       ALA  63  -2.943 -12.745  -2.159
  454    HB1  ALA  63           HB1      ALA  63  -3.282 -10.642  -0.968
  455    HB2  ALA  63           HB2      ALA  63  -3.335  -9.770  -2.500
  456    HB3  ALA  63           HB3      ALA  63  -1.841 -10.553  -1.983
  457    H    SER  64           H        SER  64  -4.938 -12.347  -0.773
  458    HA   SER  64           HA       SER  64  -7.277 -12.943  -2.293
  459    HG   SER  64           HG       SER  64  -7.137 -14.831  -0.316
  460    HB2  SER  64           HB2      SER  64  -7.091 -12.174   0.629
  461    HB3  SER  64           HB3      SER  64  -8.397 -13.063  -0.153
  462    H    VAL  65           H        VAL  65  -8.306 -11.433  -3.442
  463    HA   VAL  65           HA       VAL  65  -8.298  -8.683  -2.429
  464    HB   VAL  65           HB       VAL  65  -7.301  -8.786  -4.599
  465   HG11  VAL  65          HG11      VAL  65  -8.173 -10.894  -5.401
  466   HG12  VAL  65          HG12      VAL  65  -8.515  -9.625  -6.577
  467   HG13  VAL  65          HG13      VAL  65  -9.796 -10.210  -5.515
  468   HG21  VAL  65          HG21      VAL  65  -8.743  -6.860  -4.167
  469   HG22  VAL  65          HG22      VAL  65 -10.113  -7.726  -4.862
  470   HG23  VAL  65          HG23      VAL  65  -8.740  -7.289  -5.878
  471    H    ALA  66           H        ALA  66 -10.039  -8.047  -1.463
  472    HA   ALA  66           HA       ALA  66 -12.651  -8.713  -2.657
  473    HB1  ALA  66           HB1      ALA  66 -13.658  -8.504  -0.427
  474    HB2  ALA  66           HB2      ALA  66 -12.058  -8.245   0.271
  475    HB3  ALA  66           HB3      ALA  66 -12.457  -9.796  -0.467
  476    H    TYR  67           H        TYR  67 -13.857  -6.923  -3.224
  477    HA   TYR  67           HA       TYR  67 -13.031  -4.336  -2.189
  478    HD1  TYR  67           HD2      TYR  67 -11.890  -6.910  -5.198
  479    HD2  TYR  67           HD1      TYR  67 -14.135  -3.449  -6.246
  480    HE1  TYR  67           HE2      TYR  67 -12.538  -7.977  -7.317
  481    HE2  TYR  67           HE1      TYR  67 -14.787  -4.508  -8.366
  482    HH   TYR  67           HH       TYR  67 -14.385  -7.801  -8.982
  483    HB2  TYR  67           HB2      TYR  67 -12.643  -3.379  -4.402
  484    HB3  TYR  67           HB3      TYR  67 -11.524  -4.696  -4.081
  485    H    LYS  68           H        LYS  68 -14.439  -2.652  -2.603
  486    HA   LYS  68           HA       LYS  68 -17.063  -3.361  -3.737
  487    HB2  LYS  68           HB2      LYS  68 -16.400  -1.661  -1.331
  488    HB3  LYS  68           HB3      LYS  68 -17.968  -1.623  -2.125
  489    HG2  LYS  68           HG2      LYS  68 -18.406  -3.872  -1.555
  490    HG3  LYS  68           HG3      LYS  68 -16.744  -4.125  -1.032
  491    HD2  LYS  68           HD2      LYS  68 -18.661  -2.193   0.267
  492    HD3  LYS  68           HD3      LYS  68 -18.369  -3.835   0.842
  493    HE2  LYS  68           HE2      LYS  68 -16.035  -3.317   1.236
  494    HE3  LYS  68           HE3      LYS  68 -16.255  -1.706   0.555
  495    HZ1  LYS  68           HZ1      LYS  68 -17.769  -2.647   2.919
  496    HZ2  LYS  68           HZ2      LYS  68 -17.576  -1.054   2.363
  497    HZ3  LYS  68           HZ3      LYS  68 -16.262  -1.878   3.050
  498    H    ILE  69           H        ILE  69 -17.957  -1.918  -5.064
  499    HA   ILE  69           HA       ILE  69 -16.533   0.615  -5.571
  500    HB   ILE  69           HB       ILE  69 -18.189  -0.919  -7.589
  501   HG12  ILE  69          HG12      ILE  69 -15.173  -0.727  -7.420
  502   HG13  ILE  69          HG13      ILE  69 -16.105  -2.142  -6.946
  503   HG21  ILE  69          HG21      ILE  69 -18.095   1.478  -7.971
  504   HG22  ILE  69          HG22      ILE  69 -17.153   0.626  -9.195
  505   HG23  ILE  69          HG23      ILE  69 -16.335   1.443  -7.863
  506   HD11  ILE  69          HD11      ILE  69 -15.137  -2.420  -9.153
  507   HD12  ILE  69          HD12      ILE  69 -15.966  -0.966  -9.713
  508   HD13  ILE  69          HD13      ILE  69 -16.897  -2.386  -9.238
  509    H    LYS  70           H        LYS  70 -17.733   2.168  -4.586
  510    HA   LYS  70           HA       LYS  70 -20.637   1.690  -4.511
  511    HB2  LYS  70           HB2      LYS  70 -19.484   1.358  -2.378
  512    HB3  LYS  70           HB3      LYS  70 -18.905   3.009  -2.442
  513    HG2  LYS  70           HG2      LYS  70 -21.043   3.887  -2.066
  514    HG3  LYS  70           HG3      LYS  70 -21.826   2.343  -2.432
  515    HD2  LYS  70           HD2      LYS  70 -21.110   1.373  -0.422
  516    HD3  LYS  70           HD3      LYS  70 -19.873   2.605  -0.166
  517    HE2  LYS  70           HE2      LYS  70 -22.847   3.076  -0.054
  518    HE3  LYS  70           HE3      LYS  70 -21.800   2.852   1.348
  519    HZ1  LYS  70           HZ1      LYS  70 -22.129   5.174   0.997
  520    HZ2  LYS  70           HZ2      LYS  70 -21.679   5.057  -0.629
  521    HZ3  LYS  70           HZ3      LYS  70 -20.521   4.810   0.585
  522    H    ASP  71           H        ASP  71 -21.635   2.959  -5.734
  523    HA   ASP  71           HA       ASP  71 -20.557   5.392  -6.784
  524    HB2  ASP  71           HB2      ASP  71 -23.251   4.055  -7.102
  525    HB3  ASP  71           HB3      ASP  71 -22.771   5.506  -7.964
  526    H    LEU  72           H        LEU  72 -20.881   7.398  -6.082
  527    HA   LEU  72           HA       LEU  72 -23.214   7.957  -4.371
  528    HG   LEU  72           HG       LEU  72 -20.409   7.095  -3.211
  529    HB2  LEU  72           HB2      LEU  72 -20.516   9.323  -4.290
  530    HB3  LEU  72           HB3      LEU  72 -21.898   9.717  -3.287
  531   HD11  LEU  72          HD11      LEU  72 -19.031   8.935  -2.392
  532   HD12  LEU  72          HD12      LEU  72 -19.537   7.883  -1.069
  533   HD13  LEU  72          HD13      LEU  72 -20.335   9.435  -1.313
  534   HD21  LEU  72          HD21      LEU  72 -22.563   8.212  -1.421
  535   HD22  LEU  72          HD22      LEU  72 -21.691   6.701  -1.165
  536   HD23  LEU  72          HD23      LEU  72 -22.748   6.881  -2.565
  537    H    GLU  73           H        GLU  73 -23.154  10.704  -4.422
  538    HA   GLU  73           HA       GLU  73 -23.783  11.181  -7.244
  539    HB2  GLU  73           HB2      GLU  73 -25.496  11.691  -5.490
  540    HB3  GLU  73           HB3      GLU  73 -24.420  12.936  -4.868
  541    HG2  GLU  73           HG2      GLU  73 -24.476  13.938  -7.196
  542    HG3  GLU  73           HG3      GLU  73 -25.817  12.842  -7.520
  543    H    GLY  74           H        GLY  74 -21.958  11.721  -8.280
  544    HA2  GLY  74           HA2      GLY  74 -20.585  13.470  -9.079
  545    HA3  GLY  74           HA3      GLY  74 -20.749  14.285  -7.531
  546    H    GLN  75           H        GLN  75 -20.178  11.174  -6.824
  547    HA   GLN  75           HA       GLN  75 -17.367  10.979  -7.291
  548    HB2  GLN  75           HB2      GLN  75 -16.679  11.002  -4.930
  549    HB3  GLN  75           HB3      GLN  75 -17.306  12.565  -5.426
  550    HG2  GLN  75           HG2      GLN  75 -19.431  12.065  -4.330
  551    HG3  GLN  75           HG3      GLN  75 -18.817  10.481  -3.864
  552   HE21  GLN  75          HE21      GLN  75 -19.785  12.648  -2.183
  553   HE22  GLN  75          HE22      GLN  75 -18.485  13.041  -1.116
  554    H    VAL  76           H        VAL  76 -16.510   9.017  -6.112
  555    HA   VAL  76           HA       VAL  76 -18.570   7.117  -5.258
  556    HB   VAL  76           HB       VAL  76 -17.612   5.301  -6.621
  557   HG11  VAL  76          HG11      VAL  76 -18.580   5.935  -8.777
  558   HG12  VAL  76          HG12      VAL  76 -18.623   7.620  -8.255
  559   HG13  VAL  76          HG13      VAL  76 -19.608   6.413  -7.427
  560   HG21  VAL  76          HG21      VAL  76 -16.073   7.485  -8.004
  561   HG22  VAL  76          HG22      VAL  76 -16.149   5.794  -8.501
  562   HG23  VAL  76          HG23      VAL  76 -15.396   6.230  -6.966
  563    H    GLU  77           H        GLU  77 -17.707   5.410  -3.946
  564    HA   GLU  77           HA       GLU  77 -14.944   5.940  -3.119
  565    HB2  GLU  77           HB2      GLU  77 -15.410   4.983  -0.973
  566    HB3  GLU  77           HB3      GLU  77 -16.656   6.170  -1.324
  567    HG2  GLU  77           HG2      GLU  77 -18.164   4.368  -1.983
  568    HG3  GLU  77           HG3      GLU  77 -16.923   3.187  -1.593
  569    H    LEU  78           H        LEU  78 -13.455   4.552  -3.538
  570    HA   LEU  78           HA       LEU  78 -14.215   1.848  -4.384
  571    HG   LEU  78           HG       LEU  78 -11.309   1.679  -6.681
  572    HB2  LEU  78           HB2      LEU  78 -12.781   3.322  -5.878
  573    HB3  LEU  78           HB3      LEU  78 -11.522   3.190  -4.670
  574   HD11  LEU  78          HD11      LEU  78 -10.057   1.264  -4.633
  575   HD12  LEU  78          HD12      LEU  78 -10.547  -0.246  -5.400
  576   HD13  LEU  78          HD13      LEU  78 -11.415   0.345  -3.983
  577   HD21  LEU  78          HD21      LEU  78 -12.630  -0.379  -6.685
  578   HD22  LEU  78          HD22      LEU  78 -13.643   1.048  -6.907
  579   HD23  LEU  78          HD23      LEU  78 -13.589   0.240  -5.340
  580    H    ASP  79           H        ASP  79 -14.147   0.406  -2.823
  581    HA   ASP  79           HA       ASP  79 -12.270   0.845  -0.585
  582    HB2  ASP  79           HB2      ASP  79 -14.650   1.246   0.032
  583    HB3  ASP  79           HB3      ASP  79 -15.025  -0.406  -0.442
  584    H    ALA  80           H        ALA  80 -10.696  -0.611  -0.770
  585    HA   ALA  80           HA       ALA  80 -11.463  -3.362  -1.490
  586    HB1  ALA  80           HB1      ALA  80 -10.284  -2.281  -3.335
  587    HB2  ALA  80           HB2      ALA  80  -9.341  -3.606  -2.653
  588    HB3  ALA  80           HB3      ALA  80  -8.925  -1.937  -2.265
  589    H    ALA  81           H        ALA  81 -10.226  -5.038  -0.595
  590    HA   ALA  81           HA       ALA  81  -8.322  -4.344   1.522
  591    HB1  ALA  81           HB1      ALA  81 -10.440  -4.704   2.664
  592    HB2  ALA  81           HB2      ALA  81  -9.324  -6.024   3.016
  593    HB3  ALA  81           HB3      ALA  81 -10.633  -6.260   1.859
  594    H    PHE  82           H        PHE  82  -6.498  -5.293   0.936
  595    HA   PHE  82           HA       PHE  82  -6.605  -7.851  -0.520
  596    HD1  PHE  82           HD1      PHE  82  -5.838  -3.998  -1.050
  597    HD2  PHE  82           HD2      PHE  82  -5.248  -7.519  -3.363
  598    HE1  PHE  82           HE1      PHE  82  -6.722  -2.839  -3.030
  599    HE2  PHE  82           HE2      PHE  82  -6.134  -6.367  -5.347
  600    HZ   PHE  82           HZ       PHE  82  -6.873  -4.024  -5.184
  601    HB2  PHE  82           HB2      PHE  82  -4.363  -5.822  -0.300
  602    HB3  PHE  82           HB3      PHE  82  -4.280  -7.327  -1.208
  603    H    THR  83           H        THR  83  -6.352  -9.558   0.767
  604    HA   THR  83           HA       THR  83  -4.846  -9.309   3.236
  605    HB   THR  83           HB       THR  83  -6.103 -11.837   2.174
  606    HG1  THR  83           HG1      THR  83  -8.037 -11.139   2.821
  607   HG21  THR  83          HG21      THR  83  -5.550 -10.822   4.968
  608   HG22  THR  83          HG22      THR  83  -4.614 -12.048   4.114
  609   HG23  THR  83          HG23      THR  83  -6.288 -12.372   4.563
  610    H    PHE  84           H        PHE  84  -2.692  -9.382   3.010
  611    HA   PHE  84           HA       PHE  84  -1.487 -11.106   0.992
  612    HD1  PHE  84           HD2      PHE  84   0.204  -9.666  -0.739
  613    HD2  PHE  84           HD1      PHE  84  -1.470  -7.135   2.244
  614    HE1  PHE  84           HE2      PHE  84  -0.233  -7.950  -2.446
  615    HE2  PHE  84           HE1      PHE  84  -1.906  -5.415   0.541
  616    HZ   PHE  84           HZ       PHE  84  -1.288  -5.820  -1.805
  617    HB2  PHE  84           HB2      PHE  84  -0.272  -9.064   2.866
  618    HB3  PHE  84           HB3      PHE  84   0.639  -9.999   1.687
  619    H    SER  85           H        SER  85   0.458 -12.383   1.653
  620    HA   SER  85           HA       SER  85  -0.246 -14.083   3.852
  621    HG   SER  85           HG       SER  85  -0.018 -15.875   1.807
  622    HB2  SER  85           HB2      SER  85   2.180 -14.158   2.043
  623    HB3  SER  85           HB3      SER  85   1.638 -15.454   3.110
  624    H    CYS  86           H        CYS  86   2.028 -11.513   3.290
  625    HA   CYS  86           HA       CYS  86   3.117 -11.924   5.993
  626    HG   CYS  86           HG       CYS  86   6.378 -13.229   4.175
  627    HB2  CYS  86           HB2      CYS  86   4.624 -10.813   3.612
  628    HB3  CYS  86           HB3      CYS  86   5.272 -11.098   5.224
  629    H    GLN  87           H        GLN  87   4.014  -9.870   6.932
  630    HA   GLN  87           HA       GLN  87   2.021  -7.810   6.629
  631    HB2  GLN  87           HB2      GLN  87   2.727  -8.381   8.854
  632    HB3  GLN  87           HB3      GLN  87   4.409  -8.067   8.453
  633    HG2  GLN  87           HG2      GLN  87   4.122  -5.771   8.467
  634    HG3  GLN  87           HG3      GLN  87   2.379  -5.883   8.242
  635   HE21  GLN  87          HE21      GLN  87   1.070  -6.368   9.988
  636   HE22  GLN  87          HE22      GLN  87   1.632  -6.262  11.624
  637    H    ALA  88           H        ALA  88   5.391  -8.260   5.807
  638    HA   ALA  88           HA       ALA  88   6.137  -5.655   5.202
  639    HB1  ALA  88           HB1      ALA  88   6.962  -8.177   3.766
  640    HB2  ALA  88           HB2      ALA  88   7.704  -7.528   5.229
  641    HB3  ALA  88           HB3      ALA  88   7.809  -6.630   3.715
  642    H    GLU  89           H        GLU  89   4.322  -7.975   3.295
  643    HA   GLU  89           HA       GLU  89   4.294  -6.605   0.845
  644    HB2  GLU  89           HB2      GLU  89   1.840  -8.077   1.609
  645    HB3  GLU  89           HB3      GLU  89   2.817  -8.201   0.155
  646    HG2  GLU  89           HG2      GLU  89   3.617  -9.341   2.819
  647    HG3  GLU  89           HG3      GLU  89   2.754 -10.246   1.578
  648    H    MET  90           H        MET  90   2.382  -6.271   3.752
  649    HA   MET  90           HA       MET  90   0.273  -4.727   2.621
  650    HB2  MET  90           HB2      MET  90   0.214  -6.089   4.771
  651    HB3  MET  90           HB3      MET  90   1.127  -4.791   5.521
  652    HG2  MET  90           HG2      MET  90  -1.539  -4.382   4.198
  653    HG3  MET  90           HG3      MET  90  -1.358  -4.775   5.905
  654    HE1  MET  90           HE1      MET  90   0.631  -1.643   7.202
  655    HE2  MET  90           HE2      MET  90   1.283  -3.177   6.624
  656    HE3  MET  90           HE3      MET  90  -0.142  -3.160   7.663
  657    H    ILE  91           H        ILE  91   3.141  -3.893   4.576
  658    HA   ILE  91           HA       ILE  91   2.620  -1.112   4.571
  659    HB   ILE  91           HB       ILE  91   5.183  -1.028   5.129
  660   HG12  ILE  91          HG12      ILE  91   4.536  -3.911   5.755
  661   HG13  ILE  91          HG13      ILE  91   5.556  -3.397   4.419
  662   HG21  ILE  91          HG21      ILE  91   3.383  -0.524   6.679
  663   HG22  ILE  91          HG22      ILE  91   4.636  -1.477   7.475
  664   HG23  ILE  91          HG23      ILE  91   3.130  -2.244   6.968
  665   HD11  ILE  91          HD11      ILE  91   6.094  -2.959   7.345
  666   HD12  ILE  91          HD12      ILE  91   7.110  -2.381   6.023
  667   HD13  ILE  91          HD13      ILE  91   6.904  -4.113   6.286
  668    H    ILE  92           H        ILE  92   4.697  -3.149   2.494
  669    HA   ILE  92           HA       ILE  92   5.797  -0.963   1.070
  670    HB   ILE  92           HB       ILE  92   6.464  -2.566  -0.644
  671   HG12  ILE  92          HG12      ILE  92   4.901  -4.608   0.942
  672   HG13  ILE  92          HG13      ILE  92   4.425  -3.962  -0.625
  673   HG21  ILE  92          HG21      ILE  92   6.885  -3.599   2.152
  674   HG22  ILE  92          HG22      ILE  92   7.821  -2.332   1.358
  675   HG23  ILE  92          HG23      ILE  92   7.879  -3.984   0.746
  676   HD11  ILE  92          HD11      ILE  92   6.379  -4.944  -1.655
  677   HD12  ILE  92          HD12      ILE  92   5.455  -6.176  -0.795
  678   HD13  ILE  92          HD13      ILE  92   6.937  -5.529  -0.089
  679    H    PHE  93           H        PHE  93   2.840  -2.781   0.754
  680    HA   PHE  93           HA       PHE  93   2.032  -1.876  -1.785
  681    HD1  PHE  93           HD1      PHE  93   0.814  -3.824  -2.872
  682    HD2  PHE  93           HD2      PHE  93  -1.934  -1.812  -0.317
  683    HE1  PHE  93           HE1      PHE  93  -0.921  -3.992  -4.607
  684    HE2  PHE  93           HE2      PHE  93  -3.668  -1.978  -2.049
  685    HZ   PHE  93           HZ       PHE  93  -3.166  -3.071  -4.199
  686    HB2  PHE  93           HB2      PHE  93   1.018  -3.715  -0.280
  687    HB3  PHE  93           HB3      PHE  93   0.139  -2.406   0.500
  688    H    GLU  94           H        GLU  94   1.349  -0.653   1.475
  689    HA   GLU  94           HA       GLU  94  -0.066   1.649   0.863
  690    HB2  GLU  94           HB2      GLU  94   1.904   1.125   3.095
  691    HB3  GLU  94           HB3      GLU  94   0.867   2.542   3.023
  692    HG2  GLU  94           HG2      GLU  94  -0.204  -0.260   3.016
  693    HG3  GLU  94           HG3      GLU  94   0.095   0.656   4.494
  694    H    LEU  95           H        LEU  95   3.404   1.087   0.919
  695    HA   LEU  95           HA       LEU  95   4.210   3.760   0.518
  696    HG   LEU  95           HG       LEU  95   5.218   1.169   2.127
  697    HB2  LEU  95           HB2      LEU  95   5.636   1.221  -0.281
  698    HB3  LEU  95           HB3      LEU  95   6.366   2.809  -0.135
  699   HD11  LEU  95          HD11      LEU  95   7.538   1.051   2.891
  700   HD12  LEU  95          HD12      LEU  95   8.057   1.921   1.447
  701   HD13  LEU  95          HD13      LEU  95   7.343   0.316   1.300
  702   HD21  LEU  95          HD21      LEU  95   6.069   2.924   3.582
  703   HD22  LEU  95          HD22      LEU  95   4.863   3.564   2.464
  704   HD23  LEU  95          HD23      LEU  95   6.579   3.857   2.176
  705    H    SER  96           H        SER  96   3.894   1.046  -1.763
  706    HA   SER  96           HA       SER  96   4.596   2.468  -4.052
  707    HG   SER  96           HG       SER  96   2.343   0.220  -2.804
  708    HB2  SER  96           HB2      SER  96   3.435   0.630  -5.296
  709    HB3  SER  96           HB3      SER  96   4.595   0.074  -4.092
  710    H    LEU  97           H        LEU  97   1.421   2.085  -2.536
  711    HA   LEU  97           HA       LEU  97  -0.135   3.182  -4.593
  712    HG   LEU  97           HG       LEU  97  -0.462   1.065  -2.186
  713    HB2  LEU  97           HB2      LEU  97  -0.591   3.435  -1.620
  714    HB3  LEU  97           HB3      LEU  97  -1.794   3.689  -2.867
  715   HD11  LEU  97          HD11      LEU  97  -2.096   1.815  -0.540
  716   HD12  LEU  97          HD12      LEU  97  -2.674   0.408  -1.434
  717   HD13  LEU  97          HD13      LEU  97  -3.295   2.015  -1.816
  718   HD21  LEU  97          HD21      LEU  97  -0.927   1.215  -4.575
  719   HD22  LEU  97          HD22      LEU  97  -2.591   1.694  -4.235
  720   HD23  LEU  97          HD23      LEU  97  -2.026   0.083  -3.790
  721    H    ARG  98           H        ARG  98   1.416   4.732  -1.820
  722    HA   ARG  98           HA       ARG  98   0.539   7.363  -2.427
  723    HE   ARG  98           HE       ARG  98   0.348   7.685   3.074
  724    HB2  ARG  98           HB2      ARG  98   2.727   6.288  -0.655
  725    HB3  ARG  98           HB3      ARG  98   2.371   8.004  -0.787
  726    HG2  ARG  98           HG2      ARG  98   0.248   7.745   0.187
  727    HG3  ARG  98           HG3      ARG  98   0.288   5.990  -0.010
  728    HD2  ARG  98           HD2      ARG  98   2.000   5.779   1.642
  729    HD3  ARG  98           HD3      ARG  98   2.211   7.525   1.726
  730   HH11  ARG  98          HH11      ARG  98   0.558   4.428   1.781
  731   HH12  ARG  98          HH12      ARG  98  -0.564   3.763   2.940
  732   HH21  ARG  98          HH21      ARG  98  -1.106   6.801   4.589
  733   HH22  ARG  98          HH22      ARG  98  -1.499   5.114   4.528
  734    H    SER  99           H        SER  99   3.327   5.463  -3.316
  735    HA   SER  99           HA       SER  99   4.893   7.692  -4.208
  736    HG   SER  99           HG       SER  99   5.314   5.167  -2.513
  737    HB2  SER  99           HB2      SER  99   5.286   4.738  -4.735
  738    HB3  SER  99           HB3      SER  99   6.488   6.008  -4.962
  739    H    LEU 100           H        LEU 100   2.743   5.367  -5.731
  740    HA   LEU 100           HA       LEU 100   3.557   6.060  -8.401
  741    HG   LEU 100           HG       LEU 100   1.040   5.150  -9.889
  742    HB2  LEU 100           HB2      LEU 100   2.695   3.831  -7.734
  743    HB3  LEU 100           HB3      LEU 100   1.117   4.546  -7.492
  744   HD11  LEU 100          HD11      LEU 100   3.439   5.323 -10.306
  745   HD12  LEU 100          HD12      LEU 100   2.682   4.191 -11.426
  746   HD13  LEU 100          HD13      LEU 100   3.616   3.586 -10.058
  747   HD21  LEU 100          HD21      LEU 100   0.732   2.869 -10.736
  748   HD22  LEU 100          HD22      LEU 100   0.019   3.082  -9.137
  749   HD23  LEU 100          HD23      LEU 100   1.557   2.236  -9.311
  750    H    ALA 101           H        ALA 101   0.819   6.795  -6.300
  751    HA   ALA 101           HA       ALA 101  -0.342   8.541  -8.330
  752    HB1  ALA 101           HB1      ALA 101  -1.338   7.805  -5.578
  753    HB2  ALA 101           HB2      ALA 101  -1.835   7.055  -7.095
  754    HB3  ALA 101           HB3      ALA 101  -2.223   8.747  -6.778
  755    H    LEU 102           H        LEU 102   2.197   9.228  -7.214
  756    HA   LEU 102           HA       LEU 102   2.082  11.004  -5.061
  757    HG   LEU 102           HG       LEU 102   3.704  10.400  -8.363
  758    HB2  LEU 102           HB2      LEU 102   4.276  11.790  -5.765
  759    HB3  LEU 102           HB3      LEU 102   4.167  10.046  -5.822
  760   HD11  LEU 102          HD11      LEU 102   3.440  12.820  -8.294
  761   HD12  LEU 102          HD12      LEU 102   4.820  12.367  -9.298
  762   HD13  LEU 102          HD13      LEU 102   5.079  12.991  -7.668
  763   HD21  LEU 102          HD21      LEU 102   5.676   9.296  -7.490
  764   HD22  LEU 102          HD22      LEU 102   6.420  10.857  -7.138
  765   HD23  LEU 102          HD23      LEU 102   6.121  10.378  -8.810
  766    H    GLU 103           H        GLU 103   0.971  11.507  -8.254
  767    HA   GLU 103           HA       GLU 103   1.478  14.336  -8.347
  768    HB2  GLU 103           HB2      GLU 103  -0.107  12.493 -10.120
  769    HB3  GLU 103           HB3      GLU 103   0.025  14.222 -10.410
  770    HG2  GLU 103           HG2      GLU 103   2.506  13.931 -10.465
  771    HG3  GLU 103           HG3      GLU 103   2.236  12.188 -10.417
  772    H    HIS 104           H        HIS 104  -0.007  13.647  -6.044
  773    HA   HIS 104           HA       HIS 104  -2.511  15.079  -6.642
  774    HD1  HIS 104           HD1      HIS 104  -3.426  13.491  -2.431
  775    HD2  HIS 104           HD2      HIS 104  -0.106  12.143  -4.547
  776    HE1  HIS 104           HE1      HIS 104  -1.907  12.439  -0.721
  777    HE2  HIS 104           HE2      HIS 104   0.186  11.836  -1.994
  778    HB2  HIS 104           HB2      HIS 104  -3.623  13.968  -4.828
  779    HB3  HIS 104           HB3      HIS 104  -2.861  12.725  -5.810
  780    H    HIS 105           H        HIS 105  -2.872  16.951  -5.557
  781    HA   HIS 105           HA       HIS 105  -0.597  18.051  -4.170
  782    HD1  HIS 105           HD1      HIS 105  -2.665  18.422  -7.399
  783    HD2  HIS 105           HD2      HIS 105  -0.065  21.193  -5.693
  784    HE1  HIS 105           HE1      HIS 105  -1.331  19.372  -9.306
  785    HE2  HIS 105           HE2      HIS 105   0.091  21.178  -8.277
  786    HB2  HIS 105           HB2      HIS 105  -3.274  19.242  -4.914
  787    HB3  HIS 105           HB3      HIS 105  -2.010  20.136  -4.077
  788    H    HIS 106           H        HIS 106  -0.447  18.668  -2.063
  789    HA   HIS 106           HA       HIS 106  -2.098  17.211  -0.207
  790    HD1  HIS 106           HD1      HIS 106   0.164  15.950   2.036
  791    HD2  HIS 106           HD2      HIS 106   1.602  17.360  -1.610
  792    HE1  HIS 106           HE1      HIS 106   1.835  14.237   1.250
  793    HE2  HIS 106           HE2      HIS 106   2.589  15.039  -1.016
  794    HB2  HIS 106           HB2      HIS 106   0.197  19.133   0.219
  795    HB3  HIS 106           HB3      HIS 106  -0.619  18.280   1.526
  796    H    HIS 107           H        HIS 107  -2.335  20.210  -1.674
  797    HA   HIS 107           HA       HIS 107  -3.881  21.438   0.454
  798    HD1  HIS 107           HD1      HIS 107  -1.680  24.441  -2.368
  799    HD2  HIS 107           HD2      HIS 107  -2.160  22.623   1.347
  800    HE1  HIS 107           HE1      HIS 107   0.128  25.397  -0.898
  801    HE2  HIS 107           HE2      HIS 107  -0.095  24.179   1.298
  802    HB2  HIS 107           HB2      HIS 107  -3.225  22.310  -2.361
  803    HB3  HIS 107           HB3      HIS 107  -4.331  23.205  -1.323
  804    H    HIS 108           H        HIS 108  -4.468  18.936  -1.375
  805    HA   HIS 108           HA       HIS 108  -7.336  19.526  -1.580
  806    HD1  HIS 108           HD1      HIS 108  -7.356  16.044  -4.185
  807    HD2  HIS 108           HD2      HIS 108  -9.188  19.770  -3.934
  808    HE1  HIS 108           HE1      HIS 108  -9.711  15.700  -5.001
  809    HE2  HIS 108           HE2      HIS 108 -10.827  17.953  -4.780
  810    HB2  HIS 108           HB2      HIS 108  -6.287  19.518  -3.846
  811    HB3  HIS 108           HB3      HIS 108  -5.750  17.868  -3.560
  812    H    HIS 109           H        HIS 109  -8.687  17.752  -1.090
  813    HA   HIS 109           HA       HIS 109  -7.675  15.964   0.848
  814    HD1  HIS 109           HD1      HIS 109  -8.508  13.440   0.951
  815    HD2  HIS 109           HD2      HIS 109 -11.848  15.494   2.343
  816    HE1  HIS 109           HE1      HIS 109  -9.457  12.023   2.803
  817    HE2  HIS 109           HE2      HIS 109 -11.368  13.373   3.744
  818    HB2  HIS 109           HB2      HIS 109 -10.064  16.831   0.647
  819    HB3  HIS 109           HB3      HIS 109 -10.286  15.649  -0.638
  Start of MODEL   16
    1    HA   MET   1           HA       MET   1  38.138  41.481   7.555
    2    H1   MET   1           H1       MET   1  38.438  43.697   9.487
    3    H2   MET   1           H2       MET   1  36.979  42.947   9.056
    4    H3   MET   1           H3       MET   1  37.857  43.824   7.901
    5    HB2  MET   1           HB2      MET   1  40.542  42.983   8.592
    6    HB3  MET   1           HB3      MET   1  40.668  41.401   7.836
    7    HG2  MET   1           HG2      MET   1  41.158  43.143   6.239
    8    HG3  MET   1           HG3      MET   1  39.684  42.287   5.792
    9    HE1  MET   1           HE1      MET   1  39.078  44.236   4.081
   10    HE2  MET   1           HE2      MET   1  40.560  45.079   4.532
   11    HE3  MET   1           HE3      MET   1  39.021  45.940   4.528
   12    H    ALA   2           H        ALA   2  37.727  39.647   8.503
   13    HA   ALA   2           HA       ALA   2  39.050  38.628  10.767
   14    HB1  ALA   2           HB1      ALA   2  37.236  38.606  12.402
   15    HB2  ALA   2           HB2      ALA   2  36.220  39.545  11.310
   16    HB3  ALA   2           HB3      ALA   2  37.676  40.265  11.996
   17    H    MET   3           H        MET   3  35.961  38.658   9.053
   18    HA   MET   3           HA       MET   3  35.617  35.812   9.220
   19    HB2  MET   3           HB2      MET   3  34.194  37.773   7.408
   20    HB3  MET   3           HB3      MET   3  33.663  36.150   7.816
   21    HG2  MET   3           HG2      MET   3  32.333  37.570   9.101
   22    HG3  MET   3           HG3      MET   3  33.544  36.948  10.218
   23    HE1  MET   3           HE1      MET   3  33.658  41.191   8.393
   24    HE2  MET   3           HE2      MET   3  32.360  40.035   8.096
   25    HE3  MET   3           HE3      MET   3  33.974  39.732   7.455
   26    H    LYS   4           H        LYS   4  36.735  34.427   8.041
   27    HA   LYS   4           HA       LYS   4  37.163  34.927   5.217
   28    HB2  LYS   4           HB2      LYS   4  39.141  35.959   6.297
   29    HB3  LYS   4           HB3      LYS   4  39.495  34.429   7.083
   30    HG2  LYS   4           HG2      LYS   4  39.983  33.387   4.991
   31    HG3  LYS   4           HG3      LYS   4  39.418  34.802   4.100
   32    HD2  LYS   4           HD2      LYS   4  41.847  34.772   4.175
   33    HD3  LYS   4           HD3      LYS   4  41.222  36.137   5.101
   34    HE2  LYS   4           HE2      LYS   4  41.494  34.798   7.170
   35    HE3  LYS   4           HE3      LYS   4  42.226  33.513   6.208
   36    HZ1  LYS   4           HZ1      LYS   4  43.961  34.813   7.155
   37    HZ2  LYS   4           HZ2      LYS   4  43.263  36.262   6.618
   38    HZ3  LYS   4           HZ3      LYS   4  43.918  35.175   5.497
   39    H    ASP   5           H        ASP   5  35.982  33.158   4.676
   40    HA   ASP   5           HA       ASP   5  36.968  30.543   5.579
   41    HB2  ASP   5           HB2      ASP   5  34.015  31.190   5.504
   42    HB3  ASP   5           HB3      ASP   5  34.778  29.737   6.129
   43    H    VAL   6           H        VAL   6  37.338  29.326   3.805
   44    HA   VAL   6           HA       VAL   6  35.677  29.857   1.435
   45    HB   VAL   6           HB       VAL   6  37.440  28.648   0.123
   46   HG11  VAL   6          HG11      VAL   6  39.013  30.548   0.127
   47   HG12  VAL   6          HG12      VAL   6  38.275  31.131   1.619
   48   HG13  VAL   6          HG13      VAL   6  37.328  31.069   0.133
   49   HG21  VAL   6          HG21      VAL   6  39.676  28.420   1.120
   50   HG22  VAL   6          HG22      VAL   6  38.494  27.394   1.933
   51   HG23  VAL   6          HG23      VAL   6  39.020  28.900   2.684
   52    H    VAL   7           H        VAL   7  34.003  28.622   2.491
   53    HA   VAL   7           HA       VAL   7  34.475  25.741   2.597
   54    HB   VAL   7           HB       VAL   7  33.442  26.619   4.592
   55   HG11  VAL   7          HG11      VAL   7  32.451  28.643   3.660
   56   HG12  VAL   7          HG12      VAL   7  31.264  27.721   4.584
   57   HG13  VAL   7          HG13      VAL   7  31.243  27.674   2.820
   58   HG21  VAL   7          HG21      VAL   7  32.720  24.405   3.902
   59   HG22  VAL   7          HG22      VAL   7  31.431  25.110   2.928
   60   HG23  VAL   7          HG23      VAL   7  31.396  25.269   4.684
   61    H    ASP   8           H        ASP   8  33.914  24.503   0.961
   62    HA   ASP   8           HA       ASP   8  31.938  25.506  -0.967
   63    HB2  ASP   8           HB2      ASP   8  32.831  23.893  -2.552
   64    HB3  ASP   8           HB3      ASP   8  34.143  24.868  -1.901
   65    H    LYS   9           H        LYS   9  30.356  24.019  -1.803
   66    HA   LYS   9           HA       LYS   9  29.741  21.716  -0.181
   67    HB2  LYS   9           HB2      LYS   9  27.372  22.762   0.218
   68    HB3  LYS   9           HB3      LYS   9  28.692  23.107   1.316
   69    HG2  LYS   9           HG2      LYS   9  27.911  25.212   1.036
   70    HG3  LYS   9           HG3      LYS   9  29.023  25.161  -0.331
   71    HD2  LYS   9           HD2      LYS   9  27.126  24.503  -1.788
   72    HD3  LYS   9           HD3      LYS   9  26.041  24.696  -0.405
   73    HE2  LYS   9           HE2      LYS   9  26.786  27.056  -0.220
   74    HE3  LYS   9           HE3      LYS   9  27.745  26.835  -1.682
   75    HZ1  LYS   9           HZ1      LYS   9  25.576  26.153  -2.764
   76    HZ2  LYS   9           HZ2      LYS   9  25.754  27.797  -2.386
   77    HZ3  LYS   9           HZ3      LYS   9  24.801  26.799  -1.400
   78    H    CYS  10           H        CYS  10  29.046  20.206  -1.488
   79    HA   CYS  10           HA       CYS  10  27.006  20.592  -3.432
   80    HG   CYS  10           HG       CYS  10  30.888  20.220  -3.146
   81    HB2  CYS  10           HB2      CYS  10  28.454  20.009  -5.427
   82    HB3  CYS  10           HB3      CYS  10  28.660  21.636  -4.786
   83    H    SER  11           H        SER  11  27.634  18.816  -1.239
   84    HA   SER  11           HA       SER  11  28.384  16.278  -2.388
   85    HG   SER  11           HG       SER  11  29.592  16.478   0.859
   86    HB2  SER  11           HB2      SER  11  27.261  16.902   0.354
   87    HB3  SER  11           HB3      SER  11  27.995  15.379  -0.145
   88    H    THR  12           H        THR  12  26.785  16.017  -4.001
   89    HA   THR  12           HA       THR  12  24.343  14.819  -2.997
   90    HB   THR  12           HB       THR  12  24.228  17.112  -4.969
   91    HG1  THR  12           HG1      THR  12  24.170  17.054  -2.275
   92   HG21  THR  12          HG21      THR  12  22.575  15.355  -5.432
   93   HG22  THR  12          HG22      THR  12  21.800  16.823  -4.840
   94   HG23  THR  12          HG23      THR  12  22.014  15.444  -3.760
   95    H    LYS  13           H        LYS  13  24.826  12.867  -3.844
   96    HA   LYS  13           HA       LYS  13  24.314  12.502  -6.628
   97    HB2  LYS  13           HB2      LYS  13  26.408  11.420  -7.256
   98    HB3  LYS  13           HB3      LYS  13  26.700  13.090  -6.788
   99    HG2  LYS  13           HG2      LYS  13  27.576  12.398  -4.662
  100    HG3  LYS  13           HG3      LYS  13  27.136  10.719  -4.983
  101    HD2  LYS  13           HD2      LYS  13  28.680  10.728  -6.918
  102    HD3  LYS  13           HD3      LYS  13  29.167  12.370  -6.488
  103    HE2  LYS  13           HE2      LYS  13  30.783  10.781  -5.636
  104    HE3  LYS  13           HE3      LYS  13  29.930  11.550  -4.298
  105    HZ1  LYS  13           HZ1      LYS  13  30.145   9.192  -3.915
  106    HZ2  LYS  13           HZ2      LYS  13  29.393   8.836  -5.389
  107    HZ3  LYS  13           HZ3      LYS  13  28.512   9.572  -4.146
  108    H    GLY  14           H        GLY  14  23.371  10.566  -6.918
  109    HA2  GLY  14           HA2      GLY  14  23.127   8.244  -6.609
  110    HA3  GLY  14           HA3      GLY  14  24.045   8.366  -5.118
  111    H    CYS  15           H        CYS  15  21.046   7.880  -6.394
  112    HA   CYS  15           HA       CYS  15  19.874   8.079  -3.737
  113    HG   CYS  15           HG       CYS  15  17.467   9.317  -2.913
  114    HB2  CYS  15           HB2      CYS  15  19.297  10.216  -4.868
  115    HB3  CYS  15           HB3      CYS  15  18.544   9.306  -6.172
  116    H    ALA  16           H        ALA  16  20.229   5.778  -3.994
  117    HA   ALA  16           HA       ALA  16  18.040   4.512  -5.495
  118    HB1  ALA  16           HB1      ALA  16  19.525   2.703  -6.206
  119    HB2  ALA  16           HB2      ALA  16  20.896   3.530  -5.465
  120    HB3  ALA  16           HB3      ALA  16  20.065   4.258  -6.840
  121    H    ILE  17           H        ILE  17  16.856   4.089  -3.700
  122    HA   ILE  17           HA       ILE  17  17.993   2.148  -1.813
  123    HB   ILE  17           HB       ILE  17  16.717   3.213   0.034
  124   HG12  ILE  17          HG12      ILE  17  16.371   5.519  -1.899
  125   HG13  ILE  17          HG13      ILE  17  15.088   4.405  -1.433
  126   HG21  ILE  17          HG21      ILE  17  19.101   3.652  -0.209
  127   HG22  ILE  17          HG22      ILE  17  18.262   5.071   0.418
  128   HG23  ILE  17          HG23      ILE  17  18.754   5.013  -1.275
  129   HD11  ILE  17          HD11      ILE  17  14.936   6.496  -0.212
  130   HD12  ILE  17          HD12      ILE  17  16.569   6.267   0.412
  131   HD13  ILE  17          HD13      ILE  17  15.280   5.156   0.881
  132    H    ASP  18           H        ASP  18  16.241   0.988  -0.601
  133    HA   ASP  18           HA       ASP  18  13.901   0.593  -2.295
  134    HB2  ASP  18           HB2      ASP  18  13.607  -1.521  -1.176
  135    HB3  ASP  18           HB3      ASP  18  15.284  -1.405  -1.682
  136    H    ILE  19           H        ILE  19  11.841   0.516  -1.332
  137    HA   ILE  19           HA       ILE  19  11.559   2.416   0.823
  138    HB   ILE  19           HB       ILE  19   9.083   2.177   0.307
  139   HG12  ILE  19          HG12      ILE  19  10.196   0.681  -2.079
  140   HG13  ILE  19          HG13      ILE  19   9.143   0.015  -0.838
  141   HG21  ILE  19          HG21      ILE  19   9.247   3.626  -1.655
  142   HG22  ILE  19          HG22      ILE  19  10.930   3.144  -1.867
  143   HG23  ILE  19          HG23      ILE  19  10.448   4.052  -0.435
  144   HD11  ILE  19          HD11      ILE  19   8.449   2.124  -2.864
  145   HD12  ILE  19          HD12      ILE  19   7.389   1.600  -1.555
  146   HD13  ILE  19          HD13      ILE  19   7.871   0.459  -2.811
  147    H    GLY  20           H        GLY  20  12.180   1.321   2.606
  148    HA2  GLY  20           HA2      GLY  20  10.453  -0.938   3.404
  149    HA3  GLY  20           HA3      GLY  20  12.137  -0.785   3.889
  150    H    THR  21           H        THR  21   9.767   1.808   3.794
  151    HA   THR  21           HA       THR  21  10.275   2.499   6.523
  152    HB   THR  21           HB       THR  21   7.971   3.495   4.874
  153    HG1  THR  21           HG1      THR  21  10.669   3.817   4.424
  154   HG21  THR  21          HG21      THR  21   8.006   4.143   7.234
  155   HG22  THR  21          HG22      THR  21   8.286   5.539   6.194
  156   HG23  THR  21          HG23      THR  21   9.638   4.785   7.038
  157    H    VAL  22           H        VAL  22   9.704   0.765   7.762
  158    HA   VAL  22           HA       VAL  22   7.100  -0.461   7.529
  159    HB   VAL  22           HB       VAL  22   7.834  -1.935   9.342
  160   HG11  VAL  22          HG11      VAL  22   9.707  -3.017   8.182
  161   HG12  VAL  22          HG12      VAL  22   9.924  -1.570   7.197
  162   HG13  VAL  22          HG13      VAL  22   8.443  -2.518   7.059
  163   HG21  VAL  22          HG21      VAL  22  10.323  -0.232   9.375
  164   HG22  VAL  22          HG22      VAL  22  10.114  -1.753  10.246
  165   HG23  VAL  22          HG23      VAL  22   9.119  -0.356  10.657
  166    H    ILE  23           H        ILE  23   5.865  -0.854   9.626
  167    HA   ILE  23           HA       ILE  23   5.801   1.654  11.176
  168    HB   ILE  23           HB       ILE  23   3.459  -0.188  10.645
  169   HG12  ILE  23          HG12      ILE  23   4.170   0.942   8.576
  170   HG13  ILE  23          HG13      ILE  23   2.620   1.556   9.137
  171   HG21  ILE  23          HG21      ILE  23   3.565   2.571  11.857
  172   HG22  ILE  23          HG22      ILE  23   3.337   1.067  12.747
  173   HG23  ILE  23          HG23      ILE  23   2.115   1.603  11.594
  174   HD11  ILE  23          HD11      ILE  23   4.067   3.338   8.321
  175   HD12  ILE  23          HD12      ILE  23   5.280   2.905   9.527
  176   HD13  ILE  23          HD13      ILE  23   3.711   3.528  10.039
  177    H    ASP  24           H        ASP  24   4.091  -1.374  11.778
  178    HA   ASP  24           HA       ASP  24   5.884  -2.087  13.946
  179    HB2  ASP  24           HB2      ASP  24   3.025  -1.251  14.402
  180    HB3  ASP  24           HB3      ASP  24   3.856  -2.335  15.508
  181    H    ASN  25           H        ASN  25   2.552  -3.014  13.854
  182    HA   ASN  25           HA       ASN  25   2.534  -5.220  12.201
  183    HB2  ASN  25           HB2      ASN  25   2.869  -7.123  13.707
  184    HB3  ASN  25           HB3      ASN  25   4.336  -6.151  13.645
  185   HD21  ASN  25          HD21      ASN  25   1.753  -7.319  15.618
  186   HD22  ASN  25          HD22      ASN  25   2.348  -6.690  17.119
  187    H    ASP  26           H        ASP  26   0.519  -6.225  12.260
  188    HA   ASP  26           HA       ASP  26  -1.260  -6.121  14.445
  189    HB2  ASP  26           HB2      ASP  26  -1.259  -3.682  13.815
  190    HB3  ASP  26           HB3      ASP  26  -1.943  -4.144  12.259
  191    H    ASN  27           H        ASN  27  -2.005  -5.441  11.069
  192    HA   ASN  27           HA       ASN  27  -2.892  -8.213  10.726
  193    HB2  ASN  27           HB2      ASN  27  -4.896  -7.467   9.557
  194    HB3  ASN  27           HB3      ASN  27  -4.872  -6.795  11.183
  195   HD21  ASN  27          HD21      ASN  27  -4.555  -4.581  11.462
  196   HD22  ASN  27          HD22      ASN  27  -4.733  -3.465  10.144
  197    H    CYS  28           H        CYS  28  -3.345  -8.608   8.322
  198    HA   CYS  28           HA       CYS  28  -1.062  -7.460   6.847
  199    HG   CYS  28           HG       CYS  28  -0.624 -11.554   7.948
  200    HB2  CYS  28           HB2      CYS  28  -2.331 -10.181   6.477
  201    HB3  CYS  28           HB3      CYS  28  -0.856  -9.593   5.720
  202    H    THR  29           H        THR  29  -4.091  -6.847   7.044
  203    HA   THR  29           HA       THR  29  -4.868  -7.204   4.253
  204    HB   THR  29           HB       THR  29  -6.463  -6.058   6.558
  205    HG1  THR  29           HG1      THR  29  -7.381  -8.419   5.726
  206   HG21  THR  29          HG21      THR  29  -8.396  -6.420   5.126
  207   HG22  THR  29          HG22      THR  29  -7.355  -7.046   3.847
  208   HG23  THR  29          HG23      THR  29  -7.238  -5.353   4.329
  209    H    SER  30           H        SER  30  -4.714  -5.602   2.810
  210    HA   SER  30           HA       SER  30  -4.010  -2.923   3.756
  211    HG   SER  30           HG       SER  30  -2.324  -1.969   1.997
  212    HB2  SER  30           HB2      SER  30  -2.640  -4.118   1.974
  213    HB3  SER  30           HB3      SER  30  -4.022  -3.925   0.899
  214    H    LYS  31           H        LYS  31  -5.768  -1.813   4.251
  215    HA   LYS  31           HA       LYS  31  -8.155  -2.006   2.570
  216    HB2  LYS  31           HB2      LYS  31  -7.623  -0.877   5.314
  217    HB3  LYS  31           HB3      LYS  31  -9.130  -0.580   4.456
  218    HG2  LYS  31           HG2      LYS  31  -8.280  -3.396   4.662
  219    HG3  LYS  31           HG3      LYS  31  -8.765  -2.605   6.163
  220    HD2  LYS  31           HD2      LYS  31 -10.422  -2.604   3.649
  221    HD3  LYS  31           HD3      LYS  31 -10.619  -3.769   4.959
  222    HE2  LYS  31           HE2      LYS  31 -10.877  -0.777   5.215
  223    HE3  LYS  31           HE3      LYS  31 -12.218  -1.914   5.127
  224    HZ1  LYS  31           HZ1      LYS  31 -10.140  -2.086   7.234
  225    HZ2  LYS  31           HZ2      LYS  31 -11.670  -2.819   7.204
  226    HZ3  LYS  31           HZ3      LYS  31 -11.536  -1.143   7.415
  227    H    PHE  32           H        PHE  32  -8.445  -0.566   1.032
  228    HA   PHE  32           HA       PHE  32  -7.431   2.160   1.469
  229    HD1  PHE  32           HD1      PHE  32  -5.035   3.060   0.293
  230    HD2  PHE  32           HD2      PHE  32  -8.199   2.645  -2.517
  231    HE1  PHE  32           HE1      PHE  32  -4.484   5.265  -0.643
  232    HE2  PHE  32           HE2      PHE  32  -7.654   4.850  -3.462
  233    HZ   PHE  32           HZ       PHE  32  -5.794   6.164  -2.521
  234    HB2  PHE  32           HB2      PHE  32  -6.064   0.866  -0.214
  235    HB3  PHE  32           HB3      PHE  32  -7.506   0.787  -1.223
  236    H    SER  33           H        SER  33  -9.012   3.556   1.529
  237    HA   SER  33           HA       SER  33 -11.448   3.037  -0.048
  238    HG   SER  33           HG       SER  33 -13.525   2.801   1.638
  239    HB2  SER  33           HB2      SER  33 -11.584   2.689   2.518
  240    HB3  SER  33           HB3      SER  33 -11.489   4.448   2.615
  241    H    ARG  34           H        ARG  34 -11.615   4.542  -1.577
  242    HA   ARG  34           HA       ARG  34 -10.937   7.320  -0.911
  243    HE   ARG  34           HE       ARG  34  -7.637   9.914  -3.366
  244    HB2  ARG  34           HB2      ARG  34  -9.023   6.057  -2.066
  245    HB3  ARG  34           HB3      ARG  34 -10.045   6.058  -3.495
  246    HG2  ARG  34           HG2      ARG  34 -10.075   8.489  -3.496
  247    HG3  ARG  34           HG3      ARG  34  -9.089   8.509  -2.032
  248    HD2  ARG  34           HD2      ARG  34  -7.335   7.258  -3.276
  249    HD3  ARG  34           HD3      ARG  34  -8.304   7.441  -4.736
  250   HH11  ARG  34          HH11      ARG  34  -6.788   7.619  -5.876
  251   HH12  ARG  34          HH12      ARG  34  -5.782   8.735  -6.748
  252   HH21  ARG  34          HH21      ARG  34  -6.313  11.384  -4.509
  253   HH22  ARG  34          HH22      ARG  34  -5.523  10.882  -5.976
  254    H    PHE  35           H        PHE  35 -12.011   8.876  -2.245
  255    HA   PHE  35           HA       PHE  35 -14.425   7.757  -3.505
  256    HD1  PHE  35           HD2      PHE  35 -16.701   8.156  -1.858
  257    HD2  PHE  35           HD1      PHE  35 -13.288  10.081  -0.196
  258    HE1  PHE  35           HE2      PHE  35 -17.334   7.344   0.376
  259    HE2  PHE  35           HE1      PHE  35 -13.914   9.271   2.041
  260    HZ   PHE  35           HZ       PHE  35 -15.943   7.900   2.327
  261    HB2  PHE  35           HB2      PHE  35 -13.949  10.541  -2.421
  262    HB3  PHE  35           HB3      PHE  35 -15.467   9.933  -3.072
  263    H    PHE  36           H        PHE  36 -14.820   8.067  -5.592
  264    HA   PHE  36           HA       PHE  36 -13.004   9.847  -7.089
  265    HD1  PHE  36           HD2      PHE  36 -10.856   8.773  -8.624
  266    HD2  PHE  36           HD1      PHE  36 -12.846   5.835  -6.274
  267    HE1  PHE  36           HE2      PHE  36  -8.681   7.891  -7.888
  268    HE2  PHE  36           HE1      PHE  36 -10.675   4.954  -5.534
  269    HZ   PHE  36           HZ       PHE  36  -8.588   5.979  -6.342
  270    HB2  PHE  36           HB2      PHE  36 -14.054   7.119  -7.871
  271    HB3  PHE  36           HB3      PHE  36 -13.230   8.209  -8.983
  272    H    ALA  37           H        ALA  37 -13.929  10.294  -9.359
  273    HA   ALA  37           HA       ALA  37 -16.351  11.709  -9.011
  274    HB1  ALA  37           HB1      ALA  37 -14.928  10.999 -11.572
  275    HB2  ALA  37           HB2      ALA  37 -14.614  12.420 -10.577
  276    HB3  ALA  37           HB3      ALA  37 -16.172  12.235 -11.385
  277    H    THR  38           H        THR  38 -15.641   8.817 -11.015
  278    HA   THR  38           HA       THR  38 -18.511   8.174 -10.840
  279    HB   THR  38           HB       THR  38 -18.387   7.229 -13.133
  280    HG1  THR  38           HG1      THR  38 -16.473   8.254 -14.337
  281   HG21  THR  38          HG21      THR  38 -18.442   9.369 -14.322
  282   HG22  THR  38          HG22      THR  38 -17.684  10.157 -12.938
  283   HG23  THR  38          HG23      THR  38 -19.299   9.467 -12.784
  284    H    ARG  39           H        ARG  39 -18.974   5.892 -11.366
  285    HA   ARG  39           HA       ARG  39 -17.466   4.133  -9.753
  286    HE   ARG  39           HE       ARG  39 -20.852   0.215  -9.172
  287    HB2  ARG  39           HB2      ARG  39 -19.874   3.892 -10.250
  288    HB3  ARG  39           HB3      ARG  39 -19.491   3.516 -11.916
  289    HG2  ARG  39           HG2      ARG  39 -18.213   1.529 -11.065
  290    HG3  ARG  39           HG3      ARG  39 -18.896   1.878  -9.474
  291    HD2  ARG  39           HD2      ARG  39 -21.157   1.902 -10.816
  292    HD3  ARG  39           HD3      ARG  39 -20.242   0.920 -11.958
  293   HH11  ARG  39          HH11      ARG  39 -19.777  -0.686 -12.380
  294   HH12  ARG  39          HH12      ARG  39 -19.856  -2.391 -12.074
  295   HH21  ARG  39          HH21      ARG  39 -20.972  -2.017  -8.760
  296   HH22  ARG  39          HH22      ARG  39 -20.527  -3.155 -10.003
  297    H    GLU  40           H        GLU  40 -17.364   4.975 -13.109
  298    HA   GLU  40           HA       GLU  40 -15.786   2.905 -14.154
  299    HB2  GLU  40           HB2      GLU  40 -15.738   5.828 -14.907
  300    HB3  GLU  40           HB3      GLU  40 -15.203   4.484 -15.897
  301    HG2  GLU  40           HG2      GLU  40 -17.477   3.660 -16.047
  302    HG3  GLU  40           HG3      GLU  40 -18.028   4.964 -14.997
  303    H    GLU  41           H        GLU  41 -14.919   6.051 -12.805
  304    HA   GLU  41           HA       GLU  41 -12.145   5.869 -13.078
  305    HB2  GLU  41           HB2      GLU  41 -13.748   7.363 -10.989
  306    HB3  GLU  41           HB3      GLU  41 -12.071   7.675 -11.407
  307    HG2  GLU  41           HG2      GLU  41 -14.439   7.997 -13.229
  308    HG3  GLU  41           HG3      GLU  41 -13.544   9.294 -12.439
  309    H    ALA  42           H        ALA  42 -14.311   4.521 -10.753
  310    HA   ALA  42           HA       ALA  42 -12.396   4.070  -8.681
  311    HB1  ALA  42           HB1      ALA  42 -15.073   2.760  -9.136
  312    HB2  ALA  42           HB2      ALA  42 -14.784   4.232  -8.207
  313    HB3  ALA  42           HB3      ALA  42 -14.126   2.694  -7.649
  314    H    GLU  43           H        GLU  43 -13.933   1.889 -11.067
  315    HA   GLU  43           HA       GLU  43 -12.349  -0.352 -10.340
  316    HB2  GLU  43           HB2      GLU  43 -13.143  -1.288 -12.555
  317    HB3  GLU  43           HB3      GLU  43 -14.403  -0.819 -11.422
  318    HG2  GLU  43           HG2      GLU  43 -14.789   1.226 -12.644
  319    HG3  GLU  43           HG3      GLU  43 -13.462   0.849 -13.741
  320    H    SER  44           H        SER  44 -11.955   2.246 -12.646
  321    HA   SER  44           HA       SER  44  -9.778   1.138 -14.075
  322    HG   SER  44           HG       SER  44 -12.208   2.994 -14.625
  323    HB2  SER  44           HB2      SER  44 -10.488   4.053 -13.664
  324    HB3  SER  44           HB3      SER  44  -9.413   3.413 -14.908
  325    H    PHE  45           H        PHE  45 -10.019   2.815 -11.022
  326    HA   PHE  45           HA       PHE  45  -7.263   3.496 -10.807
  327    HD1  PHE  45           HD1      PHE  45  -6.555   5.471  -9.158
  328    HD2  PHE  45           HD2      PHE  45  -8.304   2.469  -6.702
  329    HE1  PHE  45           HE1      PHE  45  -4.877   5.920  -7.413
  330    HE2  PHE  45           HE2      PHE  45  -6.632   2.911  -4.957
  331    HZ   PHE  45           HZ       PHE  45  -4.913   4.640  -5.312
  332    HB2  PHE  45           HB2      PHE  45  -8.959   4.615  -9.445
  333    HB3  PHE  45           HB3      PHE  45  -9.365   3.091  -8.664
  334    H    MET  46           H        MET  46  -9.180   0.682 -10.013
  335    HA   MET  46           HA       MET  46  -7.169  -0.593  -8.443
  336    HB2  MET  46           HB2      MET  46  -9.581  -1.085  -8.208
  337    HB3  MET  46           HB3      MET  46  -9.573  -1.809  -9.809
  338    HG2  MET  46           HG2      MET  46  -8.206  -3.597  -9.105
  339    HG3  MET  46           HG3      MET  46  -7.823  -2.798  -7.580
  340    HE1  MET  46           HE1      MET  46 -10.668  -1.636  -6.789
  341    HE2  MET  46           HE2      MET  46  -9.599  -2.424  -5.630
  342    HE3  MET  46           HE3      MET  46 -11.289  -2.919  -5.750
  343    H    THR  47           H        THR  47  -7.687  -0.269 -11.816
  344    HA   THR  47           HA       THR  47  -6.573  -2.595 -12.851
  345    HB   THR  47           HB       THR  47  -6.177   0.180 -13.984
  346    HG1  THR  47           HG1      THR  47  -8.431  -1.576 -14.039
  347   HG21  THR  47          HG21      THR  47  -6.353  -2.544 -15.275
  348   HG22  THR  47          HG22      THR  47  -4.910  -1.540 -15.134
  349   HG23  THR  47          HG23      THR  47  -6.255  -1.012 -16.145
  350    H    LYS  48           H        LYS  48  -4.939   0.445 -11.947
  351    HA   LYS  48           HA       LYS  48  -2.334  -0.563 -12.543
  352    HB2  LYS  48           HB2      LYS  48  -1.520   1.499 -11.463
  353    HB3  LYS  48           HB3      LYS  48  -2.740   1.806 -12.691
  354    HG2  LYS  48           HG2      LYS  48  -4.430   1.958 -10.876
  355    HG3  LYS  48           HG3      LYS  48  -3.111   1.834  -9.712
  356    HD2  LYS  48           HD2      LYS  48  -3.373   3.970 -11.823
  357    HD3  LYS  48           HD3      LYS  48  -3.806   4.150 -10.127
  358    HE2  LYS  48           HE2      LYS  48  -1.479   3.701  -9.493
  359    HE3  LYS  48           HE3      LYS  48  -1.055   3.555 -11.200
  360    HZ1  LYS  48           HZ1      LYS  48  -1.891   5.884 -11.450
  361    HZ2  LYS  48           HZ2      LYS  48  -0.489   5.734 -10.520
  362    HZ3  LYS  48           HZ3      LYS  48  -1.990   5.983  -9.762
  363    H    LEU  49           H        LEU  49  -4.362  -0.479  -9.729
  364    HA   LEU  49           HA       LEU  49  -2.398  -1.077  -7.771
  365    HG   LEU  49           HG       LEU  49  -5.434   0.144  -6.005
  366    HB2  LEU  49           HB2      LEU  49  -5.377  -1.253  -7.926
  367    HB3  LEU  49           HB3      LEU  49  -4.569  -2.115  -6.635
  368   HD11  LEU  49          HD11      LEU  49  -3.445   0.801  -4.771
  369   HD12  LEU  49          HD12      LEU  49  -2.458  -0.239  -5.799
  370   HD13  LEU  49          HD13      LEU  49  -3.673  -0.947  -4.734
  371   HD21  LEU  49          HD21      LEU  49  -3.211   1.125  -7.790
  372   HD22  LEU  49          HD22      LEU  49  -4.191   2.115  -6.707
  373   HD23  LEU  49          HD23      LEU  49  -4.938   1.318  -8.091
  374    H    LYS  50           H        LYS  50  -4.497  -3.104  -9.782
  375    HA   LYS  50           HA       LYS  50  -3.848  -5.578  -8.668
  376    HB2  LYS  50           HB2      LYS  50  -5.337  -4.635 -10.869
  377    HB3  LYS  50           HB3      LYS  50  -4.207  -5.822 -11.510
  378    HG2  LYS  50           HG2      LYS  50  -6.300  -6.875 -10.893
  379    HG3  LYS  50           HG3      LYS  50  -4.986  -7.448  -9.857
  380    HD2  LYS  50           HD2      LYS  50  -5.693  -5.704  -8.188
  381    HD3  LYS  50           HD3      LYS  50  -7.127  -5.445  -9.186
  382    HE2  LYS  50           HE2      LYS  50  -6.291  -8.054  -7.933
  383    HE3  LYS  50           HE3      LYS  50  -7.558  -6.988  -7.328
  384    HZ1  LYS  50           HZ1      LYS  50  -8.954  -7.520  -9.062
  385    HZ2  LYS  50           HZ2      LYS  50  -8.172  -9.007  -8.802
  386    HZ3  LYS  50           HZ3      LYS  50  -7.698  -8.011 -10.089
  387    H    GLU  51           H        GLU  51  -2.247  -3.708 -11.181
  388    HA   GLU  51           HA       GLU  51  -0.323  -5.626 -11.917
  389    HB2  GLU  51           HB2      GLU  51  -0.041  -2.616 -11.888
  390    HB3  GLU  51           HB3      GLU  51   0.972  -3.737 -12.784
  391    HG2  GLU  51           HG2      GLU  51  -1.057  -4.446 -14.044
  392    HG3  GLU  51           HG3      GLU  51  -1.940  -3.150 -13.234
  393    H    LEU  52           H        LEU  52  -0.306  -3.068  -9.509
  394    HA   LEU  52           HA       LEU  52   2.326  -3.529  -8.572
  395    HG   LEU  52           HG       LEU  52   0.906  -0.983  -9.341
  396    HB2  LEU  52           HB2      LEU  52  -0.051  -2.112  -7.380
  397    HB3  LEU  52           HB3      LEU  52   1.524  -2.133  -6.619
  398   HD11  LEU  52          HD11      LEU  52   1.342   1.178  -8.295
  399   HD12  LEU  52          HD12      LEU  52   1.547   0.383  -6.735
  400   HD13  LEU  52          HD13      LEU  52  -0.023   0.358  -7.536
  401   HD21  LEU  52          HD21      LEU  52   3.171  -1.876  -9.238
  402   HD22  LEU  52          HD22      LEU  52   3.472  -0.979  -7.750
  403   HD23  LEU  52          HD23      LEU  52   3.195  -0.113  -9.261
  404    H    ALA  53           H        ALA  53  -0.856  -4.618  -7.483
  405    HA   ALA  53           HA       ALA  53  -0.043  -5.828  -5.082
  406    HB1  ALA  53           HB1      ALA  53  -2.381  -5.296  -5.645
  407    HB2  ALA  53           HB2      ALA  53  -2.179  -6.969  -5.125
  408    HB3  ALA  53           HB3      ALA  53  -2.371  -6.596  -6.837
  409    H    ALA  54           H        ALA  54  -0.059  -7.002  -8.386
  410    HA   ALA  54           HA       ALA  54   0.244  -9.744  -7.861
  411    HB1  ALA  54           HB1      ALA  54   1.038  -9.920 -10.152
  412    HB2  ALA  54           HB2      ALA  54   1.270  -8.173 -10.220
  413    HB3  ALA  54           HB3      ALA  54  -0.354  -8.842 -10.058
  414    H    ALA  55           H        ALA  55   2.592  -7.128  -8.073
  415    HA   ALA  55           HA       ALA  55   4.834  -8.934  -7.742
  416    HB1  ALA  55           HB1      ALA  55   4.764  -5.921  -7.736
  417    HB2  ALA  55           HB2      ALA  55   5.049  -6.937  -9.150
  418    HB3  ALA  55           HB3      ALA  55   6.207  -6.931  -7.819
  419    H    ALA  56           H        ALA  56   2.892  -6.768  -5.816
  420    HA   ALA  56           HA       ALA  56   4.618  -6.554  -3.590
  421    HB1  ALA  56           HB1      ALA  56   2.815  -4.966  -4.025
  422    HB2  ALA  56           HB2      ALA  56   2.680  -5.664  -2.410
  423    HB3  ALA  56           HB3      ALA  56   1.626  -6.229  -3.706
  424    H    SER  57           H        SER  57   2.337  -8.997  -4.545
  425    HA   SER  57           HA       SER  57   2.728 -10.315  -1.944
  426    HG   SER  57           HG       SER  57   0.299  -9.565  -4.485
  427    HB2  SER  57           HB2      SER  57   0.587 -11.520  -2.441
  428    HB3  SER  57           HB3      SER  57   0.395  -9.780  -2.230
  429    H    SER  58           H        SER  58   3.505 -12.361  -1.910
  430    HA   SER  58           HA       SER  58   4.304 -13.549  -4.442
  431    HG   SER  58           HG       SER  58   5.996 -12.512  -3.096
  432    HB2  SER  58           HB2      SER  58   4.815 -14.571  -1.642
  433    HB3  SER  58           HB3      SER  58   5.657 -15.039  -3.118
  434    H    ALA  59           H        ALA  59   1.843 -13.699  -4.748
  435    HA   ALA  59           HA       ALA  59   0.927 -16.321  -3.759
  436    HB1  ALA  59           HB1      ALA  59  -0.788 -13.921  -4.387
  437    HB2  ALA  59           HB2      ALA  59  -0.369 -14.491  -2.772
  438    HB3  ALA  59           HB3      ALA  59  -1.361 -15.494  -3.830
  439    H    ASP  60           H        ASP  60   1.368 -14.180  -6.424
  440    HA   ASP  60           HA       ASP  60   1.560 -14.572  -8.650
  441    HB2  ASP  60           HB2      ASP  60   0.826 -17.429  -7.980
  442    HB3  ASP  60           HB3      ASP  60   1.270 -16.864  -9.586
  443    H    GLU  61           H        GLU  61  -1.173 -16.516  -7.480
  444    HA   GLU  61           HA       GLU  61  -2.715 -15.611  -9.785
  445    HB2  GLU  61           HB2      GLU  61  -3.224 -17.796  -7.765
  446    HB3  GLU  61           HB3      GLU  61  -4.280 -17.422  -9.123
  447    HG2  GLU  61           HG2      GLU  61  -2.448 -17.913 -10.673
  448    HG3  GLU  61           HG3      GLU  61  -1.413 -18.324  -9.306
  449    H    GLY  62           H        GLY  62  -2.177 -14.088  -7.159
  450    HA2  GLY  62           HA2      GLY  62  -3.573 -12.136  -6.818
  451    HA3  GLY  62           HA3      GLY  62  -4.973 -13.187  -6.951
  452    H    ALA  63           H        ALA  63  -4.185 -11.304  -4.874
  453    HA   ALA  63           HA       ALA  63  -3.800 -13.031  -2.548
  454    HB1  ALA  63           HB1      ALA  63  -3.646 -10.940  -1.281
  455    HB2  ALA  63           HB2      ALA  63  -4.011 -10.027  -2.745
  456    HB3  ALA  63           HB3      ALA  63  -2.515 -10.954  -2.635
  457    H    SER  64           H        SER  64  -5.266 -12.202  -0.603
  458    HA   SER  64           HA       SER  64  -7.970 -12.778  -1.330
  459    HG   SER  64           HG       SER  64  -7.433 -14.450   0.479
  460    HB2  SER  64           HB2      SER  64  -6.844 -11.793   1.300
  461    HB3  SER  64           HB3      SER  64  -8.440 -12.492   1.056
  462    H    VAL  65           H        VAL  65  -8.578 -11.116  -2.751
  463    HA   VAL  65           HA       VAL  65  -8.537  -8.404  -1.661
  464    HB   VAL  65           HB       VAL  65  -7.523  -8.498  -3.818
  465   HG11  VAL  65          HG11      VAL  65 -10.049  -9.788  -4.846
  466   HG12  VAL  65          HG12      VAL  65  -8.500 -10.595  -4.611
  467   HG13  VAL  65          HG13      VAL  65  -8.652  -9.318  -5.817
  468   HG21  VAL  65          HG21      VAL  65  -8.870  -6.526  -3.423
  469   HG22  VAL  65          HG22      VAL  65 -10.302  -7.346  -4.045
  470   HG23  VAL  65          HG23      VAL  65  -8.957  -6.980  -5.126
  471    H    ALA  66           H        ALA  66 -10.259  -7.786  -0.641
  472    HA   ALA  66           HA       ALA  66 -12.903  -8.572  -1.683
  473    HB1  ALA  66           HB1      ALA  66 -12.188  -7.568   1.078
  474    HB2  ALA  66           HB2      ALA  66 -12.496  -9.252   0.652
  475    HB3  ALA  66           HB3      ALA  66 -13.791  -8.060   0.531
  476    H    TYR  67           H        TYR  67 -13.436  -7.011  -3.107
  477    HA   TYR  67           HA       TYR  67 -13.065  -4.214  -2.263
  478    HD1  TYR  67           HD1      TYR  67 -12.449  -7.238  -5.130
  479    HD2  TYR  67           HD2      TYR  67 -13.630  -3.319  -6.310
  480    HE1  TYR  67           HE1      TYR  67 -13.356  -8.143  -7.231
  481    HE2  TYR  67           HE2      TYR  67 -14.534  -4.215  -8.409
  482    HH   TYR  67           HH       TYR  67 -15.098  -7.473  -8.925
  483    HB2  TYR  67           HB2      TYR  67 -12.310  -3.584  -4.395
  484    HB3  TYR  67           HB3      TYR  67 -11.466  -5.096  -4.087
  485    H    LYS  68           H        LYS  68 -14.613  -2.736  -2.968
  486    HA   LYS  68           HA       LYS  68 -16.717  -3.576  -4.732
  487    HB2  LYS  68           HB2      LYS  68 -18.557  -3.063  -3.183
  488    HB3  LYS  68           HB3      LYS  68 -17.617  -4.449  -2.659
  489    HG2  LYS  68           HG2      LYS  68 -17.143  -1.700  -1.558
  490    HG3  LYS  68           HG3      LYS  68 -18.356  -2.785  -0.888
  491    HD2  LYS  68           HD2      LYS  68 -16.475  -4.494  -0.676
  492    HD3  LYS  68           HD3      LYS  68 -15.371  -3.156  -0.997
  493    HE2  LYS  68           HE2      LYS  68 -15.577  -3.498   1.386
  494    HE3  LYS  68           HE3      LYS  68 -16.312  -1.956   0.942
  495    HZ1  LYS  68           HZ1      LYS  68 -17.604  -3.397   2.534
  496    HZ2  LYS  68           HZ2      LYS  68 -17.892  -4.445   1.229
  497    HZ3  LYS  68           HZ3      LYS  68 -18.458  -2.848   1.174
  498    H    ILE  69           H        ILE  69 -18.000  -1.854  -5.438
  499    HA   ILE  69           HA       ILE  69 -16.870   0.806  -4.897
  500    HB   ILE  69           HB       ILE  69 -18.331  -0.088  -7.391
  501   HG12  ILE  69          HG12      ILE  69 -15.362   0.359  -6.987
  502   HG13  ILE  69          HG13      ILE  69 -16.135  -1.215  -7.145
  503   HG21  ILE  69          HG21      ILE  69 -16.778   2.427  -6.788
  504   HG22  ILE  69          HG22      ILE  69 -18.533   2.293  -6.894
  505   HG23  ILE  69          HG23      ILE  69 -17.541   2.026  -8.327
  506   HD11  ILE  69          HD11      ILE  69 -15.090  -0.525  -9.225
  507   HD12  ILE  69          HD12      ILE  69 -16.075   0.938  -9.246
  508   HD13  ILE  69          HD13      ILE  69 -16.840  -0.643  -9.406
  509    H    LYS  70           H        LYS  70 -18.188   2.104  -3.813
  510    HA   LYS  70           HA       LYS  70 -21.030   1.472  -3.701
  511    HB2  LYS  70           HB2      LYS  70 -19.915   1.925  -1.596
  512    HB3  LYS  70           HB3      LYS  70 -19.391   3.492  -2.187
  513    HG2  LYS  70           HG2      LYS  70 -21.272   3.720  -0.675
  514    HG3  LYS  70           HG3      LYS  70 -21.704   4.236  -2.304
  515    HD2  LYS  70           HD2      LYS  70 -23.494   2.933  -1.294
  516    HD3  LYS  70           HD3      LYS  70 -22.813   2.091  -2.686
  517    HE2  LYS  70           HE2      LYS  70 -21.536   0.640  -1.236
  518    HE3  LYS  70           HE3      LYS  70 -22.062   1.540   0.186
  519    HZ1  LYS  70           HZ1      LYS  70 -23.869   0.046  -1.640
  520    HZ2  LYS  70           HZ2      LYS  70 -24.314   0.836  -0.208
  521    HZ3  LYS  70           HZ3      LYS  70 -23.309  -0.530  -0.144
  522    H    ASP  71           H        ASP  71 -22.205   2.238  -5.203
  523    HA   ASP  71           HA       ASP  71 -21.555   4.529  -6.792
  524    HB2  ASP  71           HB2      ASP  71 -23.950   2.694  -6.673
  525    HB3  ASP  71           HB3      ASP  71 -23.870   4.075  -7.754
  526    H    LEU  72           H        LEU  72 -21.852   6.540  -6.073
  527    HA   LEU  72           HA       LEU  72 -24.198   7.112  -4.379
  528    HG   LEU  72           HG       LEU  72 -21.496   6.212  -3.249
  529    HB2  LEU  72           HB2      LEU  72 -21.509   8.492  -4.318
  530    HB3  LEU  72           HB3      LEU  72 -22.885   8.883  -3.304
  531   HD11  LEU  72          HD11      LEU  72 -21.078   8.594  -1.453
  532   HD12  LEU  72          HD12      LEU  72 -19.922   7.959  -2.623
  533   HD13  LEU  72          HD13      LEU  72 -20.381   6.989  -1.225
  534   HD21  LEU  72          HD21      LEU  72 -23.439   7.547  -1.367
  535   HD22  LEU  72          HD22      LEU  72 -22.617   6.016  -1.063
  536   HD23  LEU  72          HD23      LEU  72 -23.760   6.153  -2.400
  537    H    GLU  73           H        GLU  73 -24.504   9.651  -4.397
  538    HA   GLU  73           HA       GLU  73 -25.061  10.343  -7.141
  539    HB2  GLU  73           HB2      GLU  73 -25.752  11.469  -4.478
  540    HB3  GLU  73           HB3      GLU  73 -25.769  12.568  -5.848
  541    HG2  GLU  73           HG2      GLU  73 -27.971  11.636  -5.396
  542    HG3  GLU  73           HG3      GLU  73 -27.377  11.182  -6.990
  543    H    GLY  74           H        GLY  74 -23.315  10.903  -8.302
  544    HA2  GLY  74           HA2      GLY  74 -22.064  12.699  -9.157
  545    HA3  GLY  74           HA3      GLY  74 -22.096  13.458  -7.572
  546    H    GLN  75           H        GLN  75 -21.320  10.532  -6.698
  547    HA   GLN  75           HA       GLN  75 -18.538  10.463  -7.476
  548    HB2  GLN  75           HB2      GLN  75 -17.727  10.579  -5.128
  549    HB3  GLN  75           HB3      GLN  75 -18.418  12.097  -5.686
  550    HG2  GLN  75           HG2      GLN  75 -20.466  11.643  -4.484
  551    HG3  GLN  75           HG3      GLN  75 -19.855  10.062  -4.001
  552   HE21  GLN  75          HE21      GLN  75 -17.855  12.931  -4.092
  553   HE22  GLN  75          HE22      GLN  75 -17.650  13.066  -2.377
  554    H    VAL  76           H        VAL  76 -17.433   8.616  -6.287
  555    HA   VAL  76           HA       VAL  76 -19.330   6.595  -5.333
  556    HB   VAL  76           HB       VAL  76 -18.149   4.819  -6.554
  557   HG11  VAL  76          HG11      VAL  76 -19.073   5.293  -8.788
  558   HG12  VAL  76          HG12      VAL  76 -19.304   6.977  -8.316
  559   HG13  VAL  76          HG13      VAL  76 -20.199   5.700  -7.494
  560   HG21  VAL  76          HG21      VAL  76 -16.646   5.371  -8.397
  561   HG22  VAL  76          HG22      VAL  76 -16.001   5.925  -6.851
  562   HG23  VAL  76          HG23      VAL  76 -16.739   7.078  -7.966
  563    H    GLU  77           H        GLU  77 -18.427   5.031  -3.971
  564    HA   GLU  77           HA       GLU  77 -15.868   5.834  -2.780
  565    HB2  GLU  77           HB2      GLU  77 -17.687   5.751  -1.188
  566    HB3  GLU  77           HB3      GLU  77 -18.135   4.137  -1.717
  567    HG2  GLU  77           HG2      GLU  77 -16.021   3.267  -0.846
  568    HG3  GLU  77           HG3      GLU  77 -15.578   4.887  -0.313
  569    H    LEU  78           H        LEU  78 -14.183   4.751  -3.555
  570    HA   LEU  78           HA       LEU  78 -14.515   1.973  -4.404
  571    HG   LEU  78           HG       LEU  78 -11.563   2.231  -6.582
  572    HB2  LEU  78           HB2      LEU  78 -13.251   3.630  -5.815
  573    HB3  LEU  78           HB3      LEU  78 -12.051   3.719  -4.543
  574   HD11  LEU  78          HD11      LEU  78 -10.385   0.570  -5.233
  575   HD12  LEU  78          HD12      LEU  78 -11.318   1.056  -3.817
  576   HD13  LEU  78          HD13      LEU  78 -10.194   2.192  -4.564
  577   HD21  LEU  78          HD21      LEU  78 -12.418  -0.057  -6.436
  578   HD22  LEU  78          HD22      LEU  78 -13.713   1.112  -6.695
  579   HD23  LEU  78          HD23      LEU  78 -13.456   0.422  -5.093
  580    H    ASP  79           H        ASP  79 -14.374   0.524  -2.859
  581    HA   ASP  79           HA       ASP  79 -12.531   1.047  -0.612
  582    HB2  ASP  79           HB2      ASP  79 -15.009   1.359  -0.103
  583    HB3  ASP  79           HB3      ASP  79 -15.190  -0.370  -0.369
  584    H    ALA  80           H        ALA  80 -10.959  -0.410  -0.658
  585    HA   ALA  80           HA       ALA  80 -11.610  -3.158  -1.490
  586    HB1  ALA  80           HB1      ALA  80  -9.236  -1.569  -2.453
  587    HB2  ALA  80           HB2      ALA  80 -10.656  -1.990  -3.410
  588    HB3  ALA  80           HB3      ALA  80  -9.576  -3.258  -2.832
  589    H    ALA  81           H        ALA  81 -10.628  -4.741  -0.396
  590    HA   ALA  81           HA       ALA  81  -8.467  -4.031   1.474
  591    HB1  ALA  81           HB1      ALA  81 -10.697  -6.019   1.903
  592    HB2  ALA  81           HB2      ALA  81 -10.513  -4.464   2.716
  593    HB3  ALA  81           HB3      ALA  81  -9.341  -5.752   2.997
  594    H    PHE  82           H        PHE  82  -6.673  -4.827   0.570
  595    HA   PHE  82           HA       PHE  82  -6.732  -7.470  -0.714
  596    HD1  PHE  82           HD1      PHE  82  -6.328  -3.772  -1.564
  597    HD2  PHE  82           HD2      PHE  82  -5.056  -7.330  -3.532
  598    HE1  PHE  82           HE1      PHE  82  -7.201  -2.905  -3.695
  599    HE2  PHE  82           HE2      PHE  82  -5.931  -6.466  -5.663
  600    HZ   PHE  82           HZ       PHE  82  -7.004  -4.252  -5.747
  601    HB2  PHE  82           HB2      PHE  82  -4.601  -5.317  -0.600
  602    HB3  PHE  82           HB3      PHE  82  -4.351  -6.893  -1.340
  603    H    THR  83           H        THR  83  -6.362  -9.157   0.566
  604    HA   THR  83           HA       THR  83  -4.937  -8.705   3.086
  605    HB   THR  83           HB       THR  83  -6.480 -11.177   2.281
  606    HG1  THR  83           HG1      THR  83  -7.882  -9.376   2.226
  607   HG21  THR  83          HG21      THR  83  -5.702 -10.050   4.977
  608   HG22  THR  83          HG22      THR  83  -4.965 -11.443   4.186
  609   HG23  THR  83          HG23      THR  83  -6.648 -11.514   4.706
  610    H    PHE  84           H        PHE  84  -2.851  -9.131   3.080
  611    HA   PHE  84           HA       PHE  84  -1.764 -11.043   1.145
  612    HD1  PHE  84           HD1      PHE  84  -0.168  -9.615  -0.740
  613    HD2  PHE  84           HD2      PHE  84  -1.473  -7.016   2.365
  614    HE1  PHE  84           HE1      PHE  84  -0.630  -7.864  -2.407
  615    HE2  PHE  84           HE2      PHE  84  -1.938  -5.260   0.704
  616    HZ   PHE  84           HZ       PHE  84  -1.517  -5.683  -1.684
  617    HB2  PHE  84           HB2      PHE  84  -0.336  -9.024   2.892
  618    HB3  PHE  84           HB3      PHE  84   0.406 -10.014   1.640
  619    H    SER  85           H        SER  85   0.181 -12.306   1.986
  620    HA   SER  85           HA       SER  85  -0.627 -13.948   4.138
  621    HG   SER  85           HG       SER  85  -0.284 -15.004   2.062
  622    HB2  SER  85           HB2      SER  85   2.114 -13.753   2.865
  623    HB3  SER  85           HB3      SER  85   1.458 -15.128   3.758
  624    H    CYS  86           H        CYS  86   1.762 -11.355   3.856
  625    HA   CYS  86           HA       CYS  86   1.994 -11.323   6.787
  626    HG   CYS  86           HG       CYS  86   5.215 -13.276   6.563
  627    HB2  CYS  86           HB2      CYS  86   4.270 -10.825   4.858
  628    HB3  CYS  86           HB3      CYS  86   4.369 -10.872   6.613
  629    H    GLN  87           H        GLN  87   2.468  -9.212   7.690
  630    HA   GLN  87           HA       GLN  87   1.166  -7.091   6.357
  631    HB2  GLN  87           HB2      GLN  87   1.288  -7.098   8.782
  632    HB3  GLN  87           HB3      GLN  87   3.044  -6.999   8.726
  633    HG2  GLN  87           HG2      GLN  87   2.957  -4.798   7.796
  634    HG3  GLN  87           HG3      GLN  87   1.212  -4.889   7.613
  635   HE21  GLN  87          HE21      GLN  87  -0.091  -4.770   9.452
  636   HE22  GLN  87          HE22      GLN  87   0.497  -4.065  10.919
  637    H    ALA  88           H        ALA  88   4.477  -8.141   6.421
  638    HA   ALA  88           HA       ALA  88   5.840  -5.933   5.494
  639    HB1  ALA  88           HB1      ALA  88   6.242  -8.800   4.643
  640    HB2  ALA  88           HB2      ALA  88   6.921  -8.047   6.086
  641    HB3  ALA  88           HB3      ALA  88   7.420  -7.499   4.485
  642    H    GLU  89           H        GLU  89   4.085  -8.362   3.596
  643    HA   GLU  89           HA       GLU  89   4.537  -7.215   1.055
  644    HB2  GLU  89           HB2      GLU  89   2.015  -8.717   1.674
  645    HB3  GLU  89           HB3      GLU  89   3.030  -8.805   0.244
  646    HG2  GLU  89           HG2      GLU  89   3.907  -9.852   2.915
  647    HG3  GLU  89           HG3      GLU  89   2.997 -10.823   1.764
  648    H    MET  90           H        MET  90   2.266  -6.580   3.594
  649    HA   MET  90           HA       MET  90   0.342  -5.198   1.994
  650    HB2  MET  90           HB2      MET  90  -0.100  -6.410   4.180
  651    HB3  MET  90           HB3      MET  90   0.675  -5.062   4.994
  652    HG2  MET  90           HG2      MET  90  -1.693  -4.707   3.189
  653    HG3  MET  90           HG3      MET  90  -1.855  -5.072   4.903
  654    HE1  MET  90           HE1      MET  90  -1.114  -3.437   6.845
  655    HE2  MET  90           HE2      MET  90  -0.246  -1.926   6.569
  656    HE3  MET  90           HE3      MET  90   0.526  -3.467   6.192
  657    H    ILE  91           H        ILE  91   2.859  -4.183   4.305
  658    HA   ILE  91           HA       ILE  91   2.305  -1.422   3.998
  659    HB   ILE  91           HB       ILE  91   4.606  -1.126   5.051
  660   HG12  ILE  91          HG12      ILE  91   4.358  -4.105   5.475
  661   HG13  ILE  91          HG13      ILE  91   5.453  -3.370   4.315
  662   HG21  ILE  91          HG21      ILE  91   2.537  -1.004   6.313
  663   HG22  ILE  91          HG22      ILE  91   3.790  -1.803   7.261
  664   HG23  ILE  91          HG23      ILE  91   2.524  -2.757   6.490
  665   HD11  ILE  91          HD11      ILE  91   6.601  -2.222   6.147
  666   HD12  ILE  91          HD12      ILE  91   6.617  -3.974   6.344
  667   HD13  ILE  91          HD13      ILE  91   5.506  -2.990   7.298
  668    H    ILE  92           H        ILE  92   4.751  -3.567   2.505
  669    HA   ILE  92           HA       ILE  92   6.075  -1.517   1.109
  670    HB   ILE  92           HB       ILE  92   6.952  -3.256  -0.377
  671   HG12  ILE  92          HG12      ILE  92   6.282  -5.683   0.557
  672   HG13  ILE  92          HG13      ILE  92   4.748  -4.849   0.782
  673   HG21  ILE  92          HG21      ILE  92   6.968  -3.966   2.539
  674   HG22  ILE  92          HG22      ILE  92   8.065  -2.864   1.706
  675   HG23  ILE  92          HG23      ILE  92   8.102  -4.589   1.339
  676   HD11  ILE  92          HD11      ILE  92   4.774  -5.966  -1.343
  677   HD12  ILE  92          HD12      ILE  92   6.270  -5.149  -1.795
  678   HD13  ILE  92          HD13      ILE  92   4.782  -4.223  -1.598
  679    H    PHE  93           H        PHE  93   3.144  -3.259   0.483
  680    HA   PHE  93           HA       PHE  93   2.749  -2.588  -2.209
  681    HD1  PHE  93           HD2      PHE  93   1.131  -3.672  -3.671
  682    HD2  PHE  93           HD1      PHE  93  -1.402  -2.390  -0.496
  683    HE1  PHE  93           HE2      PHE  93  -0.708  -3.354  -5.269
  684    HE2  PHE  93           HE1      PHE  93  -3.247  -2.070  -2.092
  685    HZ   PHE  93           HZ       PHE  93  -2.897  -2.552  -4.482
  686    HB2  PHE  93           HB2      PHE  93   1.419  -4.284  -1.056
  687    HB3  PHE  93           HB3      PHE  93   0.726  -3.055  -0.007
  688    H    GLU  94           H        GLU  94   1.645  -0.929   0.762
  689    HA   GLU  94           HA       GLU  94   0.509   1.209  -0.773
  690    HB2  GLU  94           HB2      GLU  94  -0.167   2.178   1.294
  691    HB3  GLU  94           HB3      GLU  94  -0.420   0.447   1.414
  692    HG2  GLU  94           HG2      GLU  94   0.532   0.731   3.423
  693    HG3  GLU  94           HG3      GLU  94   2.030   0.625   2.498
  694    H    LEU  95           H        LEU  95   3.542   0.627   0.867
  695    HA   LEU  95           HA       LEU  95   4.641   3.196   0.738
  696    HG   LEU  95           HG       LEU  95   5.061   1.105   2.736
  697    HB2  LEU  95           HB2      LEU  95   5.906   0.474   0.464
  698    HB3  LEU  95           HB3      LEU  95   6.849   1.951   0.456
  699   HD11  LEU  95          HD11      LEU  95   7.123   0.500   3.901
  700   HD12  LEU  95          HD12      LEU  95   8.053   0.850   2.444
  701   HD13  LEU  95          HD13      LEU  95   6.896  -0.481   2.452
  702   HD21  LEU  95          HD21      LEU  95   6.260   2.824   3.979
  703   HD22  LEU  95          HD22      LEU  95   5.448   3.516   2.574
  704   HD23  LEU  95          HD23      LEU  95   7.189   3.235   2.536
  705    H    SER  96           H        SER  96   4.644   0.592  -1.675
  706    HA   SER  96           HA       SER  96   5.936   1.959  -3.730
  707    HG   SER  96           HG       SER  96   5.422  -0.994  -2.811
  708    HB2  SER  96           HB2      SER  96   3.748  -0.122  -3.970
  709    HB3  SER  96           HB3      SER  96   4.872   0.342  -5.248
  710    H    LEU  97           H        LEU  97   2.538   1.911  -2.785
  711    HA   LEU  97           HA       LEU  97   1.510   3.428  -4.914
  712    HG   LEU  97           HG       LEU  97   0.529   1.094  -2.957
  713    HB2  LEU  97           HB2      LEU  97   0.568   3.363  -2.042
  714    HB3  LEU  97           HB3      LEU  97  -0.360   3.944  -3.413
  715   HD11  LEU  97          HD11      LEU  97  -1.870   0.660  -2.686
  716   HD12  LEU  97          HD12      LEU  97  -2.191   2.389  -2.820
  717   HD13  LEU  97          HD13      LEU  97  -1.257   1.768  -1.459
  718   HD21  LEU  97          HD21      LEU  97  -0.861   0.590  -4.915
  719   HD22  LEU  97          HD22      LEU  97   0.496   1.640  -5.323
  720   HD23  LEU  97          HD23      LEU  97  -1.125   2.316  -5.162
  721    H    ARG  98           H        ARG  98   2.711   4.391  -1.726
  722    HA   ARG  98           HA       ARG  98   2.235   7.153  -2.009
  723    HE   ARG  98           HE       ARG  98   3.766   7.506   2.194
  724    HB2  ARG  98           HB2      ARG  98   4.038   5.541  -0.232
  725    HB3  ARG  98           HB3      ARG  98   3.990   7.298  -0.148
  726    HG2  ARG  98           HG2      ARG  98   1.787   7.330   0.588
  727    HG3  ARG  98           HG3      ARG  98   1.482   5.684   0.030
  728    HD2  ARG  98           HD2      ARG  98   1.654   5.822   2.458
  729    HD3  ARG  98           HD3      ARG  98   2.901   4.794   1.765
  730   HH11  ARG  98          HH11      ARG  98   3.349   4.331   3.637
  731   HH12  ARG  98          HH12      ARG  98   4.526   4.614   4.885
  732   HH21  ARG  98          HH21      ARG  98   5.318   7.883   3.867
  733   HH22  ARG  98          HH22      ARG  98   5.636   6.622   5.018
  734    H    SER  99           H        SER  99   5.003   5.138  -2.813
  735    HA   SER  99           HA       SER  99   6.734   7.368  -3.340
  736    HG   SER  99           HG       SER  99   6.862   4.634  -1.838
  737    HB2  SER  99           HB2      SER  99   7.099   4.452  -4.056
  738    HB3  SER  99           HB3      SER  99   8.360   5.685  -4.006
  739    H    LEU 100           H        LEU 100   4.507   5.462  -5.201
  740    HA   LEU 100           HA       LEU 100   5.667   6.361  -7.720
  741    HG   LEU 100           HG       LEU 100   3.259   5.551  -9.490
  742    HB2  LEU 100           HB2      LEU 100   4.905   4.038  -7.464
  743    HB3  LEU 100           HB3      LEU 100   3.272   4.605  -7.203
  744   HD11  LEU 100          HD11      LEU 100   5.666   5.908  -9.733
  745   HD12  LEU 100          HD12      LEU 100   5.015   4.947 -11.059
  746   HD13  LEU 100          HD13      LEU 100   5.921   4.163  -9.765
  747   HD21  LEU 100          HD21      LEU 100   3.097   3.419 -10.664
  748   HD22  LEU 100          HD22      LEU 100   2.356   3.325  -9.066
  749   HD23  LEU 100          HD23      LEU 100   3.949   2.619  -9.343
  750    H    ALA 101           H        ALA 101   2.513   6.476  -6.073
  751    HA   ALA 101           HA       ALA 101   1.508   8.450  -7.924
  752    HB1  ALA 101           HB1      ALA 101   0.006   6.755  -7.021
  753    HB2  ALA 101           HB2      ALA 101  -0.524   8.367  -6.540
  754    HB3  ALA 101           HB3      ALA 101   0.318   7.334  -5.384
  755    H    LEU 102           H        LEU 102   3.805   9.356  -6.777
  756    HA   LEU 102           HA       LEU 102   3.503  11.000  -4.526
  757    HG   LEU 102           HG       LEU 102   5.849   9.437  -5.201
  758    HB2  LEU 102           HB2      LEU 102   5.308  11.150  -6.925
  759    HB3  LEU 102           HB3      LEU 102   5.355  12.378  -5.676
  760   HD11  LEU 102          HD11      LEU 102   7.616  10.390  -6.558
  761   HD12  LEU 102          HD12      LEU 102   8.194  10.114  -4.915
  762   HD13  LEU 102          HD13      LEU 102   7.774  11.745  -5.442
  763   HD21  LEU 102          HD21      LEU 102   4.962  10.597  -3.252
  764   HD22  LEU 102          HD22      LEU 102   6.190  11.849  -3.423
  765   HD23  LEU 102          HD23      LEU 102   6.666  10.200  -3.019
  766    H    GLU 103           H        GLU 103   3.536  12.060  -7.924
  767    HA   GLU 103           HA       GLU 103   2.713  13.880  -8.971
  768    HB2  GLU 103           HB2      GLU 103   0.507  13.172  -7.090
  769    HB3  GLU 103           HB3      GLU 103   0.403  14.692  -7.966
  770    HG2  GLU 103           HG2      GLU 103  -0.797  12.959  -9.143
  771    HG3  GLU 103           HG3      GLU 103   0.593  13.485 -10.085
  772    H    HIS 104           H        HIS 104   1.514  14.741  -5.745
  773    HA   HIS 104           HA       HIS 104   3.638  16.637  -5.350
  774    HD1  HIS 104           HD1      HIS 104  -0.091  18.897  -4.106
  775    HD2  HIS 104           HD2      HIS 104  -0.193  16.560  -7.550
  776    HE1  HIS 104           HE1      HIS 104  -2.532  18.547  -4.622
  777    HE2  HIS 104           HE2      HIS 104  -2.572  17.201  -6.750
  778    HB2  HIS 104           HB2      HIS 104   2.162  18.617  -5.142
  779    HB3  HIS 104           HB3      HIS 104   2.228  17.989  -6.780
  780    H    HIS 105           H        HIS 105   3.360  14.609  -3.776
  781    HA   HIS 105           HA       HIS 105   1.801  15.523  -1.453
  782    HD1  HIS 105           HD1      HIS 105   1.112  11.405  -3.297
  783    HD2  HIS 105           HD2      HIS 105  -0.561  14.689  -1.378
  784    HE1  HIS 105           HE1      HIS 105  -1.330  11.361  -3.892
  785    HE2  HIS 105           HE2      HIS 105  -2.357  13.183  -2.480
  786    HB2  HIS 105           HB2      HIS 105   2.816  12.766  -2.160
  787    HB3  HIS 105           HB3      HIS 105   2.140  13.175  -0.586
  788    H    HIS 106           H        HIS 106   3.121  16.924  -0.493
  789    HA   HIS 106           HA       HIS 106   5.810  15.981   0.279
  790    HD1  HIS 106           HD1      HIS 106   6.040  20.463   1.173
  791    HD2  HIS 106           HD2      HIS 106   8.390  17.148   0.265
  792    HE1  HIS 106           HE1      HIS 106   8.295  20.925   2.185
  793    HE2  HIS 106           HE2      HIS 106   9.724  18.944   1.572
  794    HB2  HIS 106           HB2      HIS 106   5.857  17.897  -1.255
  795    HB3  HIS 106           HB3      HIS 106   4.806  18.805  -0.178
  796    H    HIS 107           H        HIS 107   2.741  16.654   1.390
  797    HA   HIS 107           HA       HIS 107   3.399  17.872   3.902
  798    HD1  HIS 107           HD1      HIS 107  -0.435  18.431   1.554
  799    HD2  HIS 107           HD2      HIS 107   2.360  20.100   4.151
  800    HE1  HIS 107           HE1      HIS 107  -0.592  20.923   1.219
  801    HE2  HIS 107           HE2      HIS 107   1.045  21.921   2.864
  802    HB2  HIS 107           HB2      HIS 107   0.866  16.704   2.771
  803    HB3  HIS 107           HB3      HIS 107   0.962  17.252   4.439
  804    H    HIS 108           H        HIS 108   3.765  14.747   2.812
  805    HA   HIS 108           HA       HIS 108   3.874  13.759   5.566
  806    HD1  HIS 108           HD1      HIS 108   4.076  10.133   4.399
  807    HD2  HIS 108           HD2      HIS 108   1.130  11.789   6.830
  808    HE1  HIS 108           HE1      HIS 108   3.673   8.451   6.219
  809    HE2  HIS 108           HE2      HIS 108   1.796   9.406   7.601
  810    HB2  HIS 108           HB2      HIS 108   1.675  13.087   4.503
  811    HB3  HIS 108           HB3      HIS 108   2.602  12.159   3.331
  812    H    HIS 109           H        HIS 109   5.559  12.394   5.942
  813    HA   HIS 109           HA       HIS 109   7.191  11.641   3.607
  814    HD1  HIS 109           HD1      HIS 109  10.738  12.793   4.489
  815    HD2  HIS 109           HD2      HIS 109   7.144  14.766   5.215
  816    HE1  HIS 109           HE1      HIS 109  11.131  15.190   3.832
  817    HE2  HIS 109           HE2      HIS 109   8.966  16.385   4.355
  818    HB2  HIS 109           HB2      HIS 109   7.945  12.084   6.501
  819    HB3  HIS 109           HB3      HIS 109   9.009  11.261   5.366
  Start of MODEL   17
    1    HA   MET   1           HA       MET   1  36.690   4.385  34.478
    2    H1   MET   1           H1       MET   1  35.996   4.670  36.758
    3    H2   MET   1           H2       MET   1  34.368   4.549  36.306
    4    H3   MET   1           H3       MET   1  35.299   5.855  35.765
    5    HB2  MET   1           HB2      MET   1  34.746   2.263  35.418
    6    HB3  MET   1           HB3      MET   1  35.924   2.040  34.135
    7    HG2  MET   1           HG2      MET   1  36.885   1.059  36.015
    8    HG3  MET   1           HG3      MET   1  37.690   2.619  35.857
    9    HE1  MET   1           HE1      MET   1  37.953   1.005  38.489
   10    HE2  MET   1           HE2      MET   1  37.621   2.224  39.720
   11    HE3  MET   1           HE3      MET   1  38.603   2.633  38.311
   12    H    ALA   2           H        ALA   2  36.202   5.110  32.517
   13    HA   ALA   2           HA       ALA   2  33.552   4.588  31.414
   14    HB1  ALA   2           HB1      ALA   2  33.258   6.886  30.662
   15    HB2  ALA   2           HB2      ALA   2  34.760   7.352  31.458
   16    HB3  ALA   2           HB3      ALA   2  33.382   6.819  32.420
   17    H    MET   3           H        MET   3  34.247   3.283  29.828
   18    HA   MET   3           HA       MET   3  36.416   4.215  28.084
   19    HB2  MET   3           HB2      MET   3  35.126   1.503  28.394
   20    HB3  MET   3           HB3      MET   3  36.280   1.878  27.127
   21    HG2  MET   3           HG2      MET   3  37.485   0.783  28.821
   22    HG3  MET   3           HG3      MET   3  37.910   2.489  28.938
   23    HE1  MET   3           HE1      MET   3  38.469   0.298  31.238
   24    HE2  MET   3           HE2      MET   3  38.064   1.256  32.662
   25    HE3  MET   3           HE3      MET   3  38.957   1.991  31.330
   26    H    LYS   4           H        LYS   4  33.354   2.454  27.652
   27    HA   LYS   4           HA       LYS   4  31.639   2.664  26.198
   28    HB2  LYS   4           HB2      LYS   4  31.461   4.931  27.071
   29    HB3  LYS   4           HB3      LYS   4  32.656   5.494  25.911
   30    HG2  LYS   4           HG2      LYS   4  31.186   5.261  24.113
   31    HG3  LYS   4           HG3      LYS   4  30.094   4.216  25.026
   32    HD2  LYS   4           HD2      LYS   4  29.473   6.091  26.452
   33    HD3  LYS   4           HD3      LYS   4  30.602   7.137  25.590
   34    HE2  LYS   4           HE2      LYS   4  28.378   5.706  24.171
   35    HE3  LYS   4           HE3      LYS   4  28.122   7.261  24.961
   36    HZ1  LYS   4           HZ1      LYS   4  29.813   8.235  23.573
   37    HZ2  LYS   4           HZ2      LYS   4  28.636   7.497  22.601
   38    HZ3  LYS   4           HZ3      LYS   4  30.136   6.738  22.839
   39    H    ASP   5           H        ASP   5  32.024   1.300  24.596
   40    HA   ASP   5           HA       ASP   5  33.805   2.162  22.415
   41    HB2  ASP   5           HB2      ASP   5  34.477   0.100  23.585
   42    HB3  ASP   5           HB3      ASP   5  32.925  -0.629  23.194
   43    H    VAL   6           H        VAL   6  33.167   1.608  20.216
   44    HA   VAL   6           HA       VAL   6  30.289   1.203  19.825
   45    HB   VAL   6           HB       VAL   6  30.718   3.631  19.707
   46   HG11  VAL   6          HG11      VAL   6  32.046   4.565  17.865
   47   HG12  VAL   6          HG12      VAL   6  32.568   2.938  17.430
   48   HG13  VAL   6          HG13      VAL   6  33.029   3.626  18.987
   49   HG21  VAL   6          HG21      VAL   6  28.929   2.694  18.366
   50   HG22  VAL   6          HG22      VAL   6  30.056   2.372  17.049
   51   HG23  VAL   6          HG23      VAL   6  29.693   4.036  17.513
   52    H    VAL   7           H        VAL   7  29.744   0.144  17.902
   53    HA   VAL   7           HA       VAL   7  32.036  -1.043  16.479
   54    HB   VAL   7           HB       VAL   7  29.256  -2.206  16.748
   55   HG11  VAL   7          HG11      VAL   7  31.823  -3.369  15.672
   56   HG12  VAL   7          HG12      VAL   7  30.393  -2.936  14.736
   57   HG13  VAL   7          HG13      VAL   7  30.319  -4.261  15.898
   58   HG21  VAL   7          HG21      VAL   7  31.787  -2.919  18.225
   59   HG22  VAL   7          HG22      VAL   7  30.271  -3.817  18.300
   60   HG23  VAL   7          HG23      VAL   7  30.350  -2.166  18.917
   61    H    ASP   8           H        ASP   8  32.320  -0.190  14.528
   62    HA   ASP   8           HA       ASP   8  30.072  -0.189  12.693
   63    HB2  ASP   8           HB2      ASP   8  30.112   2.133  13.653
   64    HB3  ASP   8           HB3      ASP   8  31.734   2.322  12.994
   65    H    LYS   9           H        LYS   9  30.838  -1.471  11.156
   66    HA   LYS   9           HA       LYS   9  33.680  -1.394  10.500
   67    HB2  LYS   9           HB2      LYS   9  32.453  -3.568  10.836
   68    HB3  LYS   9           HB3      LYS   9  31.539  -3.208   9.378
   69    HG2  LYS   9           HG2      LYS   9  33.320  -4.722   8.849
   70    HG3  LYS   9           HG3      LYS   9  33.650  -3.154   8.107
   71    HD2  LYS   9           HD2      LYS   9  35.153  -2.605   9.976
   72    HD3  LYS   9           HD3      LYS   9  34.848  -4.196  10.672
   73    HE2  LYS   9           HE2      LYS   9  36.126  -3.624   8.005
   74    HE3  LYS   9           HE3      LYS   9  36.948  -4.183   9.460
   75    HZ1  LYS   9           HZ1      LYS   9  34.953  -5.670   7.841
   76    HZ2  LYS   9           HZ2      LYS   9  35.499  -6.187   9.362
   77    HZ3  LYS   9           HZ3      LYS   9  36.592  -6.051   8.070
   78    H    CYS  10           H        CYS  10  30.631  -1.472   8.644
   79    HA   CYS  10           HA       CYS  10  31.294   0.855   7.151
   80    HG   CYS  10           HG       CYS  10  31.254   1.430   4.626
   81    HB2  CYS  10           HB2      CYS  10  32.808  -0.802   6.059
   82    HB3  CYS  10           HB3      CYS  10  31.397  -1.766   5.637
   83    H    SER  11           H        SER  11  29.472   1.740   6.367
   84    HA   SER  11           HA       SER  11  26.997   0.249   6.762
   85    HG   SER  11           HG       SER  11  25.412   3.197   5.799
   86    HB2  SER  11           HB2      SER  11  27.175   2.496   7.743
   87    HB3  SER  11           HB3      SER  11  27.475   3.181   6.148
   88    H    THR  12           H        THR  12  26.553  -1.026   5.065
   89    HA   THR  12           HA       THR  12  26.704   0.147   2.377
   90    HB   THR  12           HB       THR  12  27.999  -1.862   2.490
   91    HG1  THR  12           HG1      THR  12  27.012  -1.905   0.561
   92   HG21  THR  12          HG21      THR  12  27.055  -4.032   3.153
   93   HG22  THR  12          HG22      THR  12  25.548  -3.232   3.599
   94   HG23  THR  12          HG23      THR  12  27.033  -2.873   4.482
   95    H    LYS  13           H        LYS  13  24.859   0.907   1.613
   96    HA   LYS  13           HA       LYS  13  22.388  -0.549   1.854
   97    HB2  LYS  13           HB2      LYS  13  22.589   0.611   4.060
   98    HB3  LYS  13           HB3      LYS  13  22.619   2.146   3.209
   99    HG2  LYS  13           HG2      LYS  13  20.368   1.826   2.435
  100    HG3  LYS  13           HG3      LYS  13  20.333   0.189   3.097
  101    HD2  LYS  13           HD2      LYS  13  20.705   2.696   4.734
  102    HD3  LYS  13           HD3      LYS  13  19.169   1.851   4.528
  103    HE2  LYS  13           HE2      LYS  13  20.020  -0.101   5.614
  104    HE3  LYS  13           HE3      LYS  13  21.655   0.557   5.635
  105    HZ1  LYS  13           HZ1      LYS  13  20.951   2.241   7.181
  106    HZ2  LYS  13           HZ2      LYS  13  20.535   0.717   7.791
  107    HZ3  LYS  13           HZ3      LYS  13  19.340   1.712   7.102
  108    H    GLY  14           H        GLY  14  20.668   0.449   0.579
  109    HA2  GLY  14           HA2      GLY  14  20.055   2.339  -0.886
  110    HA3  GLY  14           HA3      GLY  14  21.745   2.402  -1.368
  111    H    CYS  15           H        CYS  15  20.774  -0.770  -0.963
  112    HA   CYS  15           HA       CYS  15  20.509  -1.080  -3.869
  113    HG   CYS  15           HG       CYS  15  20.566  -3.340  -5.065
  114    HB2  CYS  15           HB2      CYS  15  22.322  -2.310  -2.562
  115    HB3  CYS  15           HB3      CYS  15  21.026  -3.265  -1.853
  116    H    ALA  16           H        ALA  16  18.309  -0.138  -2.417
  117    HA   ALA  16           HA       ALA  16  16.365  -2.156  -3.100
  118    HB1  ALA  16           HB1      ALA  16  15.245  -2.150  -0.931
  119    HB2  ALA  16           HB2      ALA  16  16.514  -1.120  -0.268
  120    HB3  ALA  16           HB3      ALA  16  16.892  -2.762  -0.789
  121    H    ILE  17           H        ILE  17  14.407  -1.301  -3.635
  122    HA   ILE  17           HA       ILE  17  14.214   1.585  -3.766
  123    HB   ILE  17           HB       ILE  17  13.425   0.377  -5.696
  124   HG12  ILE  17          HG12      ILE  17  11.053   1.490  -4.185
  125   HG13  ILE  17          HG13      ILE  17  12.238   2.456  -5.057
  126   HG21  ILE  17          HG21      ILE  17  11.492  -1.135  -5.614
  127   HG22  ILE  17          HG22      ILE  17  11.482  -1.010  -3.855
  128   HG23  ILE  17          HG23      ILE  17  12.858  -1.746  -4.679
  129   HD11  ILE  17          HD11      ILE  17  11.560   1.401  -7.150
  130   HD12  ILE  17          HD12      ILE  17  10.192   2.167  -6.341
  131   HD13  ILE  17          HD13      ILE  17  10.387   0.416  -6.273
  132    H    ASP  18           H        ASP  18  13.292   2.800  -2.270
  133    HA   ASP  18           HA       ASP  18  11.366   1.618  -0.417
  134    HB2  ASP  18           HB2      ASP  18  13.842   1.433   0.395
  135    HB3  ASP  18           HB3      ASP  18  13.701   3.163   0.678
  136    H    ILE  19           H        ILE  19  10.493   3.332   1.069
  137    HA   ILE  19           HA       ILE  19  10.008   5.762  -0.492
  138    HB   ILE  19           HB       ILE  19   8.585   4.804   2.000
  139   HG12  ILE  19          HG12      ILE  19   8.281   3.195   0.189
  140   HG13  ILE  19          HG13      ILE  19   6.786   4.075   0.477
  141   HG21  ILE  19          HG21      ILE  19   7.801   6.895  -0.028
  142   HG22  ILE  19          HG22      ILE  19   8.379   7.208   1.609
  143   HG23  ILE  19          HG23      ILE  19   6.839   6.384   1.359
  144   HD11  ILE  19          HD11      ILE  19   7.199   3.760  -1.896
  145   HD12  ILE  19          HD12      ILE  19   8.741   4.604  -1.752
  146   HD13  ILE  19          HD13      ILE  19   7.231   5.473  -1.473
  147    H    GLY  20           H        GLY  20  11.594   4.606   2.344
  148    HA2  GLY  20           HA2      GLY  20  13.279   5.881   3.446
  149    HA3  GLY  20           HA3      GLY  20  12.447   7.355   2.967
  150    H    THR  21           H        THR  21   9.881   5.959   3.783
  151    HA   THR  21           HA       THR  21  10.172   6.081   6.692
  152    HB   THR  21           HB       THR  21   9.381   8.295   5.968
  153    HG1  THR  21           HG1      THR  21   8.376   8.116   7.811
  154   HG21  THR  21          HG21      THR  21   7.035   6.802   4.792
  155   HG22  THR  21          HG22      THR  21   8.273   7.673   3.887
  156   HG23  THR  21          HG23      THR  21   7.168   8.555   4.941
  157    H    VAL  22           H        VAL  22   8.778   4.754   7.814
  158    HA   VAL  22           HA       VAL  22   6.984   3.051   6.223
  159    HB   VAL  22           HB       VAL  22   8.839   2.056   8.401
  160   HG11  VAL  22          HG11      VAL  22   6.750   0.819   8.321
  161   HG12  VAL  22          HG12      VAL  22   8.081  -0.175   7.725
  162   HG13  VAL  22          HG13      VAL  22   6.951   0.560   6.588
  163   HG21  VAL  22          HG21      VAL  22   9.991   0.832   6.602
  164   HG22  VAL  22          HG22      VAL  22  10.115   2.580   6.411
  165   HG23  VAL  22          HG23      VAL  22   8.986   1.662   5.412
  166    H    ILE  23           H        ILE  23   5.034   2.691   7.146
  167    HA   ILE  23           HA       ILE  23   4.173   4.154   9.382
  168    HB   ILE  23           HB       ILE  23   2.611   3.397   7.661
  169   HG12  ILE  23          HG12      ILE  23   1.966   2.196  10.364
  170   HG13  ILE  23          HG13      ILE  23   1.744   3.884   9.917
  171   HG21  ILE  23          HG21      ILE  23   3.606   1.251   7.136
  172   HG22  ILE  23          HG22      ILE  23   1.898   1.054   7.530
  173   HG23  ILE  23          HG23      ILE  23   3.132   0.624   8.715
  174   HD11  ILE  23          HD11      ILE  23  -0.352   2.667   9.855
  175   HD12  ILE  23          HD12      ILE  23   0.326   1.529   8.690
  176   HD13  ILE  23          HD13      ILE  23   0.099   3.221   8.244
  177    H    ASP  24           H        ASP  24   3.713   3.545  11.494
  178    HA   ASP  24           HA       ASP  24   5.577   2.002  12.822
  179    HB2  ASP  24           HB2      ASP  24   2.819   2.895  13.629
  180    HB3  ASP  24           HB3      ASP  24   3.857   1.993  14.725
  181    H    ASN  25           H        ASN  25   2.139   1.063  12.697
  182    HA   ASN  25           HA       ASN  25   2.660  -1.536  11.700
  183    HB2  ASN  25           HB2      ASN  25   2.181  -2.894  13.640
  184    HB3  ASN  25           HB3      ASN  25   3.530  -1.837  14.026
  185   HD21  ASN  25          HD21      ASN  25   3.281  -0.250  15.559
  186   HD22  ASN  25          HD22      ASN  25   1.897  -0.158  16.592
  187    H    ASP  26           H        ASP  26   0.682  -2.941  11.948
  188    HA   ASP  26           HA       ASP  26  -1.842  -1.901  12.557
  189    HB2  ASP  26           HB2      ASP  26  -1.061  -0.583  10.392
  190    HB3  ASP  26           HB3      ASP  26  -1.498  -2.080   9.576
  191    H    ASN  27           H        ASN  27  -3.285  -3.374  10.547
  192    HA   ASN  27           HA       ASN  27  -2.587  -6.057  11.433
  193    HB2  ASN  27           HB2      ASN  27  -4.770  -6.699  10.330
  194    HB3  ASN  27           HB3      ASN  27  -4.893  -5.598  11.691
  195   HD21  ASN  27          HD21      ASN  27  -3.887  -4.566   8.484
  196   HD22  ASN  27          HD22      ASN  27  -5.311  -3.653   8.143
  197    H    CYS  28           H        CYS  28  -3.508  -7.651   9.388
  198    HA   CYS  28           HA       CYS  28  -1.223  -7.376   7.595
  199    HG   CYS  28           HG       CYS  28  -0.904 -11.094   9.233
  200    HB2  CYS  28           HB2      CYS  28  -3.114  -9.705   7.987
  201    HB3  CYS  28           HB3      CYS  28  -1.636  -9.724   7.030
  202    H    THR  29           H        THR  29  -4.647  -7.071   7.552
  203    HA   THR  29           HA       THR  29  -4.869  -7.362   4.680
  204    HB   THR  29           HB       THR  29  -6.931  -6.369   6.662
  205    HG1  THR  29           HG1      THR  29  -6.438  -8.481   7.184
  206   HG21  THR  29          HG21      THR  29  -8.553  -6.952   4.927
  207   HG22  THR  29          HG22      THR  29  -7.241  -7.432   3.850
  208   HG23  THR  29          HG23      THR  29  -7.412  -5.745   4.337
  209    H    SER  30           H        SER  30  -4.649  -5.758   3.246
  210    HA   SER  30           HA       SER  30  -4.250  -3.049   4.279
  211    HG   SER  30           HG       SER  30  -2.264  -2.016   2.621
  212    HB2  SER  30           HB2      SER  30  -2.522  -4.118   2.778
  213    HB3  SER  30           HB3      SER  30  -3.719  -4.087   1.485
  214    H    LYS  31           H        LYS  31  -6.151  -2.041   4.460
  215    HA   LYS  31           HA       LYS  31  -7.962  -2.146   2.161
  216    HB2  LYS  31           HB2      LYS  31  -8.491  -1.617   5.068
  217    HB3  LYS  31           HB3      LYS  31  -9.633  -1.130   3.823
  218    HG2  LYS  31           HG2      LYS  31  -9.603  -3.534   3.040
  219    HG3  LYS  31           HG3      LYS  31  -8.744  -3.908   4.537
  220    HD2  LYS  31           HD2      LYS  31 -11.379  -2.459   4.468
  221    HD3  LYS  31           HD3      LYS  31 -11.244  -4.210   4.585
  222    HE2  LYS  31           HE2      LYS  31 -10.071  -4.045   6.669
  223    HE3  LYS  31           HE3      LYS  31  -9.957  -2.293   6.515
  224    HZ1  LYS  31           HZ1      LYS  31 -11.723  -3.098   8.058
  225    HZ2  LYS  31           HZ2      LYS  31 -12.539  -3.747   6.720
  226    HZ3  LYS  31           HZ3      LYS  31 -12.283  -2.073   6.827
  227    H    PHE  32           H        PHE  32  -8.860  -0.297   1.355
  228    HA   PHE  32           HA       PHE  32  -7.936   2.295   2.264
  229    HD1  PHE  32           HD1      PHE  32  -6.039   3.947   1.801
  230    HD2  PHE  32           HD2      PHE  32  -7.536   2.944  -2.055
  231    HE1  PHE  32           HE1      PHE  32  -5.686   6.266   1.068
  232    HE2  PHE  32           HE2      PHE  32  -7.187   5.265  -2.795
  233    HZ   PHE  32           HZ       PHE  32  -6.264   6.925  -1.234
  234    HB2  PHE  32           HB2      PHE  32  -6.094   1.522   0.801
  235    HB3  PHE  32           HB3      PHE  32  -7.245   1.278  -0.506
  236    H    SER  33           H        SER  33  -9.591   3.663   2.083
  237    HA   SER  33           HA       SER  33 -11.651   3.113   0.045
  238    HG   SER  33           HG       SER  33 -12.953   1.647   2.020
  239    HB2  SER  33           HB2      SER  33 -12.151   4.222   2.819
  240    HB3  SER  33           HB3      SER  33 -13.362   3.732   1.632
  241    H    ARG  34           H        ARG  34 -11.497   4.711  -1.429
  242    HA   ARG  34           HA       ARG  34 -11.139   7.457  -0.422
  243    HE   ARG  34           HE       ARG  34  -8.717   9.719  -4.904
  244    HB2  ARG  34           HB2      ARG  34  -9.026   6.791  -1.356
  245    HB3  ARG  34           HB3      ARG  34  -9.803   6.188  -2.814
  246    HG2  ARG  34           HG2      ARG  34 -10.378   8.407  -3.502
  247    HG3  ARG  34           HG3      ARG  34  -9.835   9.079  -1.963
  248    HD2  ARG  34           HD2      ARG  34  -7.563   8.544  -2.454
  249    HD3  ARG  34           HD3      ARG  34  -8.031   7.615  -3.878
  250   HH11  ARG  34          HH11      ARG  34  -6.705   9.974  -2.043
  251   HH12  ARG  34          HH12      ARG  34  -5.998  11.490  -2.523
  252   HH21  ARG  34          HH21      ARG  34  -7.853  11.732  -5.498
  253   HH22  ARG  34          HH22      ARG  34  -6.677  12.509  -4.471
  254    H    PHE  35           H        PHE  35 -12.240   9.064  -1.443
  255    HA   PHE  35           HA       PHE  35 -14.502   8.289  -3.064
  256    HD1  PHE  35           HD2      PHE  35 -16.626   9.094  -1.475
  257    HD2  PHE  35           HD1      PHE  35 -13.157  11.065   0.001
  258    HE1  PHE  35           HE2      PHE  35 -17.435   8.784   0.827
  259    HE2  PHE  35           HE1      PHE  35 -13.959  10.760   2.308
  260    HZ   PHE  35           HZ       PHE  35 -16.102   9.619   2.722
  261    HB2  PHE  35           HB2      PHE  35 -13.601  11.072  -2.281
  262    HB3  PHE  35           HB3      PHE  35 -15.181  10.614  -2.902
  263    H    PHE  36           H        PHE  36 -14.664   8.487  -5.202
  264    HA   PHE  36           HA       PHE  36 -12.562   9.989  -6.613
  265    HD1  PHE  36           HD2      PHE  36 -10.597   8.655  -8.301
  266    HD2  PHE  36           HD1      PHE  36 -12.821   6.095  -5.735
  267    HE1  PHE  36           HE2      PHE  36  -8.511   7.568  -7.588
  268    HE2  PHE  36           HE1      PHE  36 -10.738   5.004  -5.015
  269    HZ   PHE  36           HZ       PHE  36  -8.580   5.741  -5.942
  270    HB2  PHE  36           HB2      PHE  36 -13.922   7.411  -7.394
  271    HB3  PHE  36           HB3      PHE  36 -13.014   8.392  -8.540
  272    H    ALA  37           H        ALA  37 -13.226  10.938  -8.648
  273    HA   ALA  37           HA       ALA  37 -15.618  12.410  -8.387
  274    HB1  ALA  37           HB1      ALA  37 -15.052  13.363 -10.551
  275    HB2  ALA  37           HB2      ALA  37 -13.860  12.091 -10.815
  276    HB3  ALA  37           HB3      ALA  37 -13.620  13.269  -9.526
  277    H    THR  38           H        THR  38 -14.684   9.811 -10.631
  278    HA   THR  38           HA       THR  38 -17.553   9.343 -11.106
  279    HB   THR  38           HB       THR  38 -16.922   8.501 -13.379
  280    HG1  THR  38           HG1      THR  38 -14.713   9.661 -13.926
  281   HG21  THR  38          HG21      THR  38 -16.614  10.729 -14.398
  282   HG22  THR  38          HG22      THR  38 -16.253  11.394 -12.805
  283   HG23  THR  38          HG23      THR  38 -17.855  10.737 -13.146
  284    H    ARG  39           H        ARG  39 -18.085   7.091 -11.629
  285    HA   ARG  39           HA       ARG  39 -16.796   5.234  -9.947
  286    HE   ARG  39           HE       ARG  39 -18.912   0.686 -12.380
  287    HB2  ARG  39           HB2      ARG  39 -19.058   4.808 -10.375
  288    HB3  ARG  39           HB3      ARG  39 -18.871   4.971 -12.107
  289    HG2  ARG  39           HG2      ARG  39 -17.699   2.853 -12.210
  290    HG3  ARG  39           HG3      ARG  39 -17.770   2.710 -10.452
  291    HD2  ARG  39           HD2      ARG  39 -20.186   2.588 -10.524
  292    HD3  ARG  39           HD3      ARG  39 -20.176   2.861 -12.267
  293   HH11  ARG  39          HH11      ARG  39 -21.174   1.403  -9.785
  294   HH12  ARG  39          HH12      ARG  39 -21.543  -0.278  -9.492
  295   HH21  ARG  39          HH21      ARG  39 -19.408  -1.508 -11.978
  296   HH22  ARG  39          HH22      ARG  39 -20.557  -1.916 -10.740
  297    H    GLU  40           H        GLU  40 -16.298   6.153 -13.245
  298    HA   GLU  40           HA       GLU  40 -14.710   4.042 -14.167
  299    HB2  GLU  40           HB2      GLU  40 -14.508   7.004 -14.731
  300    HB3  GLU  40           HB3      GLU  40 -13.699   5.748 -15.653
  301    HG2  GLU  40           HG2      GLU  40 -15.824   4.840 -16.341
  302    HG3  GLU  40           HG3      GLU  40 -16.676   6.021 -15.349
  303    H    GLU  41           H        GLU  41 -13.831   7.024 -12.503
  304    HA   GLU  41           HA       GLU  41 -11.096   6.736 -12.286
  305    HB2  GLU  41           HB2      GLU  41 -13.136   7.960 -10.441
  306    HB3  GLU  41           HB3      GLU  41 -11.420   8.028 -10.080
  307    HG2  GLU  41           HG2      GLU  41 -12.648   9.071 -12.614
  308    HG3  GLU  41           HG3      GLU  41 -12.349  10.052 -11.179
  309    H    ALA  42           H        ALA  42 -13.617   5.121 -10.501
  310    HA   ALA  42           HA       ALA  42 -11.911   4.214  -8.380
  311    HB1  ALA  42           HB1      ALA  42 -14.673   3.309  -9.172
  312    HB2  ALA  42           HB2      ALA  42 -14.286   4.570  -8.001
  313    HB3  ALA  42           HB3      ALA  42 -13.840   2.897  -7.671
  314    H    GLU  43           H        GLU  43 -13.503   2.586 -11.126
  315    HA   GLU  43           HA       GLU  43 -12.320   0.067 -10.602
  316    HB2  GLU  43           HB2      GLU  43 -13.077  -0.490 -12.927
  317    HB3  GLU  43           HB3      GLU  43 -14.335   0.109 -11.857
  318    HG2  GLU  43           HG2      GLU  43 -14.126   2.330 -12.886
  319    HG3  GLU  43           HG3      GLU  43 -12.910   1.686 -13.988
  320    H    SER  44           H        SER  44 -11.327   2.809 -12.556
  321    HA   SER  44           HA       SER  44  -9.207   1.479 -13.897
  322    HG   SER  44           HG       SER  44 -11.231   4.025 -14.449
  323    HB2  SER  44           HB2      SER  44  -9.476   4.428 -13.264
  324    HB3  SER  44           HB3      SER  44  -8.443   3.711 -14.502
  325    H    PHE  45           H        PHE  45  -9.535   3.008 -10.777
  326    HA   PHE  45           HA       PHE  45  -6.754   3.154 -10.173
  327    HD1  PHE  45           HD2      PHE  45  -5.943   4.938  -8.469
  328    HD2  PHE  45           HD1      PHE  45  -8.473   2.346  -6.236
  329    HE1  PHE  45           HE2      PHE  45  -4.430   5.131  -6.539
  330    HE2  PHE  45           HE1      PHE  45  -6.966   2.535  -4.301
  331    HZ   PHE  45           HZ       PHE  45  -4.940   3.928  -4.451
  332    HB2  PHE  45           HB2      PHE  45  -8.450   4.519  -9.005
  333    HB3  PHE  45           HB3      PHE  45  -9.151   3.058  -8.321
  334    H    MET  46           H        MET  46  -9.318   0.820  -9.549
  335    HA   MET  46           HA       MET  46  -7.875  -0.939  -7.904
  336    HB2  MET  46           HB2      MET  46 -10.316  -0.993  -8.115
  337    HB3  MET  46           HB3      MET  46 -10.171  -1.521  -9.785
  338    HG2  MET  46           HG2      MET  46 -10.735  -3.355  -8.266
  339    HG3  MET  46           HG3      MET  46  -9.192  -3.611  -9.079
  340    HE1  MET  46           HE1      MET  46  -9.468  -2.126  -4.719
  341    HE2  MET  46           HE2      MET  46 -10.900  -2.475  -5.689
  342    HE3  MET  46           HE3      MET  46  -9.839  -1.138  -6.132
  343    H    THR  47           H        THR  47  -7.782  -0.444 -11.320
  344    HA   THR  47           HA       THR  47  -6.919  -2.947 -12.220
  345    HB   THR  47           HB       THR  47  -6.032  -0.279 -13.331
  346    HG1  THR  47           HG1      THR  47  -8.501  -1.156 -13.055
  347   HG21  THR  47          HG21      THR  47  -4.852  -2.212 -14.258
  348   HG22  THR  47          HG22      THR  47  -5.932  -1.502 -15.459
  349   HG23  THR  47          HG23      THR  47  -6.392  -2.986 -14.626
  350    H    LYS  48           H        LYS  48  -4.976  -0.141 -11.136
  351    HA   LYS  48           HA       LYS  48  -2.512  -1.518 -11.518
  352    HB2  LYS  48           HB2      LYS  48  -1.449   0.360 -10.387
  353    HB3  LYS  48           HB3      LYS  48  -2.572   0.908 -11.622
  354    HG2  LYS  48           HG2      LYS  48  -4.058   1.752 -10.090
  355    HG3  LYS  48           HG3      LYS  48  -3.477   0.704  -8.792
  356    HD2  LYS  48           HD2      LYS  48  -2.745   2.938  -8.351
  357    HD3  LYS  48           HD3      LYS  48  -1.343   1.978  -8.797
  358    HE2  LYS  48           HE2      LYS  48  -1.071   4.003  -9.946
  359    HE3  LYS  48           HE3      LYS  48  -1.683   2.877 -11.156
  360    HZ1  LYS  48           HZ1      LYS  48  -3.360   4.822  -9.663
  361    HZ2  LYS  48           HZ2      LYS  48  -3.863   3.827 -10.947
  362    HZ3  LYS  48           HZ3      LYS  48  -2.754   5.078 -11.223
  363    H    LEU  49           H        LEU  49  -4.744  -1.202  -8.879
  364    HA   LEU  49           HA       LEU  49  -3.139  -2.009  -6.729
  365    HG   LEU  49           HG       LEU  49  -6.431  -0.744  -5.511
  366    HB2  LEU  49           HB2      LEU  49  -6.064  -2.151  -7.344
  367    HB3  LEU  49           HB3      LEU  49  -5.460  -3.044  -5.965
  368   HD11  LEU  49          HD11      LEU  49  -4.745  -0.210  -3.832
  369   HD12  LEU  49          HD12      LEU  49  -3.618  -1.318  -4.615
  370   HD13  LEU  49          HD13      LEU  49  -5.098  -1.937  -3.882
  371   HD21  LEU  49          HD21      LEU  49  -5.447   0.483  -7.350
  372   HD22  LEU  49          HD22      LEU  49  -3.826   0.120  -6.760
  373   HD23  LEU  49          HD23      LEU  49  -4.894   1.157  -5.816
  374    H    LYS  50           H        LYS  50  -5.002  -3.912  -9.057
  375    HA   LYS  50           HA       LYS  50  -4.492  -6.451  -8.001
  376    HB2  LYS  50           HB2      LYS  50  -5.487  -5.335 -10.505
  377    HB3  LYS  50           HB3      LYS  50  -4.606  -6.832 -10.743
  378    HG2  LYS  50           HG2      LYS  50  -6.903  -7.367 -10.489
  379    HG3  LYS  50           HG3      LYS  50  -6.075  -7.882  -9.020
  380    HD2  LYS  50           HD2      LYS  50  -6.837  -5.888  -7.864
  381    HD3  LYS  50           HD3      LYS  50  -7.609  -5.306  -9.341
  382    HE2  LYS  50           HE2      LYS  50  -8.316  -7.802  -7.808
  383    HE3  LYS  50           HE3      LYS  50  -9.248  -6.309  -7.857
  384    HZ1  LYS  50           HZ1      LYS  50  -8.729  -8.148 -10.132
  385    HZ2  LYS  50           HZ2      LYS  50  -9.519  -6.654 -10.272
  386    HZ3  LYS  50           HZ3      LYS  50 -10.208  -7.897  -9.349
  387    H    GLU  51           H        GLU  51  -2.720  -4.614 -10.469
  388    HA   GLU  51           HA       GLU  51  -0.816  -6.668 -10.962
  389    HB2  GLU  51           HB2      GLU  51  -0.558  -3.715 -11.546
  390    HB3  GLU  51           HB3      GLU  51   0.354  -5.018 -12.294
  391    HG2  GLU  51           HG2      GLU  51  -1.779  -5.912 -13.193
  392    HG3  GLU  51           HG3      GLU  51  -2.588  -4.477 -12.571
  393    H    LEU  52           H        LEU  52  -0.885  -3.853  -8.871
  394    HA   LEU  52           HA       LEU  52   1.816  -3.943  -8.069
  395    HG   LEU  52           HG       LEU  52   0.140  -1.551  -8.735
  396    HB2  LEU  52           HB2      LEU  52  -0.646  -2.795  -6.782
  397    HB3  LEU  52           HB3      LEU  52   0.936  -2.664  -6.043
  398   HD11  LEU  52          HD11      LEU  52   0.781  -0.165  -6.136
  399   HD12  LEU  52          HD12      LEU  52  -0.820  -0.324  -6.856
  400   HD13  LEU  52          HD13      LEU  52   0.424   0.624  -7.672
  401   HD21  LEU  52          HD21      LEU  52   2.754  -1.374  -7.239
  402   HD22  LEU  52          HD22      LEU  52   2.357  -0.488  -8.711
  403   HD23  LEU  52          HD23      LEU  52   2.466  -2.249  -8.744
  404    H    ALA  53           H        ALA  53  -1.074  -5.555  -6.849
  405    HA   ALA  53           HA       ALA  53   0.122  -6.722  -4.564
  406    HB1  ALA  53           HB1      ALA  53  -2.188  -7.744  -6.222
  407    HB2  ALA  53           HB2      ALA  53  -2.305  -6.610  -4.879
  408    HB3  ALA  53           HB3      ALA  53  -1.773  -8.265  -4.588
  409    H    ALA  54           H        ALA  54  -0.123  -7.700  -7.926
  410    HA   ALA  54           HA       ALA  54   1.020 -10.272  -7.642
  411    HB1  ALA  54           HB1      ALA  54   0.984  -8.492 -10.072
  412    HB2  ALA  54           HB2      ALA  54  -0.309  -9.592  -9.594
  413    HB3  ALA  54           HB3      ALA  54   1.271 -10.231 -10.053
  414    H    ALA  55           H        ALA  55   2.372  -7.070  -7.981
  415    HA   ALA  55           HA       ALA  55   5.040  -8.015  -8.508
  416    HB1  ALA  55           HB1      ALA  55   5.692  -5.682  -8.341
  417    HB2  ALA  55           HB2      ALA  55   4.104  -5.264  -7.696
  418    HB3  ALA  55           HB3      ALA  55   4.257  -5.847  -9.354
  419    H    ALA  56           H        ALA  56   3.170  -7.046  -5.713
  420    HA   ALA  56           HA       ALA  56   5.434  -6.840  -3.956
  421    HB1  ALA  56           HB1      ALA  56   3.806  -6.441  -2.205
  422    HB2  ALA  56           HB2      ALA  56   2.499  -6.952  -3.273
  423    HB3  ALA  56           HB3      ALA  56   3.409  -5.485  -3.634
  424    H    SER  57           H        SER  57   2.672  -9.103  -4.123
  425    HA   SER  57           HA       SER  57   4.166 -10.923  -2.371
  426    HG   SER  57           HG       SER  57   2.835 -10.394  -0.651
  427    HB2  SER  57           HB2      SER  57   1.227 -10.628  -2.968
  428    HB3  SER  57           HB3      SER  57   1.875 -12.010  -2.090
  429    H    SER  58           H        SER  58   3.690 -10.506  -5.561
  430    HA   SER  58           HA       SER  58   3.839 -11.771  -7.427
  431    HG   SER  58           HG       SER  58   6.618 -13.530  -6.665
  432    HB2  SER  58           HB2      SER  58   4.470 -14.040  -5.523
  433    HB3  SER  58           HB3      SER  58   4.638 -14.112  -7.278
  434    H    ALA  59           H        ALA  59   2.296 -13.738  -4.922
  435    HA   ALA  59           HA       ALA  59   0.181 -14.478  -4.639
  436    HB1  ALA  59           HB1      ALA  59  -1.664 -13.520  -5.869
  437    HB2  ALA  59           HB2      ALA  59  -0.550 -12.828  -7.048
  438    HB3  ALA  59           HB3      ALA  59  -0.537 -12.255  -5.380
  439    H    ASP  60           H        ASP  60   0.851 -14.375  -8.130
  440    HA   ASP  60           HA       ASP  60   0.552 -15.869  -9.804
  441    HB2  ASP  60           HB2      ASP  60   2.178 -17.227  -8.567
  442    HB3  ASP  60           HB3      ASP  60   0.878 -17.929  -7.609
  443    H    GLU  61           H        GLU  61  -0.967 -17.894  -7.347
  444    HA   GLU  61           HA       GLU  61  -3.352 -18.215  -8.861
  445    HB2  GLU  61           HB2      GLU  61  -2.428 -19.891  -7.247
  446    HB3  GLU  61           HB3      GLU  61  -2.877 -18.812  -5.935
  447    HG2  GLU  61           HG2      GLU  61  -5.180 -19.082  -6.380
  448    HG3  GLU  61           HG3      GLU  61  -4.857 -19.893  -7.912
  449    H    GLY  62           H        GLY  62  -2.352 -16.189  -6.163
  450    HA2  GLY  62           HA2      GLY  62  -3.280 -13.882  -6.434
  451    HA3  GLY  62           HA3      GLY  62  -4.850 -14.659  -6.544
  452    H    ALA  63           H        ALA  63  -3.034 -12.881  -4.564
  453    HA   ALA  63           HA       ALA  63  -3.607 -14.064  -2.032
  454    HB1  ALA  63           HB1      ALA  63  -3.085 -11.878  -1.109
  455    HB2  ALA  63           HB2      ALA  63  -3.166 -11.156  -2.716
  456    HB3  ALA  63           HB3      ALA  63  -1.892 -12.314  -2.334
  457    H    SER  64           H        SER  64  -5.224 -13.252  -0.516
  458    HA   SER  64           HA       SER  64  -7.800 -13.287  -1.580
  459    HG   SER  64           HG       SER  64  -7.766 -14.604   1.446
  460    HB2  SER  64           HB2      SER  64  -6.965 -12.194   1.115
  461    HB3  SER  64           HB3      SER  64  -8.558 -12.807   0.671
  462    H    VAL  65           H        VAL  65  -8.577 -11.780  -2.909
  463    HA   VAL  65           HA       VAL  65  -8.101  -8.967  -2.212
  464    HB   VAL  65           HB       VAL  65  -6.901  -9.431  -4.234
  465   HG11  VAL  65          HG11      VAL  65  -7.978 -10.301  -6.253
  466   HG12  VAL  65          HG12      VAL  65  -9.475 -10.531  -5.352
  467   HG13  VAL  65          HG13      VAL  65  -8.038 -11.463  -4.928
  468   HG21  VAL  65          HG21      VAL  65  -8.069  -7.285  -4.138
  469   HG22  VAL  65          HG22      VAL  65  -9.476  -8.013  -4.914
  470   HG23  VAL  65          HG23      VAL  65  -7.954  -7.879  -5.795
  471    H    ALA  66           H        ALA  66  -9.808  -7.872  -1.671
  472    HA   ALA  66           HA       ALA  66 -12.393  -8.524  -2.923
  473    HB1  ALA  66           HB1      ALA  66 -11.935  -7.542  -0.101
  474    HB2  ALA  66           HB2      ALA  66 -12.433  -9.169  -0.565
  475    HB3  ALA  66           HB3      ALA  66 -13.506  -7.800  -0.858
  476    H    TYR  67           H        TYR  67 -13.538  -6.784  -3.722
  477    HA   TYR  67           HA       TYR  67 -12.490  -4.115  -3.215
  478    HD1  TYR  67           HD2      TYR  67 -11.460  -7.079  -5.922
  479    HD2  TYR  67           HD1      TYR  67 -14.418  -4.228  -7.040
  480    HE1  TYR  67           HE2      TYR  67 -12.287  -8.616  -7.651
  481    HE2  TYR  67           HE1      TYR  67 -15.249  -5.761  -8.775
  482    HH   TYR  67           HH       TYR  67 -14.298  -9.041  -8.935
  483    HB2  TYR  67           HB2      TYR  67 -12.525  -3.588  -5.649
  484    HB3  TYR  67           HB3      TYR  67 -11.292  -4.759  -5.202
  485    H    LYS  68           H        LYS  68 -13.977  -2.537  -3.246
  486    HA   LYS  68           HA       LYS  68 -16.684  -3.222  -4.168
  487    HB2  LYS  68           HB2      LYS  68 -15.913  -1.769  -1.636
  488    HB3  LYS  68           HB3      LYS  68 -17.538  -1.751  -2.308
  489    HG2  LYS  68           HG2      LYS  68 -17.759  -4.106  -2.007
  490    HG3  LYS  68           HG3      LYS  68 -16.070  -4.244  -1.536
  491    HD2  LYS  68           HD2      LYS  68 -16.534  -2.801   0.418
  492    HD3  LYS  68           HD3      LYS  68 -18.234  -2.766  -0.045
  493    HE2  LYS  68           HE2      LYS  68 -18.336  -5.205   0.209
  494    HE3  LYS  68           HE3      LYS  68 -16.645  -5.212   0.712
  495    HZ1  LYS  68           HZ1      LYS  68 -18.050  -5.266   2.636
  496    HZ2  LYS  68           HZ2      LYS  68 -18.902  -3.891   2.123
  497    HZ3  LYS  68           HZ3      LYS  68 -17.273  -3.761   2.581
  498    H    ILE  69           H        ILE  69 -17.716  -1.711  -5.258
  499    HA   ILE  69           HA       ILE  69 -16.525   0.974  -5.446
  500    HB   ILE  69           HB       ILE  69 -17.862  -0.522  -7.721
  501   HG12  ILE  69          HG12      ILE  69 -14.955   0.255  -7.365
  502   HG13  ILE  69          HG13      ILE  69 -15.595  -1.379  -7.205
  503   HG21  ILE  69          HG21      ILE  69 -18.281   1.872  -7.794
  504   HG22  ILE  69          HG22      ILE  69 -17.178   1.402  -9.087
  505   HG23  ILE  69          HG23      ILE  69 -16.555   2.198  -7.642
  506   HD11  ILE  69          HD11      ILE  69 -15.624   0.286  -9.713
  507   HD12  ILE  69          HD12      ILE  69 -16.246  -1.357  -9.553
  508   HD13  ILE  69          HD13      ILE  69 -14.521  -1.043  -9.360
  509    H    LYS  70           H        LYS  70 -17.916   2.157  -4.251
  510    HA   LYS  70           HA       LYS  70 -20.752   1.477  -4.391
  511    HB2  LYS  70           HB2      LYS  70 -19.778   1.660  -2.160
  512    HB3  LYS  70           HB3      LYS  70 -19.288   3.314  -2.499
  513    HG2  LYS  70           HG2      LYS  70 -21.500   4.089  -2.500
  514    HG3  LYS  70           HG3      LYS  70 -22.156   2.456  -2.619
  515    HD2  LYS  70           HD2      LYS  70 -20.614   3.498  -0.248
  516    HD3  LYS  70           HD3      LYS  70 -22.375   3.486  -0.359
  517    HE2  LYS  70           HE2      LYS  70 -22.251   1.012  -0.722
  518    HE3  LYS  70           HE3      LYS  70 -20.524   1.107  -0.373
  519    HZ1  LYS  70           HZ1      LYS  70 -20.995   1.883   1.825
  520    HZ2  LYS  70           HZ2      LYS  70 -21.908   0.476   1.565
  521    HZ3  LYS  70           HZ3      LYS  70 -22.654   1.996   1.492
  522    H    ASP  71           H        ASP  71 -22.066   2.542  -5.593
  523    HA   ASP  71           HA       ASP  71 -21.273   4.922  -7.013
  524    HB2  ASP  71           HB2      ASP  71 -23.976   3.556  -6.940
  525    HB3  ASP  71           HB3      ASP  71 -23.411   4.710  -8.132
  526    H    LEU  72           H        LEU  72 -21.145   6.626  -5.565
  527    HA   LEU  72           HA       LEU  72 -23.399   7.118  -3.780
  528    HG   LEU  72           HG       LEU  72 -20.479   6.331  -3.092
  529    HB2  LEU  72           HB2      LEU  72 -20.780   8.594  -4.072
  530    HB3  LEU  72           HB3      LEU  72 -22.001   8.925  -2.859
  531   HD11  LEU  72          HD11      LEU  72 -19.282   7.080  -1.095
  532   HD12  LEU  72          HD12      LEU  72 -20.122   8.629  -1.173
  533   HD13  LEU  72          HD13      LEU  72 -19.003   8.165  -2.456
  534   HD21  LEU  72          HD21      LEU  72 -22.668   6.048  -2.086
  535   HD22  LEU  72          HD22      LEU  72 -22.354   7.382  -0.978
  536   HD23  LEU  72          HD23      LEU  72 -21.410   5.897  -0.860
  537    H    GLU  73           H        GLU  73 -23.679   9.724  -3.602
  538    HA   GLU  73           HA       GLU  73 -24.810  10.403  -6.181
  539    HB2  GLU  73           HB2      GLU  73 -25.015  11.761  -3.489
  540    HB3  GLU  73           HB3      GLU  73 -25.816  12.331  -4.945
  541    HG2  GLU  73           HG2      GLU  73 -27.508  11.157  -3.986
  542    HG3  GLU  73           HG3      GLU  73 -26.789   9.895  -4.985
  543    H    GLY  74           H        GLY  74 -23.325  11.132  -7.565
  544    HA2  GLY  74           HA2      GLY  74 -22.243  13.019  -8.503
  545    HA3  GLY  74           HA3      GLY  74 -21.986  13.649  -6.881
  546    H    GLN  75           H        GLN  75 -21.019  10.990  -5.982
  547    HA   GLN  75           HA       GLN  75 -18.427  10.840  -7.348
  548    HB2  GLN  75           HB2      GLN  75 -17.310  10.795  -5.095
  549    HB3  GLN  75           HB3      GLN  75 -17.981  12.356  -5.544
  550    HG2  GLN  75           HG2      GLN  75 -19.913  11.954  -4.126
  551    HG3  GLN  75           HG3      GLN  75 -19.281  10.366  -3.693
  552   HE21  GLN  75          HE21      GLN  75 -19.280  10.951  -1.493
  553   HE22  GLN  75          HE22      GLN  75 -18.076  12.009  -0.843
  554    H    VAL  76           H        VAL  76 -17.139   8.961  -6.140
  555    HA   VAL  76           HA       VAL  76 -18.987   6.849  -5.283
  556    HB   VAL  76           HB       VAL  76 -17.730   5.162  -6.590
  557   HG11  VAL  76          HG11      VAL  76 -19.020   7.332  -8.236
  558   HG12  VAL  76          HG12      VAL  76 -19.829   5.965  -7.469
  559   HG13  VAL  76          HG13      VAL  76 -18.696   5.690  -8.792
  560   HG21  VAL  76          HG21      VAL  76 -15.646   6.387  -6.871
  561   HG22  VAL  76          HG22      VAL  76 -16.457   7.545  -7.925
  562   HG23  VAL  76          HG23      VAL  76 -16.285   5.864  -8.428
  563    H    GLU  77           H        GLU  77 -17.922   5.152  -4.047
  564    HA   GLU  77           HA       GLU  77 -15.318   6.020  -2.990
  565    HB2  GLU  77           HB2      GLU  77 -17.149   6.181  -1.320
  566    HB3  GLU  77           HB3      GLU  77 -17.435   4.456  -1.505
  567    HG2  GLU  77           HG2      GLU  77 -15.271   3.935  -0.623
  568    HG3  GLU  77           HG3      GLU  77 -14.818   5.638  -0.602
  569    H    LEU  78           H        LEU  78 -13.704   4.745  -3.382
  570    HA   LEU  78           HA       LEU  78 -14.202   2.046  -4.393
  571    HG   LEU  78           HG       LEU  78 -11.081   2.306  -6.422
  572    HB2  LEU  78           HB2      LEU  78 -12.811   3.691  -5.680
  573    HB3  LEU  78           HB3      LEU  78 -11.655   3.679  -4.369
  574   HD11  LEU  78          HD11      LEU  78  -9.893   2.018  -4.328
  575   HD12  LEU  78          HD12      LEU  78 -10.127   0.461  -5.122
  576   HD13  LEU  78          HD13      LEU  78 -11.139   0.913  -3.750
  577   HD21  LEU  78          HD21      LEU  78 -13.273   1.334  -6.815
  578   HD22  LEU  78          HD22      LEU  78 -13.191   0.487  -5.270
  579   HD23  LEU  78          HD23      LEU  78 -12.068   0.069  -6.564
  580    H    ASP  79           H        ASP  79 -14.021   0.404  -3.052
  581    HA   ASP  79           HA       ASP  79 -12.311   0.675  -0.670
  582    HB2  ASP  79           HB2      ASP  79 -14.729  -1.032  -1.235
  583    HB3  ASP  79           HB3      ASP  79 -13.626  -1.403   0.086
  584    H    ALA  80           H        ALA  80 -10.395  -0.232  -0.897
  585    HA   ALA  80           HA       ALA  80 -10.184  -2.733  -2.440
  586    HB1  ALA  80           HB1      ALA  80  -8.768  -0.918  -3.274
  587    HB2  ALA  80           HB2      ALA  80  -7.793  -2.240  -2.635
  588    HB3  ALA  80           HB3      ALA  80  -8.014  -0.771  -1.687
  589    H    ALA  81           H        ALA  81  -9.782  -4.562  -1.366
  590    HA   ALA  81           HA       ALA  81  -8.559  -4.393   1.304
  591    HB1  ALA  81           HB1      ALA  81 -10.938  -6.106   0.588
  592    HB2  ALA  81           HB2      ALA  81 -10.971  -4.661   1.599
  593    HB3  ALA  81           HB3      ALA  81 -10.098  -6.096   2.138
  594    H    PHE  82           H        PHE  82  -6.616  -5.267   0.894
  595    HA   PHE  82           HA       PHE  82  -6.539  -7.840  -0.551
  596    HD1  PHE  82           HD1      PHE  82  -6.109  -4.213  -1.408
  597    HD2  PHE  82           HD2      PHE  82  -4.511  -7.742  -3.162
  598    HE1  PHE  82           HE1      PHE  82  -6.768  -3.401  -3.635
  599    HE2  PHE  82           HE2      PHE  82  -5.168  -6.940  -5.390
  600    HZ   PHE  82           HZ       PHE  82  -6.297  -4.766  -5.634
  601    HB2  PHE  82           HB2      PHE  82  -4.431  -5.696  -0.240
  602    HB3  PHE  82           HB3      PHE  82  -4.101  -7.288  -0.915
  603    H    THR  83           H        THR  83  -5.839  -9.611   0.512
  604    HA   THR  83           HA       THR  83  -4.745  -9.202   3.219
  605    HB   THR  83           HB       THR  83  -6.004 -11.731   2.141
  606    HG1  THR  83           HG1      THR  83  -7.117  -9.430   3.296
  607   HG21  THR  83          HG21      THR  83  -6.192 -12.318   4.517
  608   HG22  THR  83          HG22      THR  83  -5.393 -10.806   4.952
  609   HG23  THR  83          HG23      THR  83  -4.511 -12.043   4.056
  610    H    PHE  84           H        PHE  84  -2.599  -9.344   3.218
  611    HA   PHE  84           HA       PHE  84  -1.285 -11.141   1.307
  612    HD1  PHE  84           HD1      PHE  84  -0.242  -9.761  -0.615
  613    HD2  PHE  84           HD2      PHE  84  -1.062  -6.924   2.455
  614    HE1  PHE  84           HE1      PHE  84  -0.904  -8.114  -2.317
  615    HE2  PHE  84           HE2      PHE  84  -1.726  -5.273   0.756
  616    HZ   PHE  84           HZ       PHE  84  -1.645  -5.868  -1.633
  617    HB2  PHE  84           HB2      PHE  84  -0.093  -8.945   3.019
  618    HB3  PHE  84           HB3      PHE  84   0.754  -9.875   1.787
  619    H    SER  85           H        SER  85   0.842 -12.086   2.216
  620    HA   SER  85           HA       SER  85   0.096 -13.664   4.530
  621    HG   SER  85           HG       SER  85   1.364 -14.685   1.360
  622    HB2  SER  85           HB2      SER  85   2.596 -13.858   2.834
  623    HB3  SER  85           HB3      SER  85   1.968 -15.077   3.944
  624    H    CYS  86           H        CYS  86   2.699 -11.463   3.554
  625    HA   CYS  86           HA       CYS  86   3.519 -11.305   6.380
  626    HG   CYS  86           HG       CYS  86   5.186 -13.058   3.284
  627    HB2  CYS  86           HB2      CYS  86   5.140 -10.526   3.951
  628    HB3  CYS  86           HB3      CYS  86   5.712 -10.685   5.610
  629    H    GLN  87           H        GLN  87   3.799  -9.271   7.334
  630    HA   GLN  87           HA       GLN  87   2.082  -7.232   6.347
  631    HB2  GLN  87           HB2      GLN  87   2.336  -7.484   8.723
  632    HB3  GLN  87           HB3      GLN  87   4.075  -7.242   8.615
  633    HG2  GLN  87           HG2      GLN  87   3.873  -4.967   8.267
  634    HG3  GLN  87           HG3      GLN  87   2.210  -5.093   7.696
  635   HE21  GLN  87          HE21      GLN  87   0.549  -5.288   9.201
  636   HE22  GLN  87          HE22      GLN  87   0.765  -4.931  10.877
  637    H    ALA  88           H        ALA  88   5.493  -7.861   6.153
  638    HA   ALA  88           HA       ALA  88   6.448  -5.390   5.302
  639    HB1  ALA  88           HB1      ALA  88   8.266  -6.609   4.251
  640    HB2  ALA  88           HB2      ALA  88   7.342  -8.108   4.338
  641    HB3  ALA  88           HB3      ALA  88   7.884  -7.318   5.818
  642    H    GLU  89           H        GLU  89   4.738  -7.900   3.540
  643    HA   GLU  89           HA       GLU  89   5.036  -6.690   0.960
  644    HB2  GLU  89           HB2      GLU  89   2.916  -8.659   1.849
  645    HB3  GLU  89           HB3      GLU  89   3.469  -8.361   0.208
  646    HG2  GLU  89           HG2      GLU  89   5.632  -9.304   0.731
  647    HG3  GLU  89           HG3      GLU  89   5.143  -9.543   2.409
  648    H    MET  90           H        MET  90   2.726  -6.538   3.570
  649    HA   MET  90           HA       MET  90   0.640  -5.259   2.144
  650    HB2  MET  90           HB2      MET  90   0.444  -6.490   4.350
  651    HB3  MET  90           HB3      MET  90   1.176  -5.090   5.114
  652    HG2  MET  90           HG2      MET  90  -1.341  -4.896   3.487
  653    HG3  MET  90           HG3      MET  90  -1.353  -5.290   5.202
  654    HE1  MET  90           HE1      MET  90  -0.641  -3.639   7.116
  655    HE2  MET  90           HE2      MET  90   0.069  -2.049   6.832
  656    HE3  MET  90           HE3      MET  90   0.963  -3.505   6.393
  657    H    ILE  91           H        ILE  91   3.211  -4.024   4.272
  658    HA   ILE  91           HA       ILE  91   2.385  -1.336   4.101
  659    HB   ILE  91           HB       ILE  91   4.707  -0.820   4.944
  660   HG12  ILE  91          HG12      ILE  91   4.905  -3.823   5.187
  661   HG13  ILE  91          HG13      ILE  91   5.752  -2.884   3.970
  662   HG21  ILE  91          HG21      ILE  91   4.250  -1.752   7.170
  663   HG22  ILE  91          HG22      ILE  91   3.023  -2.803   6.463
  664   HG23  ILE  91          HG23      ILE  91   2.810  -1.052   6.430
  665   HD11  ILE  91          HD11      ILE  91   6.968  -1.701   5.709
  666   HD12  ILE  91          HD12      ILE  91   7.194  -3.445   5.850
  667   HD13  ILE  91          HD13      ILE  91   6.092  -2.605   6.943
  668    H    ILE  92           H        ILE  92   4.910  -3.135   2.297
  669    HA   ILE  92           HA       ILE  92   5.814  -0.904   0.831
  670    HB   ILE  92           HB       ILE  92   6.745  -2.511  -0.784
  671   HG12  ILE  92          HG12      ILE  92   5.382  -4.633   0.881
  672   HG13  ILE  92          HG13      ILE  92   4.888  -4.142  -0.736
  673   HG21  ILE  92          HG21      ILE  92   8.006  -1.992   1.212
  674   HG22  ILE  92          HG22      ILE  92   8.242  -3.684   0.774
  675   HG23  ILE  92          HG23      ILE  92   7.162  -3.260   2.101
  676   HD11  ILE  92          HD11      ILE  92   7.516  -5.407   0.003
  677   HD12  ILE  92          HD12      ILE  92   7.037  -4.904  -1.618
  678   HD13  ILE  92          HD13      ILE  92   6.161  -6.199  -0.801
  679    H    PHE  93           H        PHE  93   3.108  -3.038   0.441
  680    HA   PHE  93           HA       PHE  93   2.479  -2.433  -2.240
  681    HD1  PHE  93           HD1      PHE  93   0.852  -4.220  -3.581
  682    HD2  PHE  93           HD2      PHE  93  -1.400  -2.665  -0.315
  683    HE1  PHE  93           HE1      PHE  93  -1.167  -4.193  -4.985
  684    HE2  PHE  93           HE2      PHE  93  -3.421  -2.638  -1.718
  685    HZ   PHE  93           HZ       PHE  93  -3.304  -3.405  -4.054
  686    HB2  PHE  93           HB2      PHE  93   1.591  -4.411  -1.165
  687    HB3  PHE  93           HB3      PHE  93   0.768  -3.434   0.043
  688    H    GLU  94           H        GLU  94   1.185  -1.154   0.836
  689    HA   GLU  94           HA       GLU  94  -0.570   0.630  -0.541
  690    HB2  GLU  94           HB2      GLU  94  -1.210   1.450   1.637
  691    HB3  GLU  94           HB3      GLU  94  -1.143  -0.302   1.653
  692    HG2  GLU  94           HG2      GLU  94   0.014  -0.089   3.528
  693    HG3  GLU  94           HG3      GLU  94   1.364   0.420   2.511
  694    H    LEU  95           H        LEU  95   2.654   0.882   0.760
  695    HA   LEU  95           HA       LEU  95   2.840   3.709   0.622
  696    HG   LEU  95           HG       LEU  95   3.850   1.887   2.769
  697    HB2  LEU  95           HB2      LEU  95   4.932   1.540   0.573
  698    HB3  LEU  95           HB3      LEU  95   5.338   3.244   0.516
  699   HD11  LEU  95          HD11      LEU  95   5.899   2.245   4.054
  700   HD12  LEU  95          HD12      LEU  95   6.696   2.866   2.609
  701   HD13  LEU  95          HD13      LEU  95   6.175   1.183   2.673
  702   HD21  LEU  95          HD21      LEU  95   4.198   4.007   3.959
  703   HD22  LEU  95          HD22      LEU  95   3.198   4.216   2.521
  704   HD23  LEU  95          HD23      LEU  95   4.892   4.706   2.495
  705    H    SER  96           H        SER  96   3.530   1.118  -1.687
  706    HA   SER  96           HA       SER  96   4.642   2.794  -3.680
  707    HG   SER  96           HG       SER  96   5.078  -0.242  -2.733
  708    HB2  SER  96           HB2      SER  96   3.322   0.086  -3.959
  709    HB3  SER  96           HB3      SER  96   4.303   0.876  -5.194
  710    H    LEU  97           H        LEU  97   1.386   2.097  -2.744
  711    HA   LEU  97           HA       LEU  97  -0.032   2.626  -5.068
  712    HG   LEU  97           HG       LEU  97  -0.517   0.970  -2.420
  713    HB2  LEU  97           HB2      LEU  97  -0.755   3.389  -2.239
  714    HB3  LEU  97           HB3      LEU  97  -1.868   3.402  -3.592
  715   HD11  LEU  97          HD11      LEU  97  -2.785   0.333  -1.775
  716   HD12  LEU  97          HD12      LEU  97  -3.398   1.857  -2.418
  717   HD13  LEU  97          HD13      LEU  97  -2.306   1.859  -1.032
  718   HD21  LEU  97          HD21      LEU  97  -0.769   0.747  -4.834
  719   HD22  LEU  97          HD22      LEU  97  -2.471   1.190  -4.708
  720   HD23  LEU  97          HD23      LEU  97  -1.895  -0.311  -3.985
  721    H    ARG  98           H        ARG  98   0.991   4.968  -2.579
  722    HA   ARG  98           HA       ARG  98   0.081   7.160  -4.178
  723    HE   ARG  98           HE       ARG  98   0.553   7.533   0.934
  724    HB2  ARG  98           HB2      ARG  98   1.267   8.591  -2.446
  725    HB3  ARG  98           HB3      ARG  98  -0.087   7.617  -1.894
  726    HG2  ARG  98           HG2      ARG  98   2.638   6.470  -1.685
  727    HG3  ARG  98           HG3      ARG  98   2.169   7.748  -0.558
  728    HD2  ARG  98           HD2      ARG  98   0.217   5.576  -0.986
  729    HD3  ARG  98           HD3      ARG  98   1.689   5.151  -0.129
  730   HH11  ARG  98          HH11      ARG  98   0.135   4.054   0.915
  731   HH12  ARG  98          HH12      ARG  98  -0.615   4.005   2.486
  732   HH21  ARG  98          HH21      ARG  98  -0.462   7.484   2.959
  733   HH22  ARG  98          HH22      ARG  98  -0.992   5.968   3.631
  734    H    SER  99           H        SER  99   3.169   5.606  -3.575
  735    HA   SER  99           HA       SER  99   4.745   7.736  -4.623
  736    HG   SER  99           HG       SER  99   6.851   6.201  -5.595
  737    HB2  SER  99           HB2      SER  99   5.671   6.134  -3.021
  738    HB3  SER  99           HB3      SER  99   5.464   4.828  -4.189
  739    H    LEU 100           H        LEU 100   2.847   5.376  -6.142
  740    HA   LEU 100           HA       LEU 100   4.436   5.101  -8.509
  741    HG   LEU 100           HG       LEU 100   2.291   4.370 -10.528
  742    HB2  LEU 100           HB2      LEU 100   2.694   3.476  -7.669
  743    HB3  LEU 100           HB3      LEU 100   1.480   4.605  -8.226
  744   HD11  LEU 100          HD11      LEU 100   4.637   3.890 -10.016
  745   HD12  LEU 100          HD12      LEU 100   3.945   2.684 -11.100
  746   HD13  LEU 100          HD13      LEU 100   4.175   2.306  -9.392
  747   HD21  LEU 100          HD21      LEU 100   0.513   2.904  -9.729
  748   HD22  LEU 100          HD22      LEU 100   1.714   1.734  -9.183
  749   HD23  LEU 100          HD23      LEU 100   1.536   2.077 -10.905
  750    H    ALA 101           H        ALA 101   1.466   6.873  -7.699
  751    HA   ALA 101           HA       ALA 101   1.467   8.319 -10.180
  752    HB1  ALA 101           HB1      ALA 101  -0.423   9.530  -9.245
  753    HB2  ALA 101           HB2      ALA 101  -0.103   8.836  -7.655
  754    HB3  ALA 101           HB3      ALA 101  -0.615   7.796  -8.984
  755    H    LEU 102           H        LEU 102   2.560   8.839  -6.904
  756    HA   LEU 102           HA       LEU 102   3.417  11.554  -7.576
  757    HG   LEU 102           HG       LEU 102   1.978  12.593  -5.900
  758    HB2  LEU 102           HB2      LEU 102   3.294  10.051  -4.975
  759    HB3  LEU 102           HB3      LEU 102   4.160  11.564  -5.128
  760   HD11  LEU 102          HD11      LEU 102  -0.077  11.463  -5.231
  761   HD12  LEU 102          HD12      LEU 102   0.854  10.034  -4.785
  762   HD13  LEU 102          HD13      LEU 102   0.789  10.554  -6.470
  763   HD21  LEU 102          HD21      LEU 102   1.151  12.859  -3.620
  764   HD22  LEU 102          HD22      LEU 102   2.912  12.958  -3.682
  765   HD23  LEU 102          HD23      LEU 102   2.130  11.485  -3.103
  766    H    GLU 103           H        GLU 103   4.916  10.592  -9.122
  767    HA   GLU 103           HA       GLU 103   7.174   9.103  -8.341
  768    HB2  GLU 103           HB2      GLU 103   6.917  11.082 -10.620
  769    HB3  GLU 103           HB3      GLU 103   8.171   9.859 -10.456
  770    HG2  GLU 103           HG2      GLU 103   6.435   8.112 -10.566
  771    HG3  GLU 103           HG3      GLU 103   5.226   9.367 -10.828
  772    H    HIS 104           H        HIS 104   6.436  12.514  -8.313
  773    HA   HIS 104           HA       HIS 104   9.046  13.242  -7.301
  774    HD1  HIS 104           HD1      HIS 104   6.573  16.871  -6.109
  775    HD2  HIS 104           HD2      HIS 104  10.372  15.689  -7.319
  776    HE1  HIS 104           HE1      HIS 104   8.163  18.552  -5.106
  777    HE2  HIS 104           HE2      HIS 104  10.433  17.912  -6.003
  778    HB2  HIS 104           HB2      HIS 104   7.791  14.837  -8.712
  779    HB3  HIS 104           HB3      HIS 104   6.494  14.866  -7.523
  780    H    HIS 105           H        HIS 105   9.451  12.408  -5.343
  781    HA   HIS 105           HA       HIS 105   7.451  11.828  -3.426
  782    HD1  HIS 105           HD1      HIS 105  10.356   9.213  -1.556
  783    HD2  HIS 105           HD2      HIS 105   8.137   9.800  -5.030
  784    HE1  HIS 105           HE1      HIS 105   9.753   6.911  -2.376
  785    HE2  HIS 105           HE2      HIS 105   8.235   7.303  -4.348
  786    HB2  HIS 105           HB2      HIS 105  10.441  11.779  -3.423
  787    HB3  HIS 105           HB3      HIS 105   9.579  11.639  -1.896
  788    H    HIS 106           H        HIS 106   6.921  12.797  -1.521
  789    HA   HIS 106           HA       HIS 106   7.720  15.608  -1.221
  790    HD1  HIS 106           HD1      HIS 106   3.397  16.419  -0.491
  791    HD2  HIS 106           HD2      HIS 106   6.167  15.328  -3.410
  792    HE1  HIS 106           HE1      HIS 106   2.493  17.312  -2.666
  793    HE2  HIS 106           HE2      HIS 106   4.096  16.501  -4.431
  794    HB2  HIS 106           HB2      HIS 106   5.330  14.051  -0.226
  795    HB3  HIS 106           HB3      HIS 106   5.744  15.635   0.415
  796    H    HIS 107           H        HIS 107   8.622  16.337   0.684
  797    HA   HIS 107           HA       HIS 107   9.280  14.265   2.675
  798    HD1  HIS 107           HD1      HIS 107  12.882  14.029   3.300
  799    HD2  HIS 107           HD2      HIS 107  10.957  14.011  -0.386
  800    HE1  HIS 107           HE1      HIS 107  13.885  12.113   2.023
  801    HE2  HIS 107           HE2      HIS 107  12.805  12.197  -0.251
  802    HB2  HIS 107           HB2      HIS 107  10.970  16.402   1.437
  803    HB3  HIS 107           HB3      HIS 107  11.309  15.900   3.091
  804    H    HIS 108           H        HIS 108   6.953  15.729   2.861
  805    HA   HIS 108           HA       HIS 108   7.238  16.951   5.422
  806    HD1  HIS 108           HD1      HIS 108   4.753  20.356   4.048
  807    HD2  HIS 108           HD2      HIS 108   7.697  19.399   6.829
  808    HE1  HIS 108           HE1      HIS 108   4.287  21.797   6.056
  809    HE2  HIS 108           HE2      HIS 108   6.171  21.317   7.658
  810    HB2  HIS 108           HB2      HIS 108   7.986  18.809   3.926
  811    HB3  HIS 108           HB3      HIS 108   6.414  18.762   3.139
  812    H    HIS 109           H        HIS 109   4.985  17.643   2.775
  813    HA   HIS 109           HA       HIS 109   3.071  15.695   3.309
  814    HD1  HIS 109           HD1      HIS 109  -0.158  18.527   4.233
  815    HD2  HIS 109           HD2      HIS 109   1.054  14.630   5.055
  816    HE1  HIS 109           HE1      HIS 109  -2.277  17.187   4.465
  817    HE2  HIS 109           HE2      HIS 109  -1.518  14.895   5.181
  818    HB2  HIS 109           HB2      HIS 109   2.849  16.963   5.479
  819    HB3  HIS 109           HB3      HIS 109   2.311  18.355   4.545
  Start of MODEL   18
    1    HA   MET   1           HA       MET   1  44.582  27.986 -20.451
    2    H1   MET   1           H1       MET   1  45.847  28.219 -17.787
    3    H2   MET   1           H2       MET   1  45.005  29.445 -18.605
    4    H3   MET   1           H3       MET   1  46.464  28.848 -19.235
    5    HB2  MET   1           HB2      MET   1  46.539  26.574 -20.330
    6    HB3  MET   1           HB3      MET   1  46.071  25.984 -18.740
    7    HG2  MET   1           HG2      MET   1  45.612  24.319 -20.426
    8    HG3  MET   1           HG3      MET   1  44.106  24.907 -19.724
    9    HE1  MET   1           HE1      MET   1  42.880  24.237 -23.324
   10    HE2  MET   1           HE2      MET   1  42.529  24.078 -21.603
   11    HE3  MET   1           HE3      MET   1  43.920  23.248 -22.300
   12    H    ALA   2           H        ALA   2  42.469  27.971 -20.239
   13    HA   ALA   2           HA       ALA   2  41.099  27.536 -17.802
   14    HB1  ALA   2           HB1      ALA   2  39.067  27.577 -19.136
   15    HB2  ALA   2           HB2      ALA   2  40.011  27.387 -20.614
   16    HB3  ALA   2           HB3      ALA   2  40.163  28.859 -19.652
   17    H    MET   3           H        MET   3  40.949  25.680 -16.769
   18    HA   MET   3           HA       MET   3  41.327  23.163 -18.140
   19    HB2  MET   3           HB2      MET   3  40.654  23.703 -15.236
   20    HB3  MET   3           HB3      MET   3  41.204  22.170 -15.904
   21    HG2  MET   3           HG2      MET   3  43.344  23.160 -16.474
   22    HG3  MET   3           HG3      MET   3  42.796  24.725 -15.879
   23    HE1  MET   3           HE1      MET   3  44.020  21.139 -14.978
   24    HE2  MET   3           HE2      MET   3  42.346  21.073 -14.427
   25    HE3  MET   3           HE3      MET   3  43.662  21.031 -13.254
   26    H    LYS   4           H        LYS   4  39.678  22.400 -19.289
   27    HA   LYS   4           HA       LYS   4  36.972  23.151 -18.549
   28    HB2  LYS   4           HB2      LYS   4  38.017  21.701 -20.982
   29    HB3  LYS   4           HB3      LYS   4  36.351  22.217 -20.747
   30    HG2  LYS   4           HG2      LYS   4  37.048  24.539 -20.689
   31    HG3  LYS   4           HG3      LYS   4  38.736  24.054 -20.850
   32    HD2  LYS   4           HD2      LYS   4  38.224  23.062 -23.042
   33    HD3  LYS   4           HD3      LYS   4  36.548  23.593 -22.877
   34    HE2  LYS   4           HE2      LYS   4  37.256  25.911 -22.818
   35    HE3  LYS   4           HE3      LYS   4  38.948  25.420 -22.882
   36    HZ1  LYS   4           HZ1      LYS   4  38.184  26.107 -25.049
   37    HZ2  LYS   4           HZ2      LYS   4  36.913  24.984 -25.008
   38    HZ3  LYS   4           HZ3      LYS   4  38.521  24.446 -25.066
   39    H    ASP   5           H        ASP   5  37.425  21.676 -16.592
   40    HA   ASP   5           HA       ASP   5  36.245  19.047 -17.234
   41    HB2  ASP   5           HB2      ASP   5  37.120  18.208 -15.160
   42    HB3  ASP   5           HB3      ASP   5  38.440  19.027 -15.989
   43    H    VAL   6           H        VAL   6  35.400  22.013 -16.524
   44    HA   VAL   6           HA       VAL   6  33.834  21.907 -14.199
   45    HB   VAL   6           HB       VAL   6  32.716  23.947 -15.115
   46   HG11  VAL   6          HG11      VAL   6  35.728  23.903 -15.274
   47   HG12  VAL   6          HG12      VAL   6  34.760  24.146 -13.820
   48   HG13  VAL   6          HG13      VAL   6  34.730  25.349 -15.109
   49   HG21  VAL   6          HG21      VAL   6  32.753  23.371 -17.483
   50   HG22  VAL   6          HG22      VAL   6  34.516  23.449 -17.488
   51   HG23  VAL   6          HG23      VAL   6  33.567  24.910 -17.208
   52    H    VAL   7           H        VAL   7  31.896  21.112 -13.789
   53    HA   VAL   7           HA       VAL   7  29.982  20.715 -15.944
   54    HB   VAL   7           HB       VAL   7  31.191  18.581 -15.787
   55   HG11  VAL   7          HG11      VAL   7  31.894  18.678 -13.462
   56   HG12  VAL   7          HG12      VAL   7  31.027  17.178 -13.791
   57   HG13  VAL   7          HG13      VAL   7  30.221  18.493 -12.935
   58   HG21  VAL   7          HG21      VAL   7  29.252  17.110 -15.509
   59   HG22  VAL   7          HG22      VAL   7  28.842  18.559 -16.428
   60   HG23  VAL   7          HG23      VAL   7  28.369  18.425 -14.734
   61    H    ASP   8           H        ASP   8  27.890  21.004 -15.288
   62    HA   ASP   8           HA       ASP   8  27.404  21.254 -12.396
   63    HB2  ASP   8           HB2      ASP   8  27.670  23.488 -13.737
   64    HB3  ASP   8           HB3      ASP   8  26.062  23.110 -14.344
   65    H    LYS   9           H        LYS   9  24.638  21.963 -12.731
   66    HA   LYS   9           HA       LYS   9  22.610  20.957 -12.928
   67    HB2  LYS   9           HB2      LYS   9  23.050  21.032 -15.340
   68    HB3  LYS   9           HB3      LYS   9  23.951  19.528 -15.239
   69    HG2  LYS   9           HG2      LYS   9  21.836  18.418 -14.496
   70    HG3  LYS   9           HG3      LYS   9  20.998  19.928 -14.866
   71    HD2  LYS   9           HD2      LYS   9  20.769  18.523 -16.771
   72    HD3  LYS   9           HD3      LYS   9  21.938  19.774 -17.186
   73    HE2  LYS   9           HE2      LYS   9  22.683  17.000 -16.259
   74    HE3  LYS   9           HE3      LYS   9  22.556  17.470 -17.950
   75    HZ1  LYS   9           HZ1      LYS   9  24.846  17.552 -17.218
   76    HZ2  LYS   9           HZ2      LYS   9  24.447  18.609 -15.957
   77    HZ3  LYS   9           HZ3      LYS   9  24.307  19.125 -17.564
   78    H    CYS  10           H        CYS  10  23.687  20.116 -10.847
   79    HA   CYS  10           HA       CYS  10  23.596  17.172 -10.893
   80    HG   CYS  10           HG       CYS  10  25.960  15.533 -10.100
   81    HB2  CYS  10           HB2      CYS  10  25.949  18.146 -10.719
   82    HB3  CYS  10           HB3      CYS  10  25.473  18.762  -9.141
   83    H    SER  11           H        SER  11  21.601  19.238 -10.262
   84    HA   SER  11           HA       SER  11  21.004  18.298  -7.538
   85    HG   SER  11           HG       SER  11  19.842  19.758  -6.158
   86    HB2  SER  11           HB2      SER  11  21.521  20.746  -7.565
   87    HB3  SER  11           HB3      SER  11  20.189  20.978  -8.698
   88    H    THR  12           H        THR  12  19.958  16.529  -8.511
   89    HA   THR  12           HA       THR  12  17.507  17.183 -10.008
   90    HB   THR  12           HB       THR  12  18.998  14.579 -10.266
   91    HG1  THR  12           HG1      THR  12  19.374  16.947 -11.830
   92   HG21  THR  12          HG21      THR  12  17.855  14.498 -12.434
   93   HG22  THR  12          HG22      THR  12  17.114  16.064 -12.102
   94   HG23  THR  12          HG23      THR  12  16.704  14.667 -11.108
   95    H    LYS  13           H        LYS  13  15.645  16.221  -9.366
   96    HA   LYS  13           HA       LYS  13  14.160  14.893  -8.285
   97    HB2  LYS  13           HB2      LYS  13  16.562  13.153  -7.697
   98    HB3  LYS  13           HB3      LYS  13  14.885  12.679  -7.488
   99    HG2  LYS  13           HG2      LYS  13  16.076  13.460 -10.143
  100    HG3  LYS  13           HG3      LYS  13  16.001  11.802  -9.549
  101    HD2  LYS  13           HD2      LYS  13  14.135  12.060 -10.970
  102    HD3  LYS  13           HD3      LYS  13  13.501  12.135  -9.328
  103    HE2  LYS  13           HE2      LYS  13  13.490  14.598  -9.477
  104    HE3  LYS  13           HE3      LYS  13  14.052  14.478 -11.143
  105    HZ1  LYS  13           HZ1      LYS  13  11.633  14.801 -10.946
  106    HZ2  LYS  13           HZ2      LYS  13  11.508  13.306 -10.148
  107    HZ3  LYS  13           HZ3      LYS  13  12.042  13.369 -11.756
  108    H    GLY  14           H        GLY  14  14.519  13.353  -5.912
  109    HA2  GLY  14           HA2      GLY  14  15.382  13.834  -3.637
  110    HA3  GLY  14           HA3      GLY  14  15.054  15.528  -3.976
  111    H    CYS  15           H        CYS  15  12.815  13.206  -5.154
  112    HA   CYS  15           HA       CYS  15  10.823  14.202  -3.269
  113    HG   CYS  15           HG       CYS  15   8.076  11.909  -5.025
  114    HB2  CYS  15           HB2      CYS  15  10.301  14.249  -5.686
  115    HB3  CYS  15           HB3      CYS  15  10.480  12.501  -5.749
  116    H    ALA  16           H        ALA  16  11.340  13.079  -1.417
  117    HA   ALA  16           HA       ALA  16  10.786  10.198  -1.517
  118    HB1  ALA  16           HB1      ALA  16  12.565   9.777   0.102
  119    HB2  ALA  16           HB2      ALA  16  13.011  11.482   0.067
  120    HB3  ALA  16           HB3      ALA  16  13.210  10.490  -1.377
  121    H    ILE  17           H        ILE  17   9.125   9.738  -0.270
  122    HA   ILE  17           HA       ILE  17   8.715  11.320   2.179
  123    HB   ILE  17           HB       ILE  17   6.279  10.844   1.953
  124   HG12  ILE  17          HG12      ILE  17   7.053   9.910  -0.819
  125   HG13  ILE  17          HG13      ILE  17   6.468   8.876   0.479
  126   HG21  ILE  17          HG21      ILE  17   5.853  12.525   0.221
  127   HG22  ILE  17          HG22      ILE  17   7.521  12.369  -0.332
  128   HG23  ILE  17          HG23      ILE  17   7.182  12.998   1.280
  129   HD11  ILE  17          HD11      ILE  17   4.922  11.082  -0.868
  130   HD12  ILE  17          HD12      ILE  17   4.333  10.065   0.446
  131   HD13  ILE  17          HD13      ILE  17   4.712   9.349  -1.120
  132    H    ASP  18           H        ASP  18   7.717  10.159   3.948
  133    HA   ASP  18           HA       ASP  18   8.258   7.269   3.820
  134    HB2  ASP  18           HB2      ASP  18   9.895   8.298   5.240
  135    HB3  ASP  18           HB3      ASP  18   8.661   9.214   6.096
  136    H    ILE  19           H        ILE  19   6.639   5.943   4.312
  137    HA   ILE  19           HA       ILE  19   4.026   6.915   4.841
  138    HB   ILE  19           HB       ILE  19   5.137   4.110   5.084
  139   HG12  ILE  19          HG12      ILE  19   5.250   4.908   2.808
  140   HG13  ILE  19          HG13      ILE  19   3.920   3.764   2.938
  141   HG21  ILE  19          HG21      ILE  19   3.152   4.313   6.459
  142   HG22  ILE  19          HG22      ILE  19   2.801   3.353   5.021
  143   HG23  ILE  19          HG23      ILE  19   2.267   5.031   5.111
  144   HD11  ILE  19          HD11      ILE  19   3.308   5.666   1.569
  145   HD12  ILE  19          HD12      ILE  19   3.672   6.763   2.902
  146   HD13  ILE  19          HD13      ILE  19   2.336   5.618   3.039
  147    H    GLY  20           H        GLY  20   6.635   5.736   6.841
  148    HA2  GLY  20           HA2      GLY  20   6.957   6.082   9.112
  149    HA3  GLY  20           HA3      GLY  20   5.344   6.781   9.207
  150    H    THR  21           H        THR  21   6.998   3.692   8.706
  151    HA   THR  21           HA       THR  21   4.702   2.157   9.518
  152    HB   THR  21           HB       THR  21   7.502   1.085   9.281
  153    HG1  THR  21           HG1      THR  21   7.078   2.304   7.380
  154   HG21  THR  21          HG21      THR  21   4.778  -0.095   8.711
  155   HG22  THR  21          HG22      THR  21   5.786  -0.443  10.115
  156   HG23  THR  21          HG23      THR  21   6.319  -0.933   8.508
  157    H    VAL  22           H        VAL  22   5.107   3.842  11.512
  158    HA   VAL  22           HA       VAL  22   6.356   2.258  13.652
  159    HB   VAL  22           HB       VAL  22   7.196   4.616  13.280
  160   HG11  VAL  22          HG11      VAL  22   5.138   5.712  12.705
  161   HG12  VAL  22          HG12      VAL  22   5.813   6.462  14.153
  162   HG13  VAL  22          HG13      VAL  22   4.456   5.342  14.289
  163   HG21  VAL  22          HG21      VAL  22   7.551   3.478  15.399
  164   HG22  VAL  22          HG22      VAL  22   5.980   4.035  15.979
  165   HG23  VAL  22          HG23      VAL  22   7.266   5.199  15.654
  166    H    ILE  23           H        ILE  23   3.649   2.384  12.211
  167    HA   ILE  23           HA       ILE  23   1.808   2.833  14.425
  168    HB   ILE  23           HB       ILE  23   1.240   3.708  12.181
  169   HG12  ILE  23          HG12      ILE  23  -0.624   1.500  13.085
  170   HG13  ILE  23          HG13      ILE  23  -0.563   3.123  13.766
  171   HG21  ILE  23          HG21      ILE  23   2.318   1.992  10.837
  172   HG22  ILE  23          HG22      ILE  23   0.630   2.194  10.371
  173   HG23  ILE  23          HG23      ILE  23   1.113   0.813  11.356
  174   HD11  ILE  23          HD11      ILE  23  -1.311   2.425  10.935
  175   HD12  ILE  23          HD12      ILE  23  -1.254   4.050  11.619
  176   HD13  ILE  23          HD13      ILE  23  -2.424   2.878  12.227
  177    H    ASP  24           H        ASP  24   0.226   1.150  14.979
  178    HA   ASP  24           HA       ASP  24   1.423  -1.294  15.596
  179    HB2  ASP  24           HB2      ASP  24  -1.403  -0.312  15.639
  180    HB3  ASP  24           HB3      ASP  24  -1.078  -2.024  15.912
  181    H    ASN  25           H        ASN  25   2.022  -2.832  14.315
  182    HA   ASN  25           HA       ASN  25   0.900  -3.245  11.708
  183    HB2  ASN  25           HB2      ASN  25   2.601  -4.936  11.435
  184    HB3  ASN  25           HB3      ASN  25   3.310  -3.525  12.197
  185   HD21  ASN  25          HD21      ASN  25   2.124  -4.307  14.863
  186   HD22  ASN  25          HD22      ASN  25   3.136  -5.594  15.406
  187    H    ASP  26           H        ASP  26  -1.227  -3.494  13.017
  188    HA   ASP  26           HA       ASP  26  -1.771  -5.792  14.508
  189    HB2  ASP  26           HB2      ASP  26  -3.186  -3.798  14.577
  190    HB3  ASP  26           HB3      ASP  26  -3.702  -4.097  12.919
  191    H    ASN  27           H        ASN  27  -3.021  -5.163  11.207
  192    HA   ASN  27           HA       ASN  27  -3.195  -8.079  10.902
  193    HB2  ASN  27           HB2      ASN  27  -5.033  -7.595   9.257
  194    HB3  ASN  27           HB3      ASN  27  -5.401  -7.192  10.925
  195   HD21  ASN  27          HD21      ASN  27  -3.340  -5.151   8.945
  196   HD22  ASN  27          HD22      ASN  27  -4.475  -3.855   8.793
  197    H    CYS  28           H        CYS  28  -3.320  -8.733   8.533
  198    HA   CYS  28           HA       CYS  28  -1.078  -7.472   7.110
  199    HG   CYS  28           HG       CYS  28  -0.276 -11.539   7.873
  200    HB2  CYS  28           HB2      CYS  28  -2.337 -10.197   6.699
  201    HB3  CYS  28           HB3      CYS  28  -0.896  -9.593   5.887
  202    H    THR  29           H        THR  29  -4.249  -7.148   7.207
  203    HA   THR  29           HA       THR  29  -4.740  -7.153   4.332
  204    HB   THR  29           HB       THR  29  -6.659  -6.636   6.613
  205    HG1  THR  29           HG1      THR  29  -6.934  -8.944   5.114
  206   HG21  THR  29          HG21      THR  29  -8.409  -6.996   4.933
  207   HG22  THR  29          HG22      THR  29  -7.176  -7.182   3.685
  208   HG23  THR  29          HG23      THR  29  -7.384  -5.630   4.496
  209    H    SER  30           H        SER  30  -4.558  -5.344   3.187
  210    HA   SER  30           HA       SER  30  -4.494  -2.781   4.610
  211    HG   SER  30           HG       SER  30  -2.599  -1.213   2.320
  212    HB2  SER  30           HB2      SER  30  -2.582  -3.207   3.121
  213    HB3  SER  30           HB3      SER  30  -3.684  -3.433   1.762
  214    H    LYS  31           H        LYS  31  -6.013  -1.255   4.324
  215    HA   LYS  31           HA       LYS  31  -8.224  -1.899   2.496
  216    HB2  LYS  31           HB2      LYS  31  -8.107  -0.243   5.012
  217    HB3  LYS  31           HB3      LYS  31  -9.466  -0.173   3.904
  218    HG2  LYS  31           HG2      LYS  31  -8.530  -2.741   5.133
  219    HG3  LYS  31           HG3      LYS  31  -9.703  -1.679   5.909
  220    HD2  LYS  31           HD2      LYS  31 -10.163  -2.498   3.083
  221    HD3  LYS  31           HD3      LYS  31 -10.476  -3.667   4.366
  222    HE2  LYS  31           HE2      LYS  31 -12.517  -2.506   3.856
  223    HE3  LYS  31           HE3      LYS  31 -11.966  -2.014   5.453
  224    HZ1  LYS  31           HZ1      LYS  31 -11.715  -0.456   2.930
  225    HZ2  LYS  31           HZ2      LYS  31 -11.046   0.013   4.421
  226    HZ3  LYS  31           HZ3      LYS  31 -12.723  -0.109   4.250
  227    H    PHE  32           H        PHE  32  -8.052  -0.895   0.652
  228    HA   PHE  32           HA       PHE  32  -6.947   1.822   0.578
  229    HD1  PHE  32           HD1      PHE  32  -5.106   2.634  -1.274
  230    HD2  PHE  32           HD2      PHE  32  -8.476   1.132  -3.401
  231    HE1  PHE  32           HE1      PHE  32  -4.887   4.461  -2.906
  232    HE2  PHE  32           HE2      PHE  32  -8.261   2.959  -5.037
  233    HZ   PHE  32           HZ       PHE  32  -6.468   4.629  -4.787
  234    HB2  PHE  32           HB2      PHE  32  -5.960   0.252  -1.017
  235    HB3  PHE  32           HB3      PHE  32  -7.553  -0.130  -1.660
  236    H    SER  33           H        SER  33  -8.341   3.448   0.633
  237    HA   SER  33           HA       SER  33 -10.979   3.079  -0.614
  238    HG   SER  33           HG       SER  33 -11.196   1.813   1.379
  239    HB2  SER  33           HB2      SER  33 -10.513   4.434   2.056
  240    HB3  SER  33           HB3      SER  33 -12.065   4.209   1.250
  241    H    ARG  34           H        ARG  34 -10.905   4.426  -2.287
  242    HA   ARG  34           HA       ARG  34 -10.036   7.194  -1.786
  243    HE   ARG  34           HE       ARG  34  -7.199   9.865  -3.892
  244    HB2  ARG  34           HB2      ARG  34  -8.496   5.467  -3.167
  245    HB3  ARG  34           HB3      ARG  34  -9.495   6.068  -4.474
  246    HG2  ARG  34           HG2      ARG  34  -7.948   7.853  -2.611
  247    HG3  ARG  34           HG3      ARG  34  -7.305   7.243  -4.133
  248    HD2  ARG  34           HD2      ARG  34  -9.166   8.324  -5.325
  249    HD3  ARG  34           HD3      ARG  34  -9.757   8.961  -3.792
  250   HH11  ARG  34          HH11      ARG  34  -9.940  10.084  -6.069
  251   HH12  ARG  34          HH12      ARG  34  -9.375  11.545  -6.830
  252   HH21  ARG  34          HH21      ARG  34  -6.484  11.789  -4.842
  253   HH22  ARG  34          HH22      ARG  34  -7.416  12.526  -6.119
  254    H    PHE  35           H        PHE  35 -11.254   8.727  -2.756
  255    HA   PHE  35           HA       PHE  35 -13.777   7.826  -3.912
  256    HD1  PHE  35           HD1      PHE  35 -15.855   8.489  -2.173
  257    HD2  PHE  35           HD2      PHE  35 -12.227  10.236  -0.779
  258    HE1  PHE  35           HE1      PHE  35 -16.446   7.871   0.134
  259    HE2  PHE  35           HE2      PHE  35 -12.816   9.618   1.529
  260    HZ   PHE  35           HZ       PHE  35 -14.925   8.434   1.988
  261    HB2  PHE  35           HB2      PHE  35 -12.920  10.584  -3.002
  262    HB3  PHE  35           HB3      PHE  35 -14.537  10.139  -3.535
  263    H    PHE  36           H        PHE  36 -14.441   8.317  -5.959
  264    HA   PHE  36           HA       PHE  36 -12.618   9.917  -7.621
  265    HD1  PHE  36           HD1      PHE  36 -10.593   8.784  -9.184
  266    HD2  PHE  36           HD2      PHE  36 -12.643   5.822  -6.928
  267    HE1  PHE  36           HE1      PHE  36  -8.438   7.752  -8.591
  268    HE2  PHE  36           HE2      PHE  36 -10.498   4.781  -6.327
  269    HZ   PHE  36           HZ       PHE  36  -8.390   5.745  -7.161
  270    HB2  PHE  36           HB2      PHE  36 -13.841   7.250  -8.366
  271    HB3  PHE  36           HB3      PHE  36 -13.011   8.316  -9.496
  272    H    ALA  37           H        ALA  37 -13.654  10.596  -9.686
  273    HA   ALA  37           HA       ALA  37 -16.055  11.956  -9.167
  274    HB1  ALA  37           HB1      ALA  37 -15.973  12.674 -11.461
  275    HB2  ALA  37           HB2      ALA  37 -14.855  11.375 -11.870
  276    HB3  ALA  37           HB3      ALA  37 -14.338  12.679 -10.799
  277    H    THR  38           H        THR  38 -15.481   9.220 -11.391
  278    HA   THR  38           HA       THR  38 -18.334   8.544 -11.094
  279    HB   THR  38           HB       THR  38 -18.247   7.550 -13.355
  280    HG1  THR  38           HG1      THR  38 -16.252   8.482 -14.572
  281   HG21  THR  38          HG21      THR  38 -17.400  10.447 -13.278
  282   HG22  THR  38          HG22      THR  38 -19.048   9.842 -13.121
  283   HG23  THR  38          HG23      THR  38 -18.178   9.640 -14.641
  284    H    ARG  39           H        ARG  39 -18.830   6.251 -11.238
  285    HA   ARG  39           HA       ARG  39 -17.094   4.596  -9.775
  286    HE   ARG  39           HE       ARG  39 -18.944  -0.257 -11.266
  287    HB2  ARG  39           HB2      ARG  39 -19.377   4.009  -9.743
  288    HB3  ARG  39           HB3      ARG  39 -19.498   4.017 -11.495
  289    HG2  ARG  39           HG2      ARG  39 -18.165   2.011 -11.633
  290    HG3  ARG  39           HG3      ARG  39 -17.896   2.037  -9.891
  291    HD2  ARG  39           HD2      ARG  39 -20.268   1.689  -9.503
  292    HD3  ARG  39           HD3      ARG  39 -20.572   1.717 -11.244
  293   HH11  ARG  39          HH11      ARG  39 -21.135   0.448  -8.618
  294   HH12  ARG  39          HH12      ARG  39 -21.254  -1.210  -8.110
  295   HH21  ARG  39          HH21      ARG  39 -19.082  -2.421 -10.599
  296   HH22  ARG  39          HH22      ARG  39 -20.090  -2.854  -9.253
  297    H    GLU  40           H        GLU  40 -17.405   5.231 -13.161
  298    HA   GLU  40           HA       GLU  40 -15.933   3.096 -14.212
  299    HB2  GLU  40           HB2      GLU  40 -16.082   5.942 -15.213
  300    HB3  GLU  40           HB3      GLU  40 -15.605   4.531 -16.145
  301    HG2  GLU  40           HG2      GLU  40 -17.837   3.587 -15.859
  302    HG3  GLU  40           HG3      GLU  40 -18.314   5.000 -14.926
  303    H    GLU  41           H        GLU  41 -14.928   6.319 -13.141
  304    HA   GLU  41           HA       GLU  41 -12.177   6.107 -13.565
  305    HB2  GLU  41           HB2      GLU  41 -13.722   7.573 -11.419
  306    HB3  GLU  41           HB3      GLU  41 -12.004   7.785 -11.689
  307    HG2  GLU  41           HG2      GLU  41 -14.147   8.346 -13.717
  308    HG3  GLU  41           HG3      GLU  41 -13.370   9.555 -12.698
  309    H    ALA  42           H        ALA  42 -14.222   4.791 -11.091
  310    HA   ALA  42           HA       ALA  42 -12.115   4.289  -9.207
  311    HB1  ALA  42           HB1      ALA  42 -14.415   4.712  -8.481
  312    HB2  ALA  42           HB2      ALA  42 -13.810   3.168  -7.884
  313    HB3  ALA  42           HB3      ALA  42 -14.929   3.210  -9.246
  314    H    GLU  43           H        GLU  43 -14.131   2.190 -11.262
  315    HA   GLU  43           HA       GLU  43 -12.785  -0.186 -10.479
  316    HB2  GLU  43           HB2      GLU  43 -14.544   0.323 -12.890
  317    HB3  GLU  43           HB3      GLU  43 -14.048  -1.262 -12.304
  318    HG2  GLU  43           HG2      GLU  43 -15.176  -0.726 -10.144
  319    HG3  GLU  43           HG3      GLU  43 -15.802   0.737 -10.900
  320    H    SER  44           H        SER  44 -12.088   2.236 -12.820
  321    HA   SER  44           HA       SER  44 -10.304   0.611 -14.395
  322    HG   SER  44           HG       SER  44 -12.453   2.953 -15.044
  323    HB2  SER  44           HB2      SER  44 -10.550   3.629 -14.253
  324    HB3  SER  44           HB3      SER  44  -9.683   2.716 -15.487
  325    H    PHE  45           H        PHE  45 -10.086   2.576 -11.529
  326    HA   PHE  45           HA       PHE  45  -7.235   2.840 -11.606
  327    HD1  PHE  45           HD1      PHE  45  -6.662   5.324 -10.954
  328    HD2  PHE  45           HD2      PHE  45  -7.331   3.025  -7.439
  329    HE1  PHE  45           HE1      PHE  45  -4.667   6.327  -9.925
  330    HE2  PHE  45           HE2      PHE  45  -5.334   4.021  -6.404
  331    HZ   PHE  45           HZ       PHE  45  -4.001   5.679  -7.645
  332    HB2  PHE  45           HB2      PHE  45  -8.933   4.311 -10.327
  333    HB3  PHE  45           HB3      PHE  45  -8.929   3.031  -9.120
  334    H    MET  46           H        MET  46  -9.513   0.486 -10.524
  335    HA   MET  46           HA       MET  46  -7.887  -0.989  -8.752
  336    HB2  MET  46           HB2      MET  46 -10.322  -1.262  -8.861
  337    HB3  MET  46           HB3      MET  46 -10.187  -1.904 -10.491
  338    HG2  MET  46           HG2      MET  46 -10.529  -3.702  -8.941
  339    HG3  MET  46           HG3      MET  46  -8.905  -3.808  -9.620
  340    HE1  MET  46           HE1      MET  46 -11.058  -2.849  -6.488
  341    HE2  MET  46           HE2      MET  46 -10.191  -1.349  -6.820
  342    HE3  MET  46           HE3      MET  46  -9.825  -2.272  -5.365
  343    H    THR  47           H        THR  47  -8.115  -0.875 -12.224
  344    HA   THR  47           HA       THR  47  -7.029  -3.334 -12.946
  345    HB   THR  47           HB       THR  47  -6.377  -0.782 -14.404
  346    HG1  THR  47           HG1      THR  47  -8.429  -0.565 -15.001
  347   HG21  THR  47          HG21      THR  47  -6.716  -2.197 -16.385
  348   HG22  THR  47          HG22      THR  47  -7.093  -3.566 -15.339
  349   HG23  THR  47          HG23      THR  47  -5.475  -2.863 -15.322
  350    H    LYS  48           H        LYS  48  -5.361  -0.246 -12.371
  351    HA   LYS  48           HA       LYS  48  -2.784  -1.426 -12.706
  352    HB2  LYS  48           HB2      LYS  48  -1.881   0.716 -12.000
  353    HB3  LYS  48           HB3      LYS  48  -3.118   0.905 -13.233
  354    HG2  LYS  48           HG2      LYS  48  -4.734   1.463 -11.439
  355    HG3  LYS  48           HG3      LYS  48  -3.392   1.428 -10.292
  356    HD2  LYS  48           HD2      LYS  48  -3.751   3.266 -12.649
  357    HD3  LYS  48           HD3      LYS  48  -3.721   3.685 -10.941
  358    HE2  LYS  48           HE2      LYS  48  -1.399   3.170 -10.769
  359    HE3  LYS  48           HE3      LYS  48  -1.384   2.468 -12.386
  360    HZ1  LYS  48           HZ1      LYS  48  -1.689   5.327 -11.659
  361    HZ2  LYS  48           HZ2      LYS  48  -1.998   4.732 -13.215
  362    HZ3  LYS  48           HZ3      LYS  48  -0.442   4.608 -12.557
  363    H    LEU  49           H        LEU  49  -4.915  -0.918 -10.015
  364    HA   LEU  49           HA       LEU  49  -3.093  -1.361  -7.917
  365    HG   LEU  49           HG       LEU  49  -6.134  -0.219  -6.229
  366    HB2  LEU  49           HB2      LEU  49  -6.018  -1.480  -8.259
  367    HB3  LEU  49           HB3      LEU  49  -5.383  -2.473  -6.963
  368   HD11  LEU  49          HD11      LEU  49  -4.159   0.270  -4.875
  369   HD12  LEU  49          HD12      LEU  49  -3.193  -0.785  -5.905
  370   HD13  LEU  49          HD13      LEU  49  -4.499  -1.459  -4.930
  371   HD21  LEU  49          HD21      LEU  49  -5.511   1.063  -8.190
  372   HD22  LEU  49          HD22      LEU  49  -3.806   0.722  -7.895
  373   HD23  LEU  49          HD23      LEU  49  -4.716   1.715  -6.755
  374    H    LYS  50           H        LYS  50  -4.945  -3.601  -9.945
  375    HA   LYS  50           HA       LYS  50  -4.263  -6.036  -8.821
  376    HB2  LYS  50           HB2      LYS  50  -4.313  -5.343 -11.762
  377    HB3  LYS  50           HB3      LYS  50  -4.482  -6.952 -11.085
  378    HG2  LYS  50           HG2      LYS  50  -6.615  -6.558 -10.318
  379    HG3  LYS  50           HG3      LYS  50  -6.401  -4.803 -10.319
  380    HD2  LYS  50           HD2      LYS  50  -7.803  -5.355 -12.152
  381    HD3  LYS  50           HD3      LYS  50  -6.233  -4.911 -12.805
  382    HE2  LYS  50           HE2      LYS  50  -5.707  -7.406 -12.792
  383    HE3  LYS  50           HE3      LYS  50  -7.437  -7.649 -12.545
  384    HZ1  LYS  50           HZ1      LYS  50  -7.846  -6.398 -14.599
  385    HZ2  LYS  50           HZ2      LYS  50  -6.888  -7.771 -14.879
  386    HZ3  LYS  50           HZ3      LYS  50  -6.170  -6.238 -14.832
  387    H    GLU  51           H        GLU  51  -2.472  -4.176 -11.255
  388    HA   GLU  51           HA       GLU  51  -0.220  -5.777 -11.524
  389    HB2  GLU  51           HB2      GLU  51  -0.412  -2.758 -11.622
  390    HB3  GLU  51           HB3      GLU  51   0.943  -3.699 -12.230
  391    HG2  GLU  51           HG2      GLU  51  -0.459  -4.723 -13.892
  392    HG3  GLU  51           HG3      GLU  51  -1.881  -3.909 -13.241
  393    H    LEU  52           H        LEU  52  -0.729  -3.035  -9.338
  394    HA   LEU  52           HA       LEU  52   1.759  -3.078  -8.072
  395    HG   LEU  52           HG       LEU  52  -0.322  -0.937  -8.987
  396    HB2  LEU  52           HB2      LEU  52  -0.905  -2.207  -6.953
  397    HB3  LEU  52           HB3      LEU  52   0.656  -1.809  -6.265
  398   HD11  LEU  52          HD11      LEU  52  -1.527   0.143  -7.157
  399   HD12  LEU  52          HD12      LEU  52  -0.471   1.279  -7.995
  400   HD13  LEU  52          HD13      LEU  52   0.005   0.625  -6.428
  401   HD21  LEU  52          HD21      LEU  52   2.110  -1.218  -8.889
  402   HD22  LEU  52          HD22      LEU  52   2.172  -0.188  -7.459
  403   HD23  LEU  52          HD23      LEU  52   1.662   0.483  -9.009
  404    H    ALA  53           H        ALA  53  -1.294  -4.625  -7.092
  405    HA   ALA  53           HA       ALA  53  -0.293  -5.705  -4.683
  406    HB1  ALA  53           HB1      ALA  53  -2.288  -7.102  -4.687
  407    HB2  ALA  53           HB2      ALA  53  -2.585  -6.691  -6.377
  408    HB3  ALA  53           HB3      ALA  53  -2.685  -5.443  -5.136
  409    H    ALA  54           H        ALA  54  -0.586  -7.058  -7.943
  410    HA   ALA  54           HA       ALA  54   0.276  -9.669  -7.307
  411    HB1  ALA  54           HB1      ALA  54  -0.924  -9.137  -9.368
  412    HB2  ALA  54           HB2      ALA  54   0.605  -9.948  -9.711
  413    HB3  ALA  54           HB3      ALA  54   0.459  -8.205  -9.936
  414    H    ALA  55           H        ALA  55   2.003  -6.720  -8.021
  415    HA   ALA  55           HA       ALA  55   4.542  -8.037  -8.375
  416    HB1  ALA  55           HB1      ALA  55   3.924  -5.106  -8.015
  417    HB2  ALA  55           HB2      ALA  55   4.025  -5.957  -9.557
  418    HB3  ALA  55           HB3      ALA  55   5.460  -5.793  -8.545
  419    H    ALA  56           H        ALA  56   2.954  -6.147  -5.842
  420    HA   ALA  56           HA       ALA  56   5.159  -6.019  -4.090
  421    HB1  ALA  56           HB1      ALA  56   3.557  -5.335  -2.397
  422    HB2  ALA  56           HB2      ALA  56   2.223  -5.890  -3.408
  423    HB3  ALA  56           HB3      ALA  56   3.216  -4.527  -3.928
  424    H    SER  57           H        SER  57   2.395  -8.245  -4.220
  425    HA   SER  57           HA       SER  57   3.583  -9.831  -2.093
  426    HG   SER  57           HG       SER  57   0.831  -9.362  -4.311
  427    HB2  SER  57           HB2      SER  57   1.511 -11.180  -2.230
  428    HB3  SER  57           HB3      SER  57   1.164  -9.464  -1.997
  429    H    SER  58           H        SER  58   4.672 -11.670  -2.399
  430    HA   SER  58           HA       SER  58   5.378 -12.478  -5.057
  431    HG   SER  58           HG       SER  58   6.984 -11.619  -3.682
  432    HB2  SER  58           HB2      SER  58   5.943 -13.793  -2.397
  433    HB3  SER  58           HB3      SER  58   6.705 -14.218  -3.929
  434    H    ALA  59           H        ALA  59   2.544 -12.824  -3.781
  435    HA   ALA  59           HA       ALA  59   1.976 -15.596  -4.167
  436    HB1  ALA  59           HB1      ALA  59   0.559 -14.160  -2.761
  437    HB2  ALA  59           HB2      ALA  59  -0.365 -14.927  -4.053
  438    HB3  ALA  59           HB3      ALA  59   0.099 -13.231  -4.188
  439    H    ASP  60           H        ASP  60   2.083 -12.731  -6.128
  440    HA   ASP  60           HA       ASP  60   2.198 -12.388  -8.347
  441    HB2  ASP  60           HB2      ASP  60   2.375 -15.394  -8.441
  442    HB3  ASP  60           HB3      ASP  60   2.444 -14.388  -9.886
  443    H    GLU  61           H        GLU  61  -0.070 -15.076  -7.723
  444    HA   GLU  61           HA       GLU  61  -1.888 -14.358  -9.768
  445    HB2  GLU  61           HB2      GLU  61  -2.379 -15.823  -7.168
  446    HB3  GLU  61           HB3      GLU  61  -3.537 -15.712  -8.485
  447    HG2  GLU  61           HG2      GLU  61  -1.950 -16.885  -9.951
  448    HG3  GLU  61           HG3      GLU  61  -0.842 -17.046  -8.587
  449    H    GLY  62           H        GLY  62  -1.397 -13.252  -6.517
  450    HA2  GLY  62           HA2      GLY  62  -2.150 -10.838  -6.313
  451    HA3  GLY  62           HA3      GLY  62  -3.732 -11.473  -6.746
  452    H    ALA  63           H        ALA  63  -3.429 -10.090  -4.422
  453    HA   ALA  63           HA       ALA  63  -3.221 -12.039  -2.269
  454    HB1  ALA  63           HB1      ALA  63  -3.545 -10.129  -0.779
  455    HB2  ALA  63           HB2      ALA  63  -3.830  -9.082  -2.170
  456    HB3  ALA  63           HB3      ALA  63  -2.246  -9.818  -1.930
  457    H    SER  64           H        SER  64  -5.030 -11.895  -0.569
  458    HA   SER  64           HA       SER  64  -7.532 -12.451  -1.841
  459    HG   SER  64           HG       SER  64  -6.921 -14.330  -0.741
  460    HB2  SER  64           HB2      SER  64  -6.786 -12.183   1.080
  461    HB3  SER  64           HB3      SER  64  -8.348 -12.748   0.493
  462    H    VAL  65           H        VAL  65  -8.225 -10.604  -2.865
  463    HA   VAL  65           HA       VAL  65  -8.484  -8.188  -1.239
  464    HB   VAL  65           HB       VAL  65  -7.249  -7.768  -3.236
  465   HG11  VAL  65          HG11      VAL  65  -7.983  -9.693  -4.551
  466   HG12  VAL  65          HG12      VAL  65  -8.108  -8.198  -5.477
  467   HG13  VAL  65          HG13      VAL  65  -9.558  -8.932  -4.791
  468   HG21  VAL  65          HG21      VAL  65 -10.068  -6.739  -3.558
  469   HG22  VAL  65          HG22      VAL  65  -8.637  -6.067  -4.338
  470   HG23  VAL  65          HG23      VAL  65  -8.793  -6.008  -2.583
  471    H    ALA  66           H        ALA  66 -10.341  -7.904  -0.305
  472    HA   ALA  66           HA       ALA  66 -12.814  -8.603  -1.718
  473    HB1  ALA  66           HB1      ALA  66 -12.613  -9.313   0.638
  474    HB2  ALA  66           HB2      ALA  66 -13.947  -8.186   0.396
  475    HB3  ALA  66           HB3      ALA  66 -12.439  -7.625   1.118
  476    H    TYR  67           H        TYR  67 -13.120  -7.026  -3.212
  477    HA   TYR  67           HA       TYR  67 -12.718  -4.246  -2.352
  478    HD1  TYR  67           HD1      TYR  67 -11.964  -7.369  -4.930
  479    HD2  TYR  67           HD2      TYR  67 -13.894  -3.909  -6.481
  480    HE1  TYR  67           HE1      TYR  67 -12.801  -8.694  -6.822
  481    HE2  TYR  67           HE2      TYR  67 -14.741  -5.226  -8.378
  482    HH   TYR  67           HH       TYR  67 -14.694  -8.600  -8.438
  483    HB2  TYR  67           HB2      TYR  67 -12.398  -3.684  -4.692
  484    HB3  TYR  67           HB3      TYR  67 -11.316  -4.996  -4.245
  485    H    LYS  68           H        LYS  68 -14.198  -2.653  -2.968
  486    HA   LYS  68           HA       LYS  68 -16.770  -3.525  -4.044
  487    HB2  LYS  68           HB2      LYS  68 -18.048  -2.570  -2.263
  488    HB3  LYS  68           HB3      LYS  68 -16.884  -3.665  -1.533
  489    HG2  LYS  68           HG2      LYS  68 -15.432  -1.678  -1.073
  490    HG3  LYS  68           HG3      LYS  68 -16.763  -0.662  -1.617
  491    HD2  LYS  68           HD2      LYS  68 -16.869  -0.774   0.763
  492    HD3  LYS  68           HD3      LYS  68 -18.197  -1.740   0.121
  493    HE2  LYS  68           HE2      LYS  68 -17.478  -3.486   1.281
  494    HE3  LYS  68           HE3      LYS  68 -15.962  -3.452   0.381
  495    HZ1  LYS  68           HZ1      LYS  68 -15.574  -3.309   2.763
  496    HZ2  LYS  68           HZ2      LYS  68 -16.537  -1.920   2.861
  497    HZ3  LYS  68           HZ3      LYS  68 -15.076  -1.879   1.993
  498    H    ILE  69           H        ILE  69 -17.909  -1.871  -5.025
  499    HA   ILE  69           HA       ILE  69 -16.574   0.753  -5.143
  500    HB   ILE  69           HB       ILE  69 -18.263  -0.424  -7.363
  501   HG12  ILE  69          HG12      ILE  69 -15.916  -0.379  -8.548
  502   HG13  ILE  69          HG13      ILE  69 -15.298  -0.508  -6.905
  503   HG21  ILE  69          HG21      ILE  69 -17.375   1.430  -8.673
  504   HG22  ILE  69          HG22      ILE  69 -16.461   1.990  -7.273
  505   HG23  ILE  69          HG23      ILE  69 -18.224   2.012  -7.242
  506   HD11  ILE  69          HD11      ILE  69 -16.558  -2.582  -6.601
  507   HD12  ILE  69          HD12      ILE  69 -15.446  -2.689  -7.966
  508   HD13  ILE  69          HD13      ILE  69 -17.170  -2.448  -8.249
  509    H    LYS  70           H        LYS  70 -17.750   2.142  -3.996
  510    HA   LYS  70           HA       LYS  70 -20.593   1.561  -3.645
  511    HB2  LYS  70           HB2      LYS  70 -19.100   1.855  -1.673
  512    HB3  LYS  70           HB3      LYS  70 -18.889   3.536  -2.134
  513    HG2  LYS  70           HG2      LYS  70 -20.539   3.326  -0.376
  514    HG3  LYS  70           HG3      LYS  70 -21.296   3.897  -1.865
  515    HD2  LYS  70           HD2      LYS  70 -22.128   1.675  -2.339
  516    HD3  LYS  70           HD3      LYS  70 -21.282   1.030  -0.932
  517    HE2  LYS  70           HE2      LYS  70 -23.479   3.092  -0.850
  518    HE3  LYS  70           HE3      LYS  70 -23.688   1.371  -0.526
  519    HZ1  LYS  70           HZ1      LYS  70 -23.473   2.498   1.540
  520    HZ2  LYS  70           HZ2      LYS  70 -22.073   3.309   1.041
  521    HZ3  LYS  70           HZ3      LYS  70 -22.036   1.630   1.291
  522    H    ASP  71           H        ASP  71 -22.004   2.579  -4.758
  523    HA   ASP  71           HA       ASP  71 -21.399   4.888  -6.344
  524    HB2  ASP  71           HB2      ASP  71 -23.977   3.393  -5.807
  525    HB3  ASP  71           HB3      ASP  71 -23.840   4.736  -6.927
  526    H    LEU  72           H        LEU  72 -21.160   6.800  -5.301
  527    HA   LEU  72           HA       LEU  72 -22.964   7.388  -3.053
  528    HG   LEU  72           HG       LEU  72 -20.021   6.356  -2.767
  529    HB2  LEU  72           HB2      LEU  72 -20.280   8.603  -3.718
  530    HB3  LEU  72           HB3      LEU  72 -21.287   9.060  -2.358
  531   HD11  LEU  72          HD11      LEU  72 -18.592   6.975  -0.897
  532   HD12  LEU  72          HD12      LEU  72 -19.350   8.566  -0.833
  533   HD13  LEU  72          HD13      LEU  72 -18.395   8.101  -2.241
  534   HD21  LEU  72          HD21      LEU  72 -21.619   7.454  -0.453
  535   HD22  LEU  72          HD22      LEU  72 -20.774   5.907  -0.473
  536   HD23  LEU  72          HD23      LEU  72 -22.131   6.184  -1.565
  537    H    GLU  73           H        GLU  73 -22.869   9.993  -2.797
  538    HA   GLU  73           HA       GLU  73 -24.378  10.907  -5.114
  539    HB2  GLU  73           HB2      GLU  73 -24.034  12.190  -2.398
  540    HB3  GLU  73           HB3      GLU  73 -25.203  12.646  -3.630
  541    HG2  GLU  73           HG2      GLU  73 -26.419  10.638  -3.349
  542    HG3  GLU  73           HG3      GLU  73 -25.146   9.925  -2.360
  543    H    GLY  74           H        GLY  74 -22.990  11.629  -6.638
  544    HA2  GLY  74           HA2      GLY  74 -21.909  13.495  -7.589
  545    HA3  GLY  74           HA3      GLY  74 -21.508  14.062  -5.975
  546    H    GLN  75           H        GLN  75 -20.737  10.964  -5.776
  547    HA   GLN  75           HA       GLN  75 -18.275  10.874  -7.241
  548    HB2  GLN  75           HB2      GLN  75 -16.817  10.743  -5.235
  549    HB3  GLN  75           HB3      GLN  75 -17.535  12.334  -5.445
  550    HG2  GLN  75           HG2      GLN  75 -19.192  11.823  -3.727
  551    HG3  GLN  75           HG3      GLN  75 -18.496  10.215  -3.529
  552   HE21  GLN  75          HE21      GLN  75 -18.049  10.610  -1.357
  553   HE22  GLN  75          HE22      GLN  75 -16.747  11.636  -0.852
  554    H    VAL  76           H        VAL  76 -16.979   8.858  -6.337
  555    HA   VAL  76           HA       VAL  76 -18.869   6.866  -5.280
  556    HB   VAL  76           HB       VAL  76 -17.854   5.127  -6.703
  557   HG11  VAL  76          HG11      VAL  76 -19.035   7.445  -8.227
  558   HG12  VAL  76          HG12      VAL  76 -19.931   6.164  -7.407
  559   HG13  VAL  76          HG13      VAL  76 -18.931   5.783  -8.809
  560   HG21  VAL  76          HG21      VAL  76 -16.467   7.432  -8.066
  561   HG22  VAL  76          HG22      VAL  76 -16.475   5.758  -8.621
  562   HG23  VAL  76          HG23      VAL  76 -15.693   6.179  -7.097
  563    H    GLU  77           H        GLU  77 -17.941   5.225  -4.039
  564    HA   GLU  77           HA       GLU  77 -15.295   5.925  -2.964
  565    HB2  GLU  77           HB2      GLU  77 -17.242   5.937  -1.399
  566    HB3  GLU  77           HB3      GLU  77 -17.473   4.225  -1.728
  567    HG2  GLU  77           HG2      GLU  77 -15.271   3.747  -0.785
  568    HG3  GLU  77           HG3      GLU  77 -15.034   5.466  -0.465
  569    H    LEU  78           H        LEU  78 -13.722   4.734  -3.794
  570    HA   LEU  78           HA       LEU  78 -14.271   1.957  -4.553
  571    HG   LEU  78           HG       LEU  78 -11.548   2.060  -7.073
  572    HB2  LEU  78           HB2      LEU  78 -13.101   3.555  -6.144
  573    HB3  LEU  78           HB3      LEU  78 -11.750   3.558  -5.033
  574   HD11  LEU  78          HD11      LEU  78 -10.443   0.269  -5.863
  575   HD12  LEU  78          HD12      LEU  78 -11.262   0.748  -4.375
  576   HD13  LEU  78          HD13      LEU  78 -10.089   1.832  -5.123
  577   HD21  LEU  78          HD21      LEU  78 -12.632  -0.116  -6.960
  578   HD22  LEU  78          HD22      LEU  78 -13.819   1.185  -7.053
  579   HD23  LEU  78          HD23      LEU  78 -13.505   0.385  -5.512
  580    H    ASP  79           H        ASP  79 -13.908   0.480  -3.056
  581    HA   ASP  79           HA       ASP  79 -11.712   0.934  -1.145
  582    HB2  ASP  79           HB2      ASP  79 -13.779   1.414   0.046
  583    HB3  ASP  79           HB3      ASP  79 -14.480  -0.108  -0.490
  584    H    ALA  80           H        ALA  80 -10.437  -0.779  -0.756
  585    HA   ALA  80           HA       ALA  80 -11.291  -3.436  -1.635
  586    HB1  ALA  80           HB1      ALA  80 -10.184  -2.459  -3.580
  587    HB2  ALA  80           HB2      ALA  80  -9.236  -3.790  -2.914
  588    HB3  ALA  80           HB3      ALA  80  -8.754  -2.121  -2.604
  589    H    ALA  81           H        ALA  81 -10.818  -4.857  -0.114
  590    HA   ALA  81           HA       ALA  81  -8.724  -4.237   1.843
  591    HB1  ALA  81           HB1      ALA  81 -10.945  -4.778   2.720
  592    HB2  ALA  81           HB2      ALA  81  -9.750  -5.977   3.215
  593    HB3  ALA  81           HB3      ALA  81 -10.885  -6.346   1.915
  594    H    PHE  82           H        PHE  82  -6.805  -4.889   1.009
  595    HA   PHE  82           HA       PHE  82  -6.614  -7.473  -0.353
  596    HD1  PHE  82           HD1      PHE  82  -5.847  -3.534  -0.752
  597    HD2  PHE  82           HD2      PHE  82  -5.000  -7.068  -2.975
  598    HE1  PHE  82           HE1      PHE  82  -6.462  -2.373  -2.832
  599    HE2  PHE  82           HE2      PHE  82  -5.619  -5.912  -5.055
  600    HZ   PHE  82           HZ       PHE  82  -6.351  -3.564  -4.988
  601    HB2  PHE  82           HB2      PHE  82  -4.528  -5.344   0.189
  602    HB3  PHE  82           HB3      PHE  82  -4.236  -6.821  -0.713
  603    H    THR  83           H        THR  83  -6.494  -9.179   0.957
  604    HA   THR  83           HA       THR  83  -4.919  -9.013   3.413
  605    HB   THR  83           HB       THR  83  -6.564 -11.327   2.363
  606    HG1  THR  83           HG1      THR  83  -8.092  -9.895   2.872
  607   HG21  THR  83          HG21      THR  83  -5.410 -10.766   5.100
  608   HG22  THR  83          HG22      THR  83  -4.843 -11.994   3.968
  609   HG23  THR  83          HG23      THR  83  -6.449 -12.130   4.684
  610    H    PHE  84           H        PHE  84  -2.812  -9.220   3.049
  611    HA   PHE  84           HA       PHE  84  -1.825 -10.896   0.900
  612    HD1  PHE  84           HD2      PHE  84  -1.706  -7.206   2.551
  613    HD2  PHE  84           HD1      PHE  84   0.146  -9.241  -0.690
  614    HE1  PHE  84           HE2      PHE  84  -2.101  -5.254   1.101
  615    HE2  PHE  84           HE1      PHE  84  -0.241  -7.297  -2.143
  616    HZ   PHE  84           HZ       PHE  84  -1.369  -5.299  -1.250
  617    HB2  PHE  84           HB2      PHE  84  -0.364  -9.182   2.922
  618    HB3  PHE  84           HB3      PHE  84   0.400 -10.027   1.581
  619    H    SER  85           H        SER  85  -0.445 -12.668   1.175
  620    HA   SER  85           HA       SER  85  -0.985 -14.391   3.330
  621    HG   SER  85           HG       SER  85  -0.621 -16.021   0.603
  622    HB2  SER  85           HB2      SER  85   1.399 -14.554   1.479
  623    HB3  SER  85           HB3      SER  85   0.588 -15.883   2.306
  624    H    CYS  86           H        CYS  86   1.536 -12.053   2.748
  625    HA   CYS  86           HA       CYS  86   2.579 -12.557   5.448
  626    HG   CYS  86           HG       CYS  86   5.631 -14.275   3.855
  627    HB2  CYS  86           HB2      CYS  86   4.205 -11.635   3.070
  628    HB3  CYS  86           HB3      CYS  86   4.809 -11.978   4.685
  629    H    GLN  87           H        GLN  87   2.995 -10.733   6.679
  630    HA   GLN  87           HA       GLN  87   1.514  -8.404   6.020
  631    HB2  GLN  87           HB2      GLN  87   1.763  -8.988   8.330
  632    HB3  GLN  87           HB3      GLN  87   3.518  -8.947   8.208
  633    HG2  GLN  87           HG2      GLN  87   3.559  -6.607   8.039
  634    HG3  GLN  87           HG3      GLN  87   1.825  -6.514   7.737
  635   HE21  GLN  87          HE21      GLN  87   0.396  -6.753   9.458
  636   HE22  GLN  87          HE22      GLN  87   0.916  -6.627  11.106
  637    H    ALA  88           H        ALA  88   4.848  -9.315   5.633
  638    HA   ALA  88           HA       ALA  88   6.062  -6.854   5.228
  639    HB1  ALA  88           HB1      ALA  88   6.631  -9.435   3.769
  640    HB2  ALA  88           HB2      ALA  88   7.280  -8.977   5.344
  641    HB3  ALA  88           HB3      ALA  88   7.720  -8.054   3.908
  642    H    GLU  89           H        GLU  89   4.139  -8.814   3.020
  643    HA   GLU  89           HA       GLU  89   4.636  -7.305   0.672
  644    HB2  GLU  89           HB2      GLU  89   2.054  -8.770   1.128
  645    HB3  GLU  89           HB3      GLU  89   3.001  -8.633  -0.344
  646    HG2  GLU  89           HG2      GLU  89   3.852 -10.220   2.063
  647    HG3  GLU  89           HG3      GLU  89   2.989 -10.896   0.686
  648    H    MET  90           H        MET  90   2.482  -6.928   3.366
  649    HA   MET  90           HA       MET  90   0.644  -5.158   2.062
  650    HB2  MET  90           HB2      MET  90   0.028  -6.615   3.989
  651    HB3  MET  90           HB3      MET  90   1.062  -5.641   5.022
  652    HG2  MET  90           HG2      MET  90  -1.166  -4.375   3.479
  653    HG3  MET  90           HG3      MET  90  -1.485  -5.217   4.993
  654    HE1  MET  90           HE1      MET  90   0.617  -3.138   7.552
  655    HE2  MET  90           HE2      MET  90   1.083  -4.614   6.704
  656    HE3  MET  90           HE3      MET  90  -0.549  -4.445   7.350
  657    H    ILE  91           H        ILE  91   3.275  -4.731   4.430
  658    HA   ILE  91           HA       ILE  91   2.953  -1.937   4.610
  659    HB   ILE  91           HB       ILE  91   5.391  -2.054   5.493
  660   HG12  ILE  91          HG12      ILE  91   4.646  -4.976   5.663
  661   HG13  ILE  91          HG13      ILE  91   5.803  -4.330   4.509
  662   HG21  ILE  91          HG21      ILE  91   3.098  -3.430   6.877
  663   HG22  ILE  91          HG22      ILE  91   3.450  -1.701   6.889
  664   HG23  ILE  91          HG23      ILE  91   4.555  -2.833   7.670
  665   HD11  ILE  91          HD11      ILE  91   6.046  -4.233   7.506
  666   HD12  ILE  91          HD12      ILE  91   7.213  -3.573   6.361
  667   HD13  ILE  91          HD13      ILE  91   6.924  -5.312   6.422
  668    H    ILE  92           H        ILE  92   4.985  -3.944   2.491
  669    HA   ILE  92           HA       ILE  92   6.408  -1.738   1.389
  670    HB   ILE  92           HB       ILE  92   7.028  -3.249  -0.446
  671   HG12  ILE  92          HG12      ILE  92   5.256  -5.271   0.930
  672   HG13  ILE  92          HG13      ILE  92   4.910  -4.498  -0.613
  673   HG21  ILE  92          HG21      ILE  92   8.266  -4.873   0.909
  674   HG22  ILE  92          HG22      ILE  92   7.259  -4.464   2.298
  675   HG23  ILE  92          HG23      ILE  92   8.328  -3.250   1.596
  676   HD11  ILE  92          HD11      ILE  92   5.768  -6.730  -0.948
  677   HD12  ILE  92          HD12      ILE  92   7.218  -6.335  -0.026
  678   HD13  ILE  92          HD13      ILE  92   6.911  -5.539  -1.570
  679    H    PHE  93           H        PHE  93   3.349  -3.240   0.738
  680    HA   PHE  93           HA       PHE  93   2.779  -2.053  -1.753
  681    HD1  PHE  93           HD1      PHE  93   1.133  -3.189  -3.264
  682    HD2  PHE  93           HD2      PHE  93  -1.239  -2.036   0.082
  683    HE1  PHE  93           HE1      PHE  93  -0.765  -2.742  -4.763
  684    HE2  PHE  93           HE2      PHE  93  -3.140  -1.587  -1.414
  685    HZ   PHE  93           HZ       PHE  93  -2.903  -1.942  -3.838
  686    HB2  PHE  93           HB2      PHE  93   1.532  -3.962  -0.751
  687    HB3  PHE  93           HB3      PHE  93   0.863  -2.866   0.448
  688    H    GLU  94           H        GLU  94   2.053  -1.068   1.581
  689    HA   GLU  94           HA       GLU  94   0.685   1.305   1.083
  690    HB2  GLU  94           HB2      GLU  94   2.558   0.594   3.346
  691    HB3  GLU  94           HB3      GLU  94   1.498   1.996   3.344
  692    HG2  GLU  94           HG2      GLU  94   0.576  -0.861   3.155
  693    HG3  GLU  94           HG3      GLU  94   0.599   0.109   4.628
  694    H    LEU  95           H        LEU  95   4.158   0.779   1.526
  695    HA   LEU  95           HA       LEU  95   5.067   3.395   1.406
  696    HG   LEU  95           HG       LEU  95   5.857   0.669   2.701
  697    HB2  LEU  95           HB2      LEU  95   6.424   0.941   0.277
  698    HB3  LEU  95           HB3      LEU  95   7.210   2.455   0.675
  699   HD11  LEU  95          HD11      LEU  95   8.128   0.051   3.378
  700   HD12  LEU  95          HD12      LEU  95   8.776   0.965   2.014
  701   HD13  LEU  95          HD13      LEU  95   7.773  -0.456   1.726
  702   HD21  LEU  95          HD21      LEU  95   7.075   2.044   4.325
  703   HD22  LEU  95          HD22      LEU  95   5.954   3.009   3.364
  704   HD23  LEU  95          HD23      LEU  95   7.679   3.052   3.009
  705    H    SER  96           H        SER  96   4.233   1.186  -1.192
  706    HA   SER  96           HA       SER  96   5.358   2.898  -3.226
  707    HG   SER  96           HG       SER  96   5.533  -0.344  -2.541
  708    HB2  SER  96           HB2      SER  96   3.751   0.349  -3.523
  709    HB3  SER  96           HB3      SER  96   4.717   1.129  -4.776
  710    H    LEU  97           H        LEU  97   2.284   2.465  -1.741
  711    HA   LEU  97           HA       LEU  97   0.638   3.301  -3.883
  712    HG   LEU  97           HG       LEU  97   0.257   1.147  -1.725
  713    HB2  LEU  97           HB2      LEU  97   0.226   3.453  -0.900
  714    HB3  LEU  97           HB3      LEU  97  -1.006   3.866  -2.077
  715   HD11  LEU  97          HD11      LEU  97  -1.982   0.495  -0.964
  716   HD12  LEU  97          HD12      LEU  97  -2.503   2.177  -1.084
  717   HD13  LEU  97          HD13      LEU  97  -1.260   1.718   0.080
  718   HD21  LEU  97          HD21      LEU  97  -0.319   1.627  -4.062
  719   HD22  LEU  97          HD22      LEU  97  -1.959   2.042  -3.567
  720   HD23  LEU  97          HD23      LEU  97  -1.369   0.392  -3.369
  721    H    ARG  98           H        ARG  98   1.986   5.111  -1.120
  722    HA   ARG  98           HA       ARG  98   0.895   7.574  -2.117
  723    HE   ARG  98           HE       ARG  98   0.463   9.929   0.486
  724    HB2  ARG  98           HB2      ARG  98   2.806   7.030   0.148
  725    HB3  ARG  98           HB3      ARG  98   2.252   8.643  -0.288
  726    HG2  ARG  98           HG2      ARG  98  -0.117   7.630  -0.040
  727    HG3  ARG  98           HG3      ARG  98   0.707   6.368   0.874
  728    HD2  ARG  98           HD2      ARG  98  -0.073   8.020   2.409
  729    HD3  ARG  98           HD3      ARG  98   1.683   8.138   2.321
  730   HH11  ARG  98          HH11      ARG  98   1.083   9.518   3.909
  731   HH12  ARG  98          HH12      ARG  98   1.045  11.220   4.255
  732   HH21  ARG  98          HH21      ARG  98   0.394  12.164   0.933
  733   HH22  ARG  98          HH22      ARG  98   0.673  12.730   2.555
  734    H    SER  99           H        SER  99   3.937   5.911  -2.397
  735    HA   SER  99           HA       SER  99   5.388   8.170  -3.382
  736    HG   SER  99           HG       SER  99   6.180   5.493  -1.529
  737    HB2  SER  99           HB2      SER  99   6.013   5.217  -3.637
  738    HB3  SER  99           HB3      SER  99   7.140   6.545  -3.923
  739    H    LEU 100           H        LEU 100   2.853   6.636  -4.727
  740    HA   LEU 100           HA       LEU 100   3.933   6.605  -7.450
  741    HG   LEU 100           HG       LEU 100   1.143   6.099  -8.782
  742    HB2  LEU 100           HB2      LEU 100   2.732   4.606  -6.690
  743    HB3  LEU 100           HB3      LEU 100   1.310   5.577  -6.371
  744   HD11  LEU 100          HD11      LEU 100   3.483   5.862  -9.388
  745   HD12  LEU 100          HD12      LEU 100   2.475   4.806 -10.378
  746   HD13  LEU 100          HD13      LEU 100   3.414   4.135  -9.044
  747   HD21  LEU 100          HD21      LEU 100  -0.134   4.255  -7.841
  748   HD22  LEU 100          HD22      LEU 100   1.223   3.161  -8.113
  749   HD23  LEU 100          HD23      LEU 100   0.384   3.883  -9.485
  750    H    ALA 101           H        ALA 101   1.096   7.835  -5.658
  751    HA   ALA 101           HA       ALA 101   0.713   9.797  -7.823
  752    HB1  ALA 101           HB1      ALA 101  -1.627   9.894  -7.167
  753    HB2  ALA 101           HB2      ALA 101  -1.322   8.754  -5.856
  754    HB3  ALA 101           HB3      ALA 101  -1.150   8.236  -7.534
  755    H    LEU 102           H        LEU 102   2.045   9.597  -4.902
  756    HA   LEU 102           HA       LEU 102   2.725  11.032  -3.315
  757    HG   LEU 102           HG       LEU 102   3.331  12.068  -6.197
  758    HB2  LEU 102           HB2      LEU 102   1.433  13.133  -5.052
  759    HB3  LEU 102           HB3      LEU 102   2.452  13.455  -3.666
  760   HD11  LEU 102          HD11      LEU 102   4.658  14.087  -6.575
  761   HD12  LEU 102          HD12      LEU 102   3.942  14.825  -5.142
  762   HD13  LEU 102          HD13      LEU 102   2.931  14.445  -6.536
  763   HD21  LEU 102          HD21      LEU 102   4.921  12.905  -3.776
  764   HD22  LEU 102          HD22      LEU 102   5.572  12.202  -5.256
  765   HD23  LEU 102          HD23      LEU 102   4.512  11.248  -4.219
  766    H    GLU 103           H        GLU 103  -0.358  12.450  -4.330
  767    HA   GLU 103           HA       GLU 103  -2.192  13.121  -3.180
  768    HB2  GLU 103           HB2      GLU 103  -1.595  10.419  -2.057
  769    HB3  GLU 103           HB3      GLU 103  -2.894  11.370  -1.347
  770    HG2  GLU 103           HG2      GLU 103  -2.716  10.777  -4.289
  771    HG3  GLU 103           HG3      GLU 103  -3.562   9.737  -3.142
  772    H    HIS 104           H        HIS 104  -1.743  14.987  -2.162
  773    HA   HIS 104           HA       HIS 104  -0.464  14.935   0.453
  774    HD1  HIS 104           HD1      HIS 104  -1.615  19.266   0.532
  775    HD2  HIS 104           HD2      HIS 104   1.402  16.564   1.481
  776    HE1  HIS 104           HE1      HIS 104  -0.423  20.247   2.520
  777    HE2  HIS 104           HE2      HIS 104   1.241  18.480   3.212
  778    HB2  HIS 104           HB2      HIS 104   0.034  16.722  -1.266
  779    HB3  HIS 104           HB3      HIS 104  -1.597  17.331  -1.009
  780    H    HIS 105           H        HIS 105  -3.210  13.849  -0.286
  781    HA   HIS 105           HA       HIS 105  -5.097  15.414   1.173
  782    HD1  HIS 105           HD1      HIS 105  -5.539  13.447  -2.438
  783    HD2  HIS 105           HD2      HIS 105  -7.907  15.449   0.345
  784    HE1  HIS 105           HE1      HIS 105  -7.149  14.834  -3.781
  785    HE2  HIS 105           HE2      HIS 105  -8.536  16.085  -2.084
  786    HB2  HIS 105           HB2      HIS 105  -5.110  12.701  -0.081
  787    HB3  HIS 105           HB3      HIS 105  -6.354  13.090   1.102
  788    H    HIS 106           H        HIS 106  -5.184  15.620   3.264
  789    HA   HIS 106           HA       HIS 106  -3.652  13.928   5.009
  790    HD1  HIS 106           HD1      HIS 106  -5.493  17.830   4.185
  791    HD2  HIS 106           HD2      HIS 106  -7.262  15.579   7.209
  792    HE1  HIS 106           HE1      HIS 106  -7.811  18.773   4.474
  793    HE2  HIS 106           HE2      HIS 106  -8.843  17.439   6.350
  794    HB2  HIS 106           HB2      HIS 106  -4.463  15.390   6.809
  795    HB3  HIS 106           HB3      HIS 106  -3.839  16.334   5.462
  796    H    HIS 107           H        HIS 107  -4.700  13.064   7.051
  797    HA   HIS 107           HA       HIS 107  -6.962  11.415   6.213
  798    HD1  HIS 107           HD1      HIS 107  -5.684   8.780   5.891
  799    HD2  HIS 107           HD2      HIS 107  -2.751  11.017   7.826
  800    HE1  HIS 107           HE1      HIS 107  -3.488   8.007   4.928
  801    HE2  HIS 107           HE2      HIS 107  -1.720   9.290   6.191
  802    HB2  HIS 107           HB2      HIS 107  -5.328  11.236   8.759
  803    HB3  HIS 107           HB3      HIS 107  -6.451  10.028   8.141
  804    H    HIS 108           H        HIS 108  -8.979  11.935   6.760
  805    HA   HIS 108           HA       HIS 108  -9.554  14.219   8.294
  806    HD1  HIS 108           HD1      HIS 108 -11.476  11.147   5.471
  807    HD2  HIS 108           HD2      HIS 108 -12.502  11.199   9.504
  808    HE1  HIS 108           HE1      HIS 108 -12.565   8.929   5.927
  809    HE2  HIS 108           HE2      HIS 108 -13.360   9.064   8.316
  810    HB2  HIS 108           HB2      HIS 108 -11.892  13.679   8.021
  811    HB3  HIS 108           HB3      HIS 108 -11.049  13.365   6.513
  812    H    HIS 109           H        HIS 109 -10.402  14.524  10.307
  813    HA   HIS 109           HA       HIS 109 -10.556  12.194  12.086
  814    HD1  HIS 109           HD1      HIS 109  -6.823  14.136  11.536
  815    HD2  HIS 109           HD2      HIS 109  -8.434  11.028  13.784
  816    HE1  HIS 109           HE1      HIS 109  -5.050  12.351  11.600
  817    HE2  HIS 109           HE2      HIS 109  -5.981  10.554  13.109
  818    HB2  HIS 109           HB2      HIS 109  -9.013  14.739  12.571
  819    HB3  HIS 109           HB3      HIS 109  -9.566  13.724  13.896
  Start of MODEL   19
    1    HA   MET   1           HA       MET   1  52.249  -0.093  30.746
    2    H1   MET   1           H1       MET   1  53.618   1.590  31.729
    3    H2   MET   1           H2       MET   1  52.349   2.711  31.683
    4    H3   MET   1           H3       MET   1  53.017   2.132  30.238
    5    HB2  MET   1           HB2      MET   1  50.962   1.265  33.124
    6    HB3  MET   1           HB3      MET   1  50.599  -0.369  32.593
    7    HG2  MET   1           HG2      MET   1  52.088  -0.550  34.413
    8    HG3  MET   1           HG3      MET   1  53.007  -0.933  32.961
    9    HE1  MET   1           HE1      MET   1  51.895   2.585  34.387
   10    HE2  MET   1           HE2      MET   1  53.333   3.035  35.302
   11    HE3  MET   1           HE3      MET   1  52.356   1.661  35.817
   12    H    ALA   2           H        ALA   2  51.452   0.562  28.710
   13    HA   ALA   2           HA       ALA   2  48.606   0.825  28.650
   14    HB1  ALA   2           HB1      ALA   2  48.470   2.916  27.406
   15    HB2  ALA   2           HB2      ALA   2  50.216   3.128  27.537
   16    HB3  ALA   2           HB3      ALA   2  49.211   3.189  28.985
   17    H    MET   3           H        MET   3  48.803  -1.112  27.488
   18    HA   MET   3           HA       MET   3  50.277  -1.004  24.951
   19    HB2  MET   3           HB2      MET   3  49.064  -3.367  26.402
   20    HB3  MET   3           HB3      MET   3  49.943  -3.461  24.885
   21    HG2  MET   3           HG2      MET   3  51.568  -4.056  26.372
   22    HG3  MET   3           HG3      MET   3  51.849  -2.322  26.250
   23    HE1  MET   3           HE1      MET   3  49.004  -4.293  28.112
   24    HE2  MET   3           HE2      MET   3  49.649  -4.370  29.753
   25    HE3  MET   3           HE3      MET   3  50.445  -5.252  28.449
   26    H    LYS   4           H        LYS   4  47.905   0.483  25.085
   27    HA   LYS   4           HA       LYS   4  45.816  -1.077  23.839
   28    HB2  LYS   4           HB2      LYS   4  46.032   1.918  24.204
   29    HB3  LYS   4           HB3      LYS   4  44.620   1.071  23.590
   30    HG2  LYS   4           HG2      LYS   4  43.981   1.312  25.746
   31    HG3  LYS   4           HG3      LYS   4  44.852  -0.213  25.895
   32    HD2  LYS   4           HD2      LYS   4  45.496   1.280  27.686
   33    HD3  LYS   4           HD3      LYS   4  46.862   1.030  26.596
   34    HE2  LYS   4           HE2      LYS   4  46.661   3.378  27.238
   35    HE3  LYS   4           HE3      LYS   4  46.395   3.165  25.508
   36    HZ1  LYS   4           HZ1      LYS   4  44.791   4.688  26.558
   37    HZ2  LYS   4           HZ2      LYS   4  44.220   3.416  27.519
   38    HZ3  LYS   4           HZ3      LYS   4  44.039   3.355  25.836
   39    H    ASP   5           H        ASP   5  46.912  -1.891  22.042
   40    HA   ASP   5           HA       ASP   5  47.302   0.087  19.902
   41    HB2  ASP   5           HB2      ASP   5  49.499  -0.661  20.604
   42    HB3  ASP   5           HB3      ASP   5  49.004  -2.346  20.483
   43    H    VAL   6           H        VAL   6  45.376  -0.224  18.941
   44    HA   VAL   6           HA       VAL   6  44.869  -2.902  17.853
   45    HB   VAL   6           HB       VAL   6  43.313  -2.599  19.678
   46   HG11  VAL   6          HG11      VAL   6  41.712  -0.769  19.757
   47   HG12  VAL   6          HG12      VAL   6  42.441  -0.053  18.320
   48   HG13  VAL   6          HG13      VAL   6  43.368  -0.163  19.818
   49   HG21  VAL   6          HG21      VAL   6  41.189  -2.833  18.484
   50   HG22  VAL   6          HG22      VAL   6  42.482  -3.745  17.703
   51   HG23  VAL   6          HG23      VAL   6  41.950  -2.209  17.019
   52    H    VAL   7           H        VAL   7  44.478  -2.964  15.736
   53    HA   VAL   7           HA       VAL   7  44.332  -0.390  14.328
   54    HB   VAL   7           HB       VAL   7  45.144  -3.083  13.218
   55   HG11  VAL   7          HG11      VAL   7  45.377  -0.313  12.037
   56   HG12  VAL   7          HG12      VAL   7  44.229  -1.555  11.535
   57   HG13  VAL   7          HG13      VAL   7  45.959  -1.807  11.303
   58   HG21  VAL   7          HG21      VAL   7  46.756  -2.335  14.867
   59   HG22  VAL   7          HG22      VAL   7  46.844  -0.752  14.095
   60   HG23  VAL   7          HG23      VAL   7  47.435  -2.182  13.246
   61    H    ASP   8           H        ASP   8  42.190   0.053  14.188
   62    HA   ASP   8           HA       ASP   8  40.835  -1.379  12.093
   63    HB2  ASP   8           HB2      ASP   8  38.755  -1.793  13.240
   64    HB3  ASP   8           HB3      ASP   8  40.042  -2.578  14.141
   65    H    LYS   9           H        LYS   9  40.011   0.089  10.762
   66    HA   LYS   9           HA       LYS   9  38.734   2.479  11.652
   67    HB2  LYS   9           HB2      LYS   9  41.251   2.893  12.012
   68    HB3  LYS   9           HB3      LYS   9  41.371   2.930  10.259
   69    HG2  LYS   9           HG2      LYS   9  39.838   4.808  10.169
   70    HG3  LYS   9           HG3      LYS   9  39.639   4.748  11.922
   71    HD2  LYS   9           HD2      LYS   9  42.063   5.187  12.170
   72    HD3  LYS   9           HD3      LYS   9  42.191   5.339  10.416
   73    HE2  LYS   9           HE2      LYS   9  40.469   7.050  12.206
   74    HE3  LYS   9           HE3      LYS   9  42.034   7.517  11.542
   75    HZ1  LYS   9           HZ1      LYS   9  39.635   6.828   9.930
   76    HZ2  LYS   9           HZ2      LYS   9  41.130   7.363   9.330
   77    HZ3  LYS   9           HZ3      LYS   9  40.172   8.402  10.260
   78    H    CYS  10           H        CYS  10  37.783   0.578  10.025
   79    HA   CYS  10           HA       CYS  10  37.576   2.019   7.496
   80    HG   CYS  10           HG       CYS  10  37.691   1.046   4.882
   81    HB2  CYS  10           HB2      CYS  10  39.234   0.223   7.115
   82    HB3  CYS  10           HB3      CYS  10  38.050  -0.970   7.634
   83    H    SER  11           H        SER  11  35.560   2.690   8.012
   84    HA   SER  11           HA       SER  11  33.449   0.814   7.496
   85    HG   SER  11           HG       SER  11  31.619   0.302   9.527
   86    HB2  SER  11           HB2      SER  11  33.725   0.470   9.920
   87    HB3  SER  11           HB3      SER  11  33.563   2.204  10.190
   88    H    THR  12           H        THR  12  32.908   2.074   5.778
   89    HA   THR  12           HA       THR  12  32.257   4.892   6.338
   90    HB   THR  12           HB       THR  12  32.783   5.261   3.875
   91    HG1  THR  12           HG1      THR  12  34.008   3.671   2.854
   92   HG21  THR  12          HG21      THR  12  35.060   4.352   5.643
   93   HG22  THR  12          HG22      THR  12  34.317   5.952   5.673
   94   HG23  THR  12          HG23      THR  12  35.192   5.413   4.240
   95    H    LYS  13           H        LYS  13  31.391   2.000   4.500
   96    HA   LYS  13           HA       LYS  13  29.219   3.270   3.149
   97    HB2  LYS  13           HB2      LYS  13  30.462   1.328   2.215
   98    HB3  LYS  13           HB3      LYS  13  29.760   0.312   3.467
   99    HG2  LYS  13           HG2      LYS  13  27.553   0.652   2.594
  100    HG3  LYS  13           HG3      LYS  13  28.147   1.845   1.437
  101    HD2  LYS  13           HD2      LYS  13  28.846  -1.092   1.489
  102    HD3  LYS  13           HD3      LYS  13  27.755  -0.302   0.351
  103    HE2  LYS  13           HE2      LYS  13  29.696   1.152  -0.325
  104    HE3  LYS  13           HE3      LYS  13  30.725   0.093   0.637
  105    HZ1  LYS  13           HZ1      LYS  13  29.936  -1.777  -0.745
  106    HZ2  LYS  13           HZ2      LYS  13  30.785  -0.608  -1.633
  107    HZ3  LYS  13           HZ3      LYS  13  29.096  -0.672  -1.723
  108    H    GLY  14           H        GLY  14  27.265   3.654   3.840
  109    HA2  GLY  14           HA2      GLY  14  25.612   1.929   5.258
  110    HA3  GLY  14           HA3      GLY  14  26.393   2.962   6.449
  111    H    CYS  15           H        CYS  15  24.451   3.004   3.499
  112    HA   CYS  15           HA       CYS  15  22.698   5.007   4.466
  113    HG   CYS  15           HG       CYS  15  21.906   7.001   2.051
  114    HB2  CYS  15           HB2      CYS  15  24.690   6.432   3.959
  115    HB3  CYS  15           HB3      CYS  15  24.591   5.912   2.282
  116    H    ALA  16           H        ALA  16  20.809   4.534   3.518
  117    HA   ALA  16           HA       ALA  16  20.608   3.995   0.708
  118    HB1  ALA  16           HB1      ALA  16  21.417   1.815   1.461
  119    HB2  ALA  16           HB2      ALA  16  19.761   1.713   0.865
  120    HB3  ALA  16           HB3      ALA  16  20.073   1.706   2.600
  121    H    ILE  17           H        ILE  17  18.562   4.260  -0.049
  122    HA   ILE  17           HA       ILE  17  16.463   4.851   1.913
  123    HB   ILE  17           HB       ILE  17  16.909   6.623   0.273
  124   HG12  ILE  17          HG12      ILE  17  14.253   5.266  -0.248
  125   HG13  ILE  17          HG13      ILE  17  14.611   6.297   1.133
  126   HG21  ILE  17          HG21      ILE  17  16.425   6.296  -2.107
  127   HG22  ILE  17          HG22      ILE  17  16.146   4.580  -1.809
  128   HG23  ILE  17          HG23      ILE  17  17.750   5.269  -1.556
  129   HD11  ILE  17          HD11      ILE  17  14.628   7.152  -1.752
  130   HD12  ILE  17          HD12      ILE  17  14.981   8.183  -0.365
  131   HD13  ILE  17          HD13      ILE  17  13.369   7.498  -0.568
  132    H    ASP  18           H        ASP  18  14.516   3.717   1.896
  133    HA   ASP  18           HA       ASP  18  14.135   1.602  -0.063
  134    HB2  ASP  18           HB2      ASP  18  15.600   0.648   1.744
  135    HB3  ASP  18           HB3      ASP  18  14.301   0.961   2.891
  136    H    ILE  19           H        ILE  19  11.998   0.781  -0.095
  137    HA   ILE  19           HA       ILE  19   9.956   2.565   0.683
  138    HB   ILE  19           HB       ILE  19   9.918  -0.286  -0.285
  139   HG12  ILE  19          HG12      ILE  19   8.731   2.181  -1.544
  140   HG13  ILE  19          HG13      ILE  19  10.404   1.724  -1.786
  141   HG21  ILE  19          HG21      ILE  19   8.024  -0.066   1.234
  142   HG22  ILE  19          HG22      ILE  19   7.478  -0.159  -0.440
  143   HG23  ILE  19          HG23      ILE  19   7.504   1.395   0.391
  144   HD11  ILE  19          HD11      ILE  19   9.713  -0.368  -2.785
  145   HD12  ILE  19          HD12      ILE  19   8.970   0.997  -3.618
  146   HD13  ILE  19          HD13      ILE  19   8.024   0.034  -2.483
  147    H    GLY  20           H        GLY  20  10.935  -0.595   2.032
  148    HA2  GLY  20           HA2      GLY  20   8.830  -0.481   4.016
  149    HA3  GLY  20           HA3      GLY  20   9.992  -1.777   3.796
  150    H    THR  21           H        THR  21  10.401   1.685   4.481
  151    HA   THR  21           HA       THR  21  11.979   0.943   6.840
  152    HB   THR  21           HB       THR  21  13.049   2.437   5.139
  153    HG1  THR  21           HG1      THR  21  13.467   2.465   7.536
  154   HG21  THR  21          HG21      THR  21  12.358   4.801   5.082
  155   HG22  THR  21          HG22      THR  21  10.960   4.399   6.081
  156   HG23  THR  21          HG23      THR  21  11.108   3.724   4.458
  157    H    VAL  22           H        VAL  22   8.959   1.740   5.997
  158    HA   VAL  22           HA       VAL  22   8.340   2.801   8.672
  159    HB   VAL  22           HB       VAL  22   6.807   3.404   6.131
  160   HG11  VAL  22          HG11      VAL  22   6.417   4.387   8.953
  161   HG12  VAL  22          HG12      VAL  22   5.351   3.301   8.063
  162   HG13  VAL  22          HG13      VAL  22   5.541   4.974   7.540
  163   HG21  VAL  22          HG21      VAL  22   7.567   5.727   6.464
  164   HG22  VAL  22          HG22      VAL  22   8.894   4.615   6.125
  165   HG23  VAL  22          HG23      VAL  22   8.611   5.173   7.775
  166    H    ILE  23           H        ILE  23   7.163   1.400   9.835
  167    HA   ILE  23           HA       ILE  23   5.481  -0.509   8.371
  168    HB   ILE  23           HB       ILE  23   7.419  -1.761   8.922
  169   HG12  ILE  23          HG12      ILE  23   5.279  -2.368  10.977
  170   HG13  ILE  23          HG13      ILE  23   5.252  -2.881   9.293
  171   HG21  ILE  23          HG21      ILE  23   8.297  -1.966  11.208
  172   HG22  ILE  23          HG22      ILE  23   7.140  -0.747  11.749
  173   HG23  ILE  23          HG23      ILE  23   8.400  -0.318  10.592
  174   HD11  ILE  23          HD11      ILE  23   5.950  -4.689  10.748
  175   HD12  ILE  23          HD12      ILE  23   7.281  -3.703  11.357
  176   HD13  ILE  23          HD13      ILE  23   7.262  -4.212   9.668
  177    H    ASP  24           H        ASP  24   3.471  -0.147   8.905
  178    HA   ASP  24           HA       ASP  24   2.680   0.996  11.418
  179    HB2  ASP  24           HB2      ASP  24   1.008  -0.250   9.217
  180    HB3  ASP  24           HB3      ASP  24   0.371   0.651  10.587
  181    H    ASN  25           H        ASN  25   3.045  -2.159  10.087
  182    HA   ASN  25           HA       ASN  25   2.402  -4.258  10.693
  183    HB2  ASN  25           HB2      ASN  25   3.203  -4.924  12.916
  184    HB3  ASN  25           HB3      ASN  25   4.364  -3.914  12.075
  185   HD21  ASN  25          HD21      ASN  25   2.105  -4.107  14.709
  186   HD22  ASN  25          HD22      ASN  25   2.690  -2.720  15.567
  187    H    ASP  26           H        ASP  26   0.219  -2.555  10.617
  188    HA   ASP  26           HA       ASP  26  -1.352  -2.821  13.001
  189    HB2  ASP  26           HB2      ASP  26  -1.562  -0.824  11.653
  190    HB3  ASP  26           HB3      ASP  26  -2.029  -1.778  10.249
  191    H    ASN  27           H        ASN  27  -1.599  -4.138   9.695
  192    HA   ASN  27           HA       ASN  27  -3.099  -6.414  10.778
  193    HB2  ASN  27           HB2      ASN  27  -4.038  -4.478   8.695
  194    HB3  ASN  27           HB3      ASN  27  -4.473  -6.173   8.521
  195   HD21  ASN  27          HD21      ASN  27  -4.943  -3.261  10.357
  196   HD22  ASN  27          HD22      ASN  27  -6.286  -3.836  11.284
  197    H    CYS  28           H        CYS  28  -3.546  -7.920   8.645
  198    HA   CYS  28           HA       CYS  28  -1.062  -7.972   7.044
  199    HG   CYS  28           HG       CYS  28  -3.610 -11.872   7.162
  200    HB2  CYS  28           HB2      CYS  28  -1.520 -10.305   6.595
  201    HB3  CYS  28           HB3      CYS  28  -1.633 -10.059   8.333
  202    H    THR  29           H        THR  29  -4.205  -7.031   7.095
  203    HA   THR  29           HA       THR  29  -4.642  -7.400   4.212
  204    HB   THR  29           HB       THR  29  -6.706  -6.602   6.275
  205    HG1  THR  29           HG1      THR  29  -5.491  -8.943   6.079
  206   HG21  THR  29          HG21      THR  29  -8.293  -7.428   4.596
  207   HG22  THR  29          HG22      THR  29  -6.950  -7.792   3.512
  208   HG23  THR  29          HG23      THR  29  -7.296  -6.120   3.956
  209    H    SER  30           H        SER  30  -4.464  -5.702   2.951
  210    HA   SER  30           HA       SER  30  -4.277  -3.056   4.170
  211    HG   SER  30           HG       SER  30  -1.475  -3.070   2.515
  212    HB2  SER  30           HB2      SER  30  -3.548  -4.066   1.412
  213    HB3  SER  30           HB3      SER  30  -3.387  -2.395   1.933
  214    H    LYS  31           H        LYS  31  -6.265  -2.260   4.441
  215    HA   LYS  31           HA       LYS  31  -8.099  -2.299   2.175
  216    HB2  LYS  31           HB2      LYS  31  -9.800  -1.419   3.721
  217    HB3  LYS  31           HB3      LYS  31  -9.134  -2.944   4.271
  218    HG2  LYS  31           HG2      LYS  31  -8.323  -0.245   5.336
  219    HG3  LYS  31           HG3      LYS  31  -9.517  -1.310   6.082
  220    HD2  LYS  31           HD2      LYS  31  -7.671  -3.069   6.081
  221    HD3  LYS  31           HD3      LYS  31  -6.567  -1.745   5.740
  222    HE2  LYS  31           HE2      LYS  31  -8.423  -1.842   8.109
  223    HE3  LYS  31           HE3      LYS  31  -6.722  -2.301   8.148
  224    HZ1  LYS  31           HZ1      LYS  31  -6.997  -0.054   8.920
  225    HZ2  LYS  31           HZ2      LYS  31  -7.792   0.393   7.489
  226    HZ3  LYS  31           HZ3      LYS  31  -6.153  -0.045   7.450
  227    H    PHE  32           H        PHE  32  -7.937  -0.777   0.837
  228    HA   PHE  32           HA       PHE  32  -7.058   1.887   1.730
  229    HD1  PHE  32           HD2      PHE  32  -5.331   3.305   1.315
  230    HD2  PHE  32           HD1      PHE  32  -6.018   1.967  -2.667
  231    HE1  PHE  32           HE2      PHE  32  -4.551   5.474   0.459
  232    HE2  PHE  32           HE1      PHE  32  -5.238   4.134  -3.532
  233    HZ   PHE  32           HZ       PHE  32  -4.510   5.891  -1.968
  234    HB2  PHE  32           HB2      PHE  32  -5.357   0.680   0.388
  235    HB3  PHE  32           HB3      PHE  32  -6.509   0.560  -0.935
  236    H    SER  33           H        SER  33  -8.570   3.362   1.543
  237    HA   SER  33           HA       SER  33 -10.705   2.970  -0.443
  238    HG   SER  33           HG       SER  33 -11.927   2.157   2.062
  239    HB2  SER  33           HB2      SER  33 -10.898   4.765   1.969
  240    HB3  SER  33           HB3      SER  33 -12.205   4.033   1.037
  241    H    ARG  34           H        ARG  34 -10.984   4.441  -1.997
  242    HA   ARG  34           HA       ARG  34  -9.777   7.101  -1.684
  243    HE   ARG  34           HE       ARG  34  -7.786   8.144  -0.958
  244    HB2  ARG  34           HB2      ARG  34  -9.206   5.080  -3.803
  245    HB3  ARG  34           HB3      ARG  34  -9.250   6.772  -4.255
  246    HG2  ARG  34           HG2      ARG  34  -7.572   5.856  -1.962
  247    HG3  ARG  34           HG3      ARG  34  -7.001   5.705  -3.624
  248    HD2  ARG  34           HD2      ARG  34  -6.158   7.760  -2.798
  249    HD3  ARG  34           HD3      ARG  34  -7.473   8.159  -3.899
  250   HH11  ARG  34          HH11      ARG  34  -8.342   9.595  -4.103
  251   HH12  ARG  34          HH12      ARG  34  -9.175  10.979  -3.465
  252   HH21  ARG  34          HH21      ARG  34  -8.931   9.939  -0.117
  253   HH22  ARG  34          HH22      ARG  34  -9.534  11.163  -1.201
  254    H    PHE  35           H        PHE  35 -10.855   8.744  -2.740
  255    HA   PHE  35           HA       PHE  35 -13.539   8.057  -3.662
  256    HD1  PHE  35           HD1      PHE  35 -15.462   8.946  -1.994
  257    HD2  PHE  35           HD2      PHE  35 -11.726  10.488  -0.662
  258    HE1  PHE  35           HE1      PHE  35 -16.118   8.515   0.340
  259    HE2  PHE  35           HE2      PHE  35 -12.374  10.058   1.669
  260    HZ   PHE  35           HZ       PHE  35 -14.571   9.073   2.174
  261    HB2  PHE  35           HB2      PHE  35 -12.334  10.723  -2.896
  262    HB3  PHE  35           HB3      PHE  35 -14.000  10.482  -3.406
  263    H    PHE  36           H        PHE  36 -14.281   8.496  -5.672
  264    HA   PHE  36           HA       PHE  36 -12.563   9.984  -7.530
  265    HD1  PHE  36           HD2      PHE  36 -10.673   8.894  -9.263
  266    HD2  PHE  36           HD1      PHE  36 -12.321   5.926  -6.694
  267    HE1  PHE  36           HE2      PHE  36  -8.418   7.999  -8.852
  268    HE2  PHE  36           HE1      PHE  36 -10.071   5.028  -6.277
  269    HZ   PHE  36           HZ       PHE  36  -8.117   6.066  -7.358
  270    HB2  PHE  36           HB2      PHE  36 -13.735   7.241  -8.038
  271    HB3  PHE  36           HB3      PHE  36 -13.090   8.279  -9.306
  272    H    ALA  37           H        ALA  37 -13.879  10.283  -9.676
  273    HA   ALA  37           HA       ALA  37 -16.279  11.631  -8.967
  274    HB1  ALA  37           HB1      ALA  37 -16.449  12.183 -11.327
  275    HB2  ALA  37           HB2      ALA  37 -15.193  11.005 -11.709
  276    HB3  ALA  37           HB3      ALA  37 -14.803  12.432 -10.746
  277    H    THR  38           H        THR  38 -15.685   8.816 -11.092
  278    HA   THR  38           HA       THR  38 -18.455   7.989 -10.539
  279    HB   THR  38           HB       THR  38 -17.969   6.937 -13.024
  280    HG1  THR  38           HG1      THR  38 -16.641   8.210 -14.081
  281   HG21  THR  38          HG21      THR  38 -19.569   8.636 -13.815
  282   HG22  THR  38          HG22      THR  38 -19.326   9.542 -12.323
  283   HG23  THR  38          HG23      THR  38 -20.054   7.938 -12.270
  284    H    ARG  39           H        ARG  39 -18.875   5.706 -10.861
  285    HA   ARG  39           HA       ARG  39 -17.044   4.113  -9.474
  286    HE   ARG  39           HE       ARG  39 -21.862   2.229 -13.017
  287    HB2  ARG  39           HB2      ARG  39 -18.537   2.227 -10.111
  288    HB3  ARG  39           HB3      ARG  39 -19.381   3.596  -9.402
  289    HG2  ARG  39           HG2      ARG  39 -19.858   4.324 -11.790
  290    HG3  ARG  39           HG3      ARG  39 -19.326   2.707 -12.265
  291    HD2  ARG  39           HD2      ARG  39 -21.009   1.715 -10.814
  292    HD3  ARG  39           HD3      ARG  39 -21.524   3.318 -10.293
  293   HH11  ARG  39          HH11      ARG  39 -22.715   4.540 -10.514
  294   HH12  ARG  39          HH12      ARG  39 -24.200   5.016 -11.291
  295   HH21  ARG  39          HH21      ARG  39 -23.804   2.869 -14.045
  296   HH22  ARG  39          HH22      ARG  39 -24.798   4.102 -13.323
  297    H    GLU  40           H        GLU  40 -17.420   4.700 -12.882
  298    HA   GLU  40           HA       GLU  40 -15.922   2.540 -13.888
  299    HB2  GLU  40           HB2      GLU  40 -16.138   5.363 -14.940
  300    HB3  GLU  40           HB3      GLU  40 -15.565   3.973 -15.844
  301    HG2  GLU  40           HG2      GLU  40 -17.758   2.936 -15.651
  302    HG3  GLU  40           HG3      GLU  40 -18.331   4.321 -14.724
  303    H    GLU  41           H        GLU  41 -15.013   5.789 -12.903
  304    HA   GLU  41           HA       GLU  41 -12.268   5.704 -13.343
  305    HB2  GLU  41           HB2      GLU  41 -13.767   7.100 -11.114
  306    HB3  GLU  41           HB3      GLU  41 -12.142   7.494 -11.643
  307    HG2  GLU  41           HG2      GLU  41 -14.655   7.757 -13.275
  308    HG3  GLU  41           HG3      GLU  41 -13.756   9.073 -12.521
  309    H    ALA  42           H        ALA  42 -14.223   4.345 -10.819
  310    HA   ALA  42           HA       ALA  42 -12.067   3.828  -8.998
  311    HB1  ALA  42           HB1      ALA  42 -14.861   2.696  -9.044
  312    HB2  ALA  42           HB2      ALA  42 -14.354   4.158  -8.200
  313    HB3  ALA  42           HB3      ALA  42 -13.720   2.589  -7.702
  314    H    GLU  43           H        GLU  43 -13.816   1.982 -11.446
  315    HA   GLU  43           HA       GLU  43 -12.614  -0.519 -10.884
  316    HB2  GLU  43           HB2      GLU  43 -13.643   0.447 -13.559
  317    HB3  GLU  43           HB3      GLU  43 -13.383  -1.223 -13.077
  318    HG2  GLU  43           HG2      GLU  43 -15.106  -0.812 -11.263
  319    HG3  GLU  43           HG3      GLU  43 -15.480   0.685 -12.112
  320    H    SER  44           H        SER  44 -11.771   2.126 -13.070
  321    HA   SER  44           HA       SER  44  -9.559   0.924 -14.307
  322    HG   SER  44           HG       SER  44 -11.179   3.926 -15.509
  323    HB2  SER  44           HB2      SER  44  -9.991   3.857 -13.701
  324    HB3  SER  44           HB3      SER  44  -8.896   3.192 -14.916
  325    H    PHE  45           H        PHE  45  -9.924   2.488 -11.204
  326    HA   PHE  45           HA       PHE  45  -7.156   2.765 -10.629
  327    HD1  PHE  45           HD2      PHE  45  -6.418   4.603  -9.097
  328    HD2  PHE  45           HD1      PHE  45  -8.705   2.033  -6.588
  329    HE1  PHE  45           HE2      PHE  45  -4.848   5.014  -7.251
  330    HE2  PHE  45           HE1      PHE  45  -7.137   2.441  -4.736
  331    HZ   PHE  45           HZ       PHE  45  -5.206   3.930  -5.066
  332    HB2  PHE  45           HB2      PHE  45  -8.969   4.006  -9.450
  333    HB3  PHE  45           HB3      PHE  45  -9.474   2.499  -8.696
  334    H    MET  46           H        MET  46  -9.559   0.250 -10.034
  335    HA   MET  46           HA       MET  46  -7.880  -1.437  -8.504
  336    HB2  MET  46           HB2      MET  46 -10.317  -1.660  -8.503
  337    HB3  MET  46           HB3      MET  46 -10.290  -2.127 -10.196
  338    HG2  MET  46           HG2      MET  46 -10.576  -4.027  -8.652
  339    HG3  MET  46           HG3      MET  46  -9.154  -4.171  -9.684
  340    HE1  MET  46           HE1      MET  46 -10.383  -3.082  -6.078
  341    HE2  MET  46           HE2      MET  46  -9.386  -1.746  -6.651
  342    HE3  MET  46           HE3      MET  46  -8.832  -2.748  -5.309
  343    H    THR  47           H        THR  47  -8.320  -0.953 -11.919
  344    HA   THR  47           HA       THR  47  -7.165  -3.301 -12.898
  345    HB   THR  47           HB       THR  47  -7.030  -0.556 -14.156
  346    HG1  THR  47           HG1      THR  47  -9.123  -2.249 -13.629
  347   HG21  THR  47          HG21      THR  47  -5.601  -2.253 -15.235
  348   HG22  THR  47          HG22      THR  47  -6.951  -1.781 -16.267
  349   HG23  THR  47          HG23      THR  47  -7.002  -3.313 -15.396
  350    H    LYS  48           H        LYS  48  -5.645  -0.172 -12.066
  351    HA   LYS  48           HA       LYS  48  -3.036  -1.086 -12.790
  352    HB2  LYS  48           HB2      LYS  48  -2.188   0.969 -11.810
  353    HB3  LYS  48           HB3      LYS  48  -3.570   1.303 -12.840
  354    HG2  LYS  48           HG2      LYS  48  -4.804   2.093 -11.142
  355    HG3  LYS  48           HG3      LYS  48  -4.201   0.887 -10.003
  356    HD2  LYS  48           HD2      LYS  48  -3.411   2.988  -9.249
  357    HD3  LYS  48           HD3      LYS  48  -2.031   2.160  -9.959
  358    HE2  LYS  48           HE2      LYS  48  -1.883   4.365 -10.753
  359    HE3  LYS  48           HE3      LYS  48  -2.567   3.447 -12.094
  360    HZ1  LYS  48           HZ1      LYS  48  -4.792   4.221 -11.351
  361    HZ2  LYS  48           HZ2      LYS  48  -3.777   5.472 -11.864
  362    HZ3  LYS  48           HZ3      LYS  48  -4.029   5.217 -10.209
  363    H    LEU  49           H        LEU  49  -4.876  -0.959  -9.803
  364    HA   LEU  49           HA       LEU  49  -2.769  -1.581  -8.032
  365    HG   LEU  49           HG       LEU  49  -5.443  -0.391  -5.827
  366    HB2  LEU  49           HB2      LEU  49  -5.731  -1.611  -7.909
  367    HB3  LEU  49           HB3      LEU  49  -4.891  -2.603  -6.733
  368   HD11  LEU  49          HD11      LEU  49  -2.488  -0.802  -6.248
  369   HD12  LEU  49          HD12      LEU  49  -3.475  -1.549  -4.990
  370   HD13  LEU  49          HD13      LEU  49  -3.226   0.197  -4.995
  371   HD21  LEU  49          HD21      LEU  49  -3.634   0.660  -7.994
  372   HD22  LEU  49          HD22      LEU  49  -4.296   1.604  -6.659
  373   HD23  LEU  49          HD23      LEU  49  -5.374   0.915  -7.872
  374    H    LYS  50           H        LYS  50  -5.022  -3.605  -9.848
  375    HA   LYS  50           HA       LYS  50  -4.456  -6.096  -8.853
  376    HB2  LYS  50           HB2      LYS  50  -5.778  -5.048 -11.080
  377    HB3  LYS  50           HB3      LYS  50  -4.584  -6.154 -11.745
  378    HG2  LYS  50           HG2      LYS  50  -6.620  -7.346 -11.405
  379    HG3  LYS  50           HG3      LYS  50  -5.441  -7.908 -10.214
  380    HD2  LYS  50           HD2      LYS  50  -6.457  -6.282  -8.594
  381    HD3  LYS  50           HD3      LYS  50  -7.732  -6.003  -9.781
  382    HE2  LYS  50           HE2      LYS  50  -7.036  -8.601  -8.436
  383    HE3  LYS  50           HE3      LYS  50  -8.476  -7.624  -8.170
  384    HZ1  LYS  50           HZ1      LYS  50  -8.942  -9.510  -9.605
  385    HZ2  LYS  50           HZ2      LYS  50  -7.758  -9.004 -10.705
  386    HZ3  LYS  50           HZ3      LYS  50  -9.146  -8.057 -10.458
  387    H    GLU  51           H        GLU  51  -2.735  -4.407 -11.465
  388    HA   GLU  51           HA       GLU  51  -0.872  -6.481 -11.924
  389    HB2  GLU  51           HB2      GLU  51  -0.626  -3.549 -12.566
  390    HB3  GLU  51           HB3      GLU  51   0.354  -4.842 -13.247
  391    HG2  GLU  51           HG2      GLU  51  -2.631  -4.730 -13.520
  392    HG3  GLU  51           HG3      GLU  51  -1.523  -4.003 -14.674
  393    H    LEU  52           H        LEU  52  -0.835  -3.623  -9.883
  394    HA   LEU  52           HA       LEU  52   1.879  -3.783  -9.095
  395    HG   LEU  52           HG       LEU  52  -0.046  -1.478  -9.815
  396    HB2  LEU  52           HB2      LEU  52  -0.491  -2.593  -7.654
  397    HB3  LEU  52           HB3      LEU  52   1.184  -2.346  -7.200
  398   HD11  LEU  52          HD11      LEU  52   0.737   0.152  -7.402
  399   HD12  LEU  52          HD12      LEU  52  -0.912  -0.210  -7.913
  400   HD13  LEU  52          HD13      LEU  52   0.128   0.780  -8.934
  401   HD21  LEU  52          HD21      LEU  52   2.674  -0.933  -8.634
  402   HD22  LEU  52          HD22      LEU  52   2.039  -0.256 -10.135
  403   HD23  LEU  52          HD23      LEU  52   2.332  -1.990 -10.003
  404    H    ALA  53           H        ALA  53  -1.106  -5.090  -7.716
  405    HA   ALA  53           HA       ALA  53  -0.025  -6.114  -5.340
  406    HB1  ALA  53           HB1      ALA  53  -2.437  -5.860  -5.763
  407    HB2  ALA  53           HB2      ALA  53  -2.022  -7.478  -5.195
  408    HB3  ALA  53           HB3      ALA  53  -2.362  -7.203  -6.904
  409    H    ALA  54           H        ALA  54  -0.209  -7.467  -8.572
  410    HA   ALA  54           HA       ALA  54   0.532 -10.106  -7.959
  411    HB1  ALA  54           HB1      ALA  54   1.098 -10.301 -10.330
  412    HB2  ALA  54           HB2      ALA  54   1.012  -8.546 -10.495
  413    HB3  ALA  54           HB3      ALA  54  -0.438  -9.469 -10.101
  414    H    ALA  55           H        ALA  55   2.438  -7.206  -8.488
  415    HA   ALA  55           HA       ALA  55   4.943  -8.661  -8.466
  416    HB1  ALA  55           HB1      ALA  55   4.396  -5.696  -8.456
  417    HB2  ALA  55           HB2      ALA  55   4.700  -6.689  -9.881
  418    HB3  ALA  55           HB3      ALA  55   5.972  -6.451  -8.682
  419    H    ALA  56           H        ALA  56   2.936  -6.886  -6.248
  420    HA   ALA  56           HA       ALA  56   4.948  -6.473  -4.260
  421    HB1  ALA  56           HB1      ALA  56   3.047  -4.988  -4.413
  422    HB2  ALA  56           HB2      ALA  56   3.074  -5.770  -2.832
  423    HB3  ALA  56           HB3      ALA  56   1.946  -6.319  -4.073
  424    H    SER  57           H        SER  57   2.157  -8.688  -4.472
  425    HA   SER  57           HA       SER  57   3.191 -10.091  -2.117
  426    HG   SER  57           HG       SER  57   0.718  -9.722  -4.421
  427    HB2  SER  57           HB2      SER  57   0.906 -11.185  -2.124
  428    HB3  SER  57           HB3      SER  57   0.924  -9.449  -1.820
  429    H    SER  58           H        SER  58   3.965 -12.072  -2.181
  430    HA   SER  58           HA       SER  58   4.088 -13.433  -4.768
  431    HG   SER  58           HG       SER  58   6.412 -12.086  -2.934
  432    HB2  SER  58           HB2      SER  58   5.615 -13.968  -2.213
  433    HB3  SER  58           HB3      SER  58   5.905 -14.723  -3.779
  434    H    ALA  59           H        ALA  59   1.626 -13.557  -3.498
  435    HA   ALA  59           HA       ALA  59   1.374 -16.033  -2.063
  436    HB1  ALA  59           HB1      ALA  59  -0.755 -14.257  -3.248
  437    HB2  ALA  59           HB2      ALA  59  -0.158 -14.206  -1.588
  438    HB3  ALA  59           HB3      ALA  59  -1.040 -15.621  -2.167
  439    H    ASP  60           H        ASP  60   0.309 -14.904  -5.273
  440    HA   ASP  60           HA       ASP  60   0.953 -17.396  -6.504
  441    HB2  ASP  60           HB2      ASP  60  -1.192 -17.982  -5.350
  442    HB3  ASP  60           HB3      ASP  60  -1.999 -16.748  -6.311
  443    H    GLU  61           H        GLU  61  -1.703 -15.148  -7.174
  444    HA   GLU  61           HA       GLU  61  -0.129 -13.997  -9.385
  445    HB2  GLU  61           HB2      GLU  61  -2.204 -13.793 -10.689
  446    HB3  GLU  61           HB3      GLU  61  -1.864 -15.474 -10.302
  447    HG2  GLU  61           HG2      GLU  61  -3.526 -15.465  -8.565
  448    HG3  GLU  61           HG3      GLU  61  -3.794 -13.736  -8.783
  449    H    GLY  62           H        GLY  62  -0.908 -13.362  -6.506
  450    HA2  GLY  62           HA2      GLY  62  -0.841 -10.763  -6.197
  451    HA3  GLY  62           HA3      GLY  62  -2.489 -10.931  -6.799
  452    H    ALA  63           H        ALA  63  -3.111 -10.046  -4.691
  453    HA   ALA  63           HA       ALA  63  -3.005 -12.085  -2.569
  454    HB1  ALA  63           HB1      ALA  63  -3.375  -9.105  -2.271
  455    HB2  ALA  63           HB2      ALA  63  -1.883  -9.990  -1.957
  456    HB3  ALA  63           HB3      ALA  63  -3.308 -10.281  -0.959
  457    H    SER  64           H        SER  64  -4.953 -12.014  -1.103
  458    HA   SER  64           HA       SER  64  -7.326 -12.329  -2.610
  459    HG   SER  64           HG       SER  64  -7.152 -14.403  -1.173
  460    HB2  SER  64           HB2      SER  64  -6.991 -12.034   0.384
  461    HB3  SER  64           HB3      SER  64  -8.410 -12.675  -0.437
  462    H    VAL  65           H        VAL  65  -8.204 -10.600  -3.583
  463    HA   VAL  65           HA       VAL  65  -8.239  -8.061  -2.143
  464    HB   VAL  65           HB       VAL  65  -7.230  -7.859  -4.303
  465   HG11  VAL  65          HG11      VAL  65  -9.734  -9.093  -5.445
  466   HG12  VAL  65          HG12      VAL  65  -8.134  -9.833  -5.382
  467   HG13  VAL  65          HG13      VAL  65  -8.408  -8.409  -6.385
  468   HG21  VAL  65          HG21      VAL  65  -8.592  -5.975  -3.657
  469   HG22  VAL  65          HG22      VAL  65 -10.030  -6.738  -4.336
  470   HG23  VAL  65          HG23      VAL  65  -8.721  -6.220  -5.399
  471    H    ALA  66           H        ALA  66  -9.988  -7.676  -1.031
  472    HA   ALA  66           HA       ALA  66 -12.599  -8.348  -2.211
  473    HB1  ALA  66           HB1      ALA  66 -13.519  -8.134   0.041
  474    HB2  ALA  66           HB2      ALA  66 -11.917  -7.738   0.665
  475    HB3  ALA  66           HB3      ALA  66 -12.232  -9.339  -0.007
  476    H    TYR  67           H        TYR  67 -13.003  -6.608  -3.486
  477    HA   TYR  67           HA       TYR  67 -12.743  -3.966  -2.228
  478    HD1  TYR  67           HD2      TYR  67 -11.768  -6.599  -5.254
  479    HD2  TYR  67           HD1      TYR  67 -13.360  -2.797  -6.322
  480    HE1  TYR  67           HE2      TYR  67 -12.395  -7.487  -7.459
  481    HE2  TYR  67           HE1      TYR  67 -13.990  -3.676  -8.528
  482    HH   TYR  67           HH       TYR  67 -13.215  -5.546 -10.053
  483    HB2  TYR  67           HB2      TYR  67 -12.162  -3.002  -4.340
  484    HB3  TYR  67           HB3      TYR  67 -11.108  -4.381  -4.074
  485    H    LYS  68           H        LYS  68 -14.366  -2.530  -2.445
  486    HA   LYS  68           HA       LYS  68 -16.667  -3.317  -4.085
  487    HB2  LYS  68           HB2      LYS  68 -18.214  -2.583  -2.368
  488    HB3  LYS  68           HB3      LYS  68 -17.161  -3.828  -1.712
  489    HG2  LYS  68           HG2      LYS  68 -15.814  -2.106  -0.625
  490    HG3  LYS  68           HG3      LYS  68 -16.879  -0.864  -1.275
  491    HD2  LYS  68           HD2      LYS  68 -18.764  -1.829  -0.053
  492    HD3  LYS  68           HD3      LYS  68 -17.707  -3.084   0.597
  493    HE2  LYS  68           HE2      LYS  68 -17.209  -0.148   1.029
  494    HE3  LYS  68           HE3      LYS  68 -18.208  -1.113   2.114
  495    HZ1  LYS  68           HZ1      LYS  68 -16.010  -1.014   2.985
  496    HZ2  LYS  68           HZ2      LYS  68 -15.324  -1.511   1.520
  497    HZ3  LYS  68           HZ3      LYS  68 -16.265  -2.594   2.425
  498    H    ILE  69           H        ILE  69 -17.895  -1.578  -4.851
  499    HA   ILE  69           HA       ILE  69 -16.515   1.020  -4.732
  500    HB   ILE  69           HB       ILE  69 -18.172  -0.024  -7.037
  501   HG12  ILE  69          HG12      ILE  69 -15.162   0.248  -6.832
  502   HG13  ILE  69          HG13      ILE  69 -16.044  -1.274  -6.759
  503   HG21  ILE  69          HG21      ILE  69 -18.199   2.399  -6.840
  504   HG22  ILE  69          HG22      ILE  69 -17.244   1.913  -8.240
  505   HG23  ILE  69          HG23      ILE  69 -16.437   2.433  -6.761
  506   HD11  ILE  69          HD11      ILE  69 -16.847  -0.914  -9.039
  507   HD12  ILE  69          HD12      ILE  69 -15.085  -0.920  -8.955
  508   HD13  ILE  69          HD13      ILE  69 -15.954   0.606  -9.108
  509    H    LYS  70           H        LYS  70 -17.666   2.411  -3.559
  510    HA   LYS  70           HA       LYS  70 -20.566   2.080  -3.446
  511    HB2  LYS  70           HB2      LYS  70 -19.449   2.343  -1.309
  512    HB3  LYS  70           HB3      LYS  70 -18.729   3.851  -1.847
  513    HG2  LYS  70           HG2      LYS  70 -20.628   4.206  -0.342
  514    HG3  LYS  70           HG3      LYS  70 -20.900   4.903  -1.939
  515    HD2  LYS  70           HD2      LYS  70 -22.914   3.804  -1.197
  516    HD3  LYS  70           HD3      LYS  70 -22.222   2.899  -2.543
  517    HE2  LYS  70           HE2      LYS  70 -21.240   1.313  -0.955
  518    HE3  LYS  70           HE3      LYS  70 -21.949   2.216   0.381
  519    HZ1  LYS  70           HZ1      LYS  70 -24.138   1.697  -0.415
  520    HZ2  LYS  70           HZ2      LYS  70 -23.259   0.252  -0.267
  521    HZ3  LYS  70           HZ3      LYS  70 -23.515   0.935  -1.798
  522    H    ASP  71           H        ASP  71 -21.702   3.088  -4.854
  523    HA   ASP  71           HA       ASP  71 -20.684   5.435  -6.238
  524    HB2  ASP  71           HB2      ASP  71 -21.777   3.473  -7.436
  525    HB3  ASP  71           HB3      ASP  71 -23.299   3.996  -6.728
  526    H    LEU  72           H        LEU  72 -20.886   7.156  -4.910
  527    HA   LEU  72           HA       LEU  72 -23.359   7.529  -3.409
  528    HG   LEU  72           HG       LEU  72 -20.645   6.801  -2.369
  529    HB2  LEU  72           HB2      LEU  72 -20.787   9.118  -3.395
  530    HB3  LEU  72           HB3      LEU  72 -22.154   9.397  -2.337
  531   HD11  LEU  72          HD11      LEU  72 -19.437   7.611  -0.411
  532   HD12  LEU  72          HD12      LEU  72 -20.210   9.188  -0.580
  533   HD13  LEU  72          HD13      LEU  72 -19.096   8.614  -1.821
  534   HD21  LEU  72          HD21      LEU  72 -22.486   8.085  -0.361
  535   HD22  LEU  72          HD22      LEU  72 -21.640   6.554  -0.142
  536   HD23  LEU  72          HD23      LEU  72 -22.868   6.711  -1.398
  537    H    GLU  73           H        GLU  73 -24.279   9.729  -3.368
  538    HA   GLU  73           HA       GLU  73 -24.724  10.666  -6.052
  539    HB2  GLU  73           HB2      GLU  73 -26.463  10.566  -4.204
  540    HB3  GLU  73           HB3      GLU  73 -25.666  11.965  -3.498
  541    HG2  GLU  73           HG2      GLU  73 -26.047  13.151  -5.675
  542    HG3  GLU  73           HG3      GLU  73 -27.055  11.788  -6.154
  543    H    GLY  74           H        GLY  74 -22.775  11.495  -6.788
  544    HA2  GLY  74           HA2      GLY  74 -22.041  13.900  -7.071
  545    HA3  GLY  74           HA3      GLY  74 -21.750  13.854  -5.340
  546    H    GLN  75           H        GLN  75 -20.747  11.118  -5.402
  547    HA   GLN  75           HA       GLN  75 -18.442  11.043  -7.101
  548    HB2  GLN  75           HB2      GLN  75 -16.751  11.196  -5.329
  549    HB3  GLN  75           HB3      GLN  75 -17.655  12.696  -5.463
  550    HG2  GLN  75           HG2      GLN  75 -19.022  12.018  -3.527
  551    HG3  GLN  75           HG3      GLN  75 -18.043  10.558  -3.377
  552   HE21  GLN  75          HE21      GLN  75 -17.310  11.100  -1.317
  553   HE22  GLN  75          HE22      GLN  75 -16.168  12.372  -1.043
  554    H    VAL  76           H        VAL  76 -16.951   9.170  -6.252
  555    HA   VAL  76           HA       VAL  76 -18.655   7.129  -4.973
  556    HB   VAL  76           HB       VAL  76 -17.785   5.402  -6.434
  557   HG11  VAL  76          HG11      VAL  76 -18.891   7.732  -7.992
  558   HG12  VAL  76          HG12      VAL  76 -19.826   6.506  -7.135
  559   HG13  VAL  76          HG13      VAL  76 -18.858   6.056  -8.538
  560   HG21  VAL  76          HG21      VAL  76 -16.308   7.615  -7.846
  561   HG22  VAL  76          HG22      VAL  76 -16.412   5.941  -8.389
  562   HG23  VAL  76          HG23      VAL  76 -15.588   6.330  -6.879
  563    H    GLU  77           H        GLU  77 -17.440   5.354  -4.002
  564    HA   GLU  77           HA       GLU  77 -14.689   6.129  -3.299
  565    HB2  GLU  77           HB2      GLU  77 -16.126   6.480  -1.363
  566    HB3  GLU  77           HB3      GLU  77 -16.751   4.844  -1.502
  567    HG2  GLU  77           HG2      GLU  77 -14.558   3.936  -0.986
  568    HG3  GLU  77           HG3      GLU  77 -13.889   5.565  -0.907
  569    H    LEU  78           H        LEU  78 -13.237   4.723  -3.900
  570    HA   LEU  78           HA       LEU  78 -13.993   1.956  -4.466
  571    HG   LEU  78           HG       LEU  78 -11.095   1.651  -6.757
  572    HB2  LEU  78           HB2      LEU  78 -12.595   3.303  -6.070
  573    HB3  LEU  78           HB3      LEU  78 -11.334   3.338  -4.857
  574   HD11  LEU  78          HD11      LEU  78  -9.726   1.551  -4.738
  575   HD12  LEU  78          HD12      LEU  78 -10.129  -0.062  -5.326
  576   HD13  LEU  78          HD13      LEU  78 -10.978   0.606  -3.932
  577   HD21  LEU  78          HD21      LEU  78 -13.182   0.196  -5.145
  578   HD22  LEU  78          HD22      LEU  78 -12.260  -0.468  -6.494
  579   HD23  LEU  78          HD23      LEU  78 -13.396   0.852  -6.769
  580    H    ASP  79           H        ASP  79 -13.862   0.562  -2.860
  581    HA   ASP  79           HA       ASP  79 -11.916   1.067  -0.699
  582    HB2  ASP  79           HB2      ASP  79 -14.291   1.453  -0.038
  583    HB3  ASP  79           HB3      ASP  79 -14.643  -0.223  -0.448
  584    H    ALA  80           H        ALA  80 -10.309  -0.338  -1.112
  585    HA   ALA  80           HA       ALA  80 -11.057  -3.093  -1.850
  586    HB1  ALA  80           HB1      ALA  80  -9.911  -1.894  -3.646
  587    HB2  ALA  80           HB2      ALA  80  -8.944  -3.242  -3.048
  588    HB3  ALA  80           HB3      ALA  80  -8.543  -1.592  -2.571
  589    H    ALA  81           H        ALA  81 -10.569  -4.625  -0.432
  590    HA   ALA  81           HA       ALA  81  -8.439  -4.100   1.533
  591    HB1  ALA  81           HB1      ALA  81 -10.676  -4.499   2.494
  592    HB2  ALA  81           HB2      ALA  81  -9.516  -5.741   2.968
  593    HB3  ALA  81           HB3      ALA  81 -10.712  -6.083   1.717
  594    H    PHE  82           H        PHE  82  -6.598  -4.899   0.749
  595    HA   PHE  82           HA       PHE  82  -6.576  -7.439  -0.709
  596    HD1  PHE  82           HD2      PHE  82  -5.154  -6.941  -3.339
  597    HD2  PHE  82           HD1      PHE  82  -5.429  -3.494  -0.862
  598    HE1  PHE  82           HE2      PHE  82  -5.770  -5.586  -5.297
  599    HE2  PHE  82           HE1      PHE  82  -6.039  -2.132  -2.815
  600    HZ   PHE  82           HZ       PHE  82  -6.211  -3.176  -5.038
  601    HB2  PHE  82           HB2      PHE  82  -4.332  -5.497  -0.093
  602    HB3  PHE  82           HB3      PHE  82  -4.198  -6.918  -1.118
  603    H    THR  83           H        THR  83  -6.467  -9.224   0.491
  604    HA   THR  83           HA       THR  83  -5.213  -9.153   3.121
  605    HB   THR  83           HB       THR  83  -6.480 -11.548   1.788
  606    HG1  THR  83           HG1      THR  83  -7.751  -9.393   2.146
  607   HG21  THR  83          HG21      THR  83  -6.089 -10.789   4.693
  608   HG22  THR  83          HG22      THR  83  -5.150 -11.991   3.806
  609   HG23  THR  83          HG23      THR  83  -6.865 -12.259   4.106
  610    H    PHE  84           H        PHE  84  -3.067  -9.287   3.099
  611    HA   PHE  84           HA       PHE  84  -1.728 -10.845   1.032
  612    HD1  PHE  84           HD1      PHE  84  -0.004  -9.324  -0.468
  613    HD2  PHE  84           HD2      PHE  84  -1.714  -6.964   2.629
  614    HE1  PHE  84           HE1      PHE  84  -0.324  -7.479  -2.060
  615    HE2  PHE  84           HE2      PHE  84  -2.040  -5.111   1.041
  616    HZ   PHE  84           HZ       PHE  84  -1.346  -5.370  -1.309
  617    HB2  PHE  84           HB2      PHE  84  -0.649  -8.984   3.156
  618    HB3  PHE  84           HB3      PHE  84   0.344  -9.825   1.971
  619    H    SER  85           H        SER  85  -0.130 -12.410   1.510
  620    HA   SER  85           HA       SER  85  -0.855 -14.176   3.630
  621    HG   SER  85           HG       SER  85  -1.093 -14.738   1.230
  622    HB2  SER  85           HB2      SER  85   1.620 -14.374   1.915
  623    HB3  SER  85           HB3      SER  85   0.691 -15.685   2.645
  624    H    CYS  86           H        CYS  86   1.389 -11.609   3.291
  625    HA   CYS  86           HA       CYS  86   2.568 -12.265   5.894
  626    HG   CYS  86           HG       CYS  86   4.108 -14.345   4.910
  627    HB2  CYS  86           HB2      CYS  86   4.115 -11.228   3.505
  628    HB3  CYS  86           HB3      CYS  86   4.771 -11.541   5.108
  629    H    GLN  87           H        GLN  87   3.223 -10.434   7.126
  630    HA   GLN  87           HA       GLN  87   1.514  -8.183   6.746
  631    HB2  GLN  87           HB2      GLN  87   1.956  -8.865   8.980
  632    HB3  GLN  87           HB3      GLN  87   3.695  -8.784   8.735
  633    HG2  GLN  87           HG2      GLN  87   3.735  -6.480   8.829
  634    HG3  GLN  87           HG3      GLN  87   2.020  -6.324   8.457
  635   HE21  GLN  87          HE21      GLN  87   0.508  -6.697  10.098
  636   HE22  GLN  87          HE22      GLN  87   0.957  -6.682  11.772
  637    H    ALA  88           H        ALA  88   4.892  -8.828   6.072
  638    HA   ALA  88           HA       ALA  88   5.786  -6.202   5.695
  639    HB1  ALA  88           HB1      ALA  88   7.292  -8.119   5.756
  640    HB2  ALA  88           HB2      ALA  88   7.535  -7.166   4.293
  641    HB3  ALA  88           HB3      ALA  88   6.644  -8.685   4.218
  642    H    GLU  89           H        GLU  89   3.937  -8.330   3.627
  643    HA   GLU  89           HA       GLU  89   4.172  -6.922   1.204
  644    HB2  GLU  89           HB2      GLU  89   1.717  -8.451   2.073
  645    HB3  GLU  89           HB3      GLU  89   2.327  -8.221   0.442
  646    HG2  GLU  89           HG2      GLU  89   3.784  -9.792   2.547
  647    HG3  GLU  89           HG3      GLU  89   2.634 -10.506   1.422
  648    H    MET  90           H        MET  90   2.052  -6.550   3.981
  649    HA   MET  90           HA       MET  90   0.152  -4.801   2.877
  650    HB2  MET  90           HB2      MET  90  -0.215  -5.870   5.036
  651    HB3  MET  90           HB3      MET  90   1.168  -5.023   5.722
  652    HG2  MET  90           HG2      MET  90  -0.078  -2.874   5.168
  653    HG3  MET  90           HG3      MET  90  -1.489  -3.893   4.894
  654    HE1  MET  90           HE1      MET  90   1.370  -4.390   7.535
  655    HE2  MET  90           HE2      MET  90   0.699  -3.566   8.943
  656    HE3  MET  90           HE3      MET  90   1.154  -2.639   7.514
  657    H    ILE  91           H        ILE  91   3.052  -4.081   4.800
  658    HA   ILE  91           HA       ILE  91   2.698  -1.287   4.671
  659    HB   ILE  91           HB       ILE  91   5.246  -1.346   5.333
  660   HG12  ILE  91          HG12      ILE  91   4.383  -4.121   6.152
  661   HG13  ILE  91          HG13      ILE  91   5.362  -3.824   4.724
  662   HG21  ILE  91          HG21      ILE  91   3.416  -0.640   6.759
  663   HG22  ILE  91          HG22      ILE  91   4.548  -1.646   7.661
  664   HG23  ILE  91          HG23      ILE  91   3.014  -2.320   7.108
  665   HD11  ILE  91          HD11      ILE  91   6.748  -4.474   6.590
  666   HD12  ILE  91          HD12      ILE  91   6.099  -3.154   7.561
  667   HD13  ILE  91          HD13      ILE  91   7.085  -2.803   6.142
  668    H    ILE  92           H        ILE  92   4.780  -3.484   2.769
  669    HA   ILE  92           HA       ILE  92   6.124  -1.405   1.411
  670    HB   ILE  92           HB       ILE  92   6.760  -3.115  -0.262
  671   HG12  ILE  92          HG12      ILE  92   6.122  -5.549   0.620
  672   HG13  ILE  92          HG13      ILE  92   4.671  -4.699   1.139
  673   HG21  ILE  92          HG21      ILE  92   8.073  -2.808   1.750
  674   HG22  ILE  92          HG22      ILE  92   8.075  -4.502   1.258
  675   HG23  ILE  92          HG23      ILE  92   7.064  -3.975   2.604
  676   HD11  ILE  92          HD11      ILE  92   4.345  -5.709  -1.031
  677   HD12  ILE  92          HD12      ILE  92   5.741  -4.842  -1.672
  678   HD13  ILE  92          HD13      ILE  92   4.305  -3.951  -1.166
  679    H    PHE  93           H        PHE  93   3.051  -2.941   0.904
  680    HA   PHE  93           HA       PHE  93   2.642  -2.014  -1.757
  681    HD1  PHE  93           HD1      PHE  93   1.683  -3.511  -3.224
  682    HD2  PHE  93           HD2      PHE  93  -1.597  -2.452  -0.725
  683    HE1  PHE  93           HE1      PHE  93   0.176  -3.607  -5.167
  684    HE2  PHE  93           HE2      PHE  93  -3.105  -2.543  -2.663
  685    HZ   PHE  93           HZ       PHE  93  -2.219  -3.121  -4.885
  686    HB2  PHE  93           HB2      PHE  93   1.468  -3.941  -0.527
  687    HB3  PHE  93           HB3      PHE  93   0.471  -2.699   0.217
  688    H    GLU  94           H        GLU  94   1.393  -0.953   1.394
  689    HA   GLU  94           HA       GLU  94  -0.069   1.266   0.587
  690    HB2  GLU  94           HB2      GLU  94   1.467   0.792   3.144
  691    HB3  GLU  94           HB3      GLU  94   0.332   2.112   2.915
  692    HG2  GLU  94           HG2      GLU  94  -0.476  -0.748   2.557
  693    HG3  GLU  94           HG3      GLU  94  -0.471   0.029   4.137
  694    H    LEU  95           H        LEU  95   3.342   1.046   1.504
  695    HA   LEU  95           HA       LEU  95   3.849   3.818   1.440
  696    HG   LEU  95           HG       LEU  95   4.392   1.849   3.428
  697    HB2  LEU  95           HB2      LEU  95   5.673   1.427   1.259
  698    HB3  LEU  95           HB3      LEU  95   6.250   3.077   1.399
  699   HD11  LEU  95          HD11      LEU  95   6.353   1.453   4.825
  700   HD12  LEU  95          HD12      LEU  95   7.401   1.944   3.494
  701   HD13  LEU  95          HD13      LEU  95   6.410   0.493   3.346
  702   HD21  LEU  95          HD21      LEU  95   6.224   4.240   3.462
  703   HD22  LEU  95          HD22      LEU  95   5.308   3.647   4.846
  704   HD23  LEU  95          HD23      LEU  95   4.460   4.261   3.427
  705    H    SER  96           H        SER  96   4.785   1.297  -0.934
  706    HA   SER  96           HA       SER  96   5.645   2.861  -3.000
  707    HG   SER  96           HG       SER  96   5.512  -0.400  -2.219
  708    HB2  SER  96           HB2      SER  96   3.862   0.429  -3.281
  709    HB3  SER  96           HB3      SER  96   4.951   1.074  -4.508
  710    H    LEU  97           H        LEU  97   2.254   2.169  -2.164
  711    HA   LEU  97           HA       LEU  97   1.120   3.382  -4.456
  712    HG   LEU  97           HG       LEU  97   0.440   0.816  -2.560
  713    HB2  LEU  97           HB2      LEU  97  -0.116   3.004  -1.728
  714    HB3  LEU  97           HB3      LEU  97  -0.990   3.394  -3.194
  715   HD11  LEU  97          HD11      LEU  97  -1.797  -0.142  -2.758
  716   HD12  LEU  97          HD12      LEU  97  -2.462   1.468  -3.039
  717   HD13  LEU  97          HD13      LEU  97  -1.719   1.078  -1.486
  718   HD21  LEU  97          HD21      LEU  97  -0.335   0.026  -4.740
  719   HD22  LEU  97          HD22      LEU  97   0.777   1.383  -4.914
  720   HD23  LEU  97          HD23      LEU  97  -0.957   1.634  -5.110
  721    H    ARG  98           H        ARG  98   2.122   4.657  -1.357
  722    HA   ARG  98           HA       ARG  98   0.636   7.019  -1.311
  723    HE   ARG  98           HE       ARG  98   1.205   5.951   2.474
  724    HB2  ARG  98           HB2      ARG  98   2.312   5.867   0.422
  725    HB3  ARG  98           HB3      ARG  98   3.414   7.064  -0.243
  726    HG2  ARG  98           HG2      ARG  98   2.418   7.986   1.710
  727    HG3  ARG  98           HG3      ARG  98   1.734   8.821   0.314
  728    HD2  ARG  98           HD2      ARG  98   0.005   8.260   1.950
  729    HD3  ARG  98           HD3      ARG  98  -0.253   7.411   0.426
  730   HH11  ARG  98          HH11      ARG  98  -1.897   6.566   0.963
  731   HH12  ARG  98          HH12      ARG  98  -2.606   5.091   1.535
  732   HH21  ARG  98          HH21      ARG  98   0.303   4.006   3.182
  733   HH22  ARG  98          HH22      ARG  98  -1.336   3.587   2.756
  734    H    SER  99           H        SER  99   3.890   6.422  -2.598
  735    HA   SER  99           HA       SER  99   3.991   9.115  -3.706
  736    HG   SER  99           HG       SER  99   6.793   7.615  -1.978
  737    HB2  SER  99           HB2      SER  99   6.048   6.890  -3.830
  738    HB3  SER  99           HB3      SER  99   6.308   8.577  -4.279
  739    H    LEU 100           H        LEU 100   2.298   6.688  -4.657
  740    HA   LEU 100           HA       LEU 100   3.187   6.654  -7.460
  741    HG   LEU 100           HG       LEU 100   1.961   4.997  -8.853
  742    HB2  LEU 100           HB2      LEU 100   2.960   4.488  -6.369
  743    HB3  LEU 100           HB3      LEU 100   1.287   4.828  -5.995
  744   HD11  LEU 100          HD11      LEU 100   3.371   3.105  -8.210
  745   HD12  LEU 100          HD12      LEU 100   1.983   2.566  -9.157
  746   HD13  LEU 100          HD13      LEU 100   1.995   2.347  -7.407
  747   HD21  LEU 100          HD21      LEU 100  -0.323   5.196  -7.984
  748   HD22  LEU 100          HD22      LEU 100  -0.201   3.571  -7.310
  749   HD23  LEU 100          HD23      LEU 100  -0.154   3.808  -9.056
  750    H    ALA 101           H        ALA 101   0.400   7.186  -5.385
  751    HA   ALA 101           HA       ALA 101  -1.513   7.783  -7.329
  752    HB1  ALA 101           HB1      ALA 101  -2.684   9.010  -5.559
  753    HB2  ALA 101           HB2      ALA 101  -1.233   8.950  -4.560
  754    HB3  ALA 101           HB3      ALA 101  -2.076   7.459  -4.980
  755    H    LEU 102           H        LEU 102   1.106   9.647  -6.032
  756    HA   LEU 102           HA       LEU 102   2.117  11.569  -6.628
  757    HG   LEU 102           HG       LEU 102   2.093   9.444  -8.812
  758    HB2  LEU 102           HB2      LEU 102   0.447  11.262  -9.112
  759    HB3  LEU 102           HB3      LEU 102   1.730  12.436  -8.915
  760   HD11  LEU 102          HD11      LEU 102   3.242   9.721 -10.951
  761   HD12  LEU 102          HD12      LEU 102   2.825  11.435 -10.956
  762   HD13  LEU 102          HD13      LEU 102   1.553  10.218 -11.058
  763   HD21  LEU 102          HD21      LEU 102   4.116  11.679  -8.765
  764   HD22  LEU 102          HD22      LEU 102   4.478   9.954  -8.822
  765   HD23  LEU 102          HD23      LEU 102   3.686  10.643  -7.405
  766    H    GLU 103           H        GLU 103  -1.328  11.573  -6.451
  767    HA   GLU 103           HA       GLU 103  -1.936  14.257  -6.782
  768    HB2  GLU 103           HB2      GLU 103  -3.123  12.201  -4.928
  769    HB3  GLU 103           HB3      GLU 103  -3.794  13.817  -5.111
  770    HG2  GLU 103           HG2      GLU 103  -3.479  11.777  -7.299
  771    HG3  GLU 103           HG3      GLU 103  -4.982  12.197  -6.475
  772    H    HIS 104           H        HIS 104  -1.150  12.625  -3.709
  773    HA   HIS 104           HA       HIS 104  -0.622  15.167  -2.438
  774    HD1  HIS 104           HD1      HIS 104  -2.038  14.513   0.757
  775    HD2  HIS 104           HD2      HIS 104   2.037  14.003   0.091
  776    HE1  HIS 104           HE1      HIS 104  -0.891  15.550   2.742
  777    HE2  HIS 104           HE2      HIS 104   1.572  15.370   2.238
  778    HB2  HIS 104           HB2      HIS 104  -1.591  13.137  -1.248
  779    HB3  HIS 104           HB3      HIS 104   0.008  12.412  -1.361
  780    H    HIS 105           H        HIS 105   0.954  15.696  -4.160
  781    HA   HIS 105           HA       HIS 105   3.398  14.289  -4.397
  782    HD1  HIS 105           HD1      HIS 105   5.009  18.297  -5.532
  783    HD2  HIS 105           HD2      HIS 105   5.003  14.303  -6.695
  784    HE1  HIS 105           HE1      HIS 105   7.244  17.905  -6.620
  785    HE2  HIS 105           HE2      HIS 105   7.238  15.467  -7.284
  786    HB2  HIS 105           HB2      HIS 105   2.485  15.855  -6.116
  787    HB3  HIS 105           HB3      HIS 105   2.854  17.198  -5.040
  788    H    HIS 106           H        HIS 106   5.098  14.260  -3.095
  789    HA   HIS 106           HA       HIS 106   5.056  16.019  -0.767
  790    HD1  HIS 106           HD1      HIS 106   8.765  13.712   0.252
  791    HD2  HIS 106           HD2      HIS 106   5.332  15.399   1.891
  792    HE1  HIS 106           HE1      HIS 106   9.384  14.385   2.601
  793    HE2  HIS 106           HE2      HIS 106   7.225  15.183   3.638
  794    HB2  HIS 106           HB2      HIS 106   5.318  13.539  -0.517
  795    HB3  HIS 106           HB3      HIS 106   6.874  13.669  -1.326
  796    H    HIS 107           H        HIS 107   5.726  17.938  -1.804
  797    HA   HIS 107           HA       HIS 107   8.602  17.986  -2.467
  798    HD1  HIS 107           HD1      HIS 107   7.518  22.171  -3.907
  799    HD2  HIS 107           HD2      HIS 107  10.136  18.977  -4.408
  800    HE1  HIS 107           HE1      HIS 107   9.644  23.169  -4.799
  801    HE2  HIS 107           HE2      HIS 107  11.130  21.197  -5.300
  802    HB2  HIS 107           HB2      HIS 107   7.038  18.739  -4.280
  803    HB3  HIS 107           HB3      HIS 107   6.494  20.032  -3.218
  804    H    HIS 108           H        HIS 108   6.425  18.553  -0.102
  805    HA   HIS 108           HA       HIS 108   7.523  20.927   1.065
  806    HD1  HIS 108           HD1      HIS 108   5.434  22.279   3.222
  807    HD2  HIS 108           HD2      HIS 108   6.923  18.703   4.738
  808    HE1  HIS 108           HE1      HIS 108   5.790  22.674   5.680
  809    HE2  HIS 108           HE2      HIS 108   6.832  20.552   6.545
  810    HB2  HIS 108           HB2      HIS 108   5.244  20.313   1.594
  811    HB3  HIS 108           HB3      HIS 108   5.753  18.730   2.162
  812    H    HIS 109           H        HIS 109   9.498  21.001   1.919
  813    HA   HIS 109           HA       HIS 109  10.721  18.579   2.954
  814    HD1  HIS 109           HD1      HIS 109  11.434  22.343   0.760
  815    HD2  HIS 109           HD2      HIS 109  12.627  22.332   4.748
  816    HE1  HIS 109           HE1      HIS 109  11.644  24.762   1.415
  817    HE2  HIS 109           HE2      HIS 109  12.534  24.730   3.774
  818    HB2  HIS 109           HB2      HIS 109  12.757  19.928   3.247
  819    HB3  HIS 109           HB3      HIS 109  12.144  20.040   1.606
  Start of MODEL   20
    1    HA   MET   1           HA       MET   1   8.276 -40.906 -32.082
    2    H1   MET   1           H1       MET   1  10.094 -43.216 -32.399
    3    H2   MET   1           H2       MET   1   9.787 -41.993 -33.531
    4    H3   MET   1           H3       MET   1   8.566 -43.086 -33.119
    5    HB2  MET   1           HB2      MET   1   8.825 -43.197 -30.184
    6    HB3  MET   1           HB3      MET   1   7.926 -41.746 -29.773
    7    HG2  MET   1           HG2      MET   1   6.345 -43.446 -30.204
    8    HG3  MET   1           HG3      MET   1   6.302 -42.343 -31.577
    9    HE1  MET   1           HE1      MET   1   8.143 -46.572 -31.593
   10    HE2  MET   1           HE2      MET   1   7.296 -45.836 -30.232
   11    HE3  MET   1           HE3      MET   1   8.890 -45.247 -30.702
   12    H    ALA   2           H        ALA   2  10.140 -39.628 -32.554
   13    HA   ALA   2           HA       ALA   2  11.973 -39.451 -30.256
   14    HB1  ALA   2           HB1      ALA   2  13.792 -38.845 -31.787
   15    HB2  ALA   2           HB2      ALA   2  12.724 -39.136 -33.161
   16    HB3  ALA   2           HB3      ALA   2  13.182 -40.469 -32.102
   17    H    MET   3           H        MET   3  11.144 -37.703 -29.276
   18    HA   MET   3           HA       MET   3  11.552 -35.170 -30.590
   19    HB2  MET   3           HB2      MET   3   9.319 -34.278 -30.067
   20    HB3  MET   3           HB3      MET   3   9.252 -35.586 -31.234
   21    HG2  MET   3           HG2      MET   3   8.666 -35.924 -28.299
   22    HG3  MET   3           HG3      MET   3   7.440 -35.592 -29.520
   23    HE1  MET   3           HE1      MET   3   7.239 -38.081 -27.552
   24    HE2  MET   3           HE2      MET   3   6.712 -39.325 -28.687
   25    HE3  MET   3           HE3      MET   3   6.057 -37.690 -28.799
   26    H    LYS   4           H        LYS   4  13.207 -34.998 -29.056
   27    HA   LYS   4           HA       LYS   4  12.285 -34.232 -26.399
   28    HB2  LYS   4           HB2      LYS   4  14.048 -35.613 -25.295
   29    HB3  LYS   4           HB3      LYS   4  12.764 -36.556 -26.034
   30    HG2  LYS   4           HG2      LYS   4  15.306 -36.039 -27.526
   31    HG3  LYS   4           HG3      LYS   4  15.226 -37.309 -26.305
   32    HD2  LYS   4           HD2      LYS   4  13.482 -38.436 -27.503
   33    HD3  LYS   4           HD3      LYS   4  13.316 -37.084 -28.626
   34    HE2  LYS   4           HE2      LYS   4  14.569 -39.038 -29.541
   35    HE3  LYS   4           HE3      LYS   4  15.460 -37.517 -29.578
   36    HZ1  LYS   4           HZ1      LYS   4  16.740 -39.507 -28.813
   37    HZ2  LYS   4           HZ2      LYS   4  15.783 -39.516 -27.410
   38    HZ3  LYS   4           HZ3      LYS   4  16.772 -38.182 -27.757
   39    H    ASP   5           H        ASP   5  12.870 -32.148 -26.762
   40    HA   ASP   5           HA       ASP   5  15.550 -31.465 -26.150
   41    HB2  ASP   5           HB2      ASP   5  15.823 -31.997 -28.583
   42    HB3  ASP   5           HB3      ASP   5  14.666 -30.721 -28.951
   43    H    VAL   6           H        VAL   6  15.376 -29.693 -24.954
   44    HA   VAL   6           HA       VAL   6  12.850 -28.245 -25.054
   45    HB   VAL   6           HB       VAL   6  13.524 -27.312 -22.862
   46   HG11  VAL   6          HG11      VAL   6  13.659 -30.319 -23.035
   47   HG12  VAL   6          HG12      VAL   6  12.184 -29.354 -23.000
   48   HG13  VAL   6          HG13      VAL   6  13.254 -29.380 -21.598
   49   HG21  VAL   6          HG21      VAL   6  15.458 -28.270 -21.695
   50   HG22  VAL   6          HG22      VAL   6  15.941 -27.368 -23.133
   51   HG23  VAL   6          HG23      VAL   6  15.908 -29.131 -23.166
   52    H    VAL   7           H        VAL   7  12.622 -26.159 -25.518
   53    HA   VAL   7           HA       VAL   7  15.055 -24.570 -26.009
   54    HB   VAL   7           HB       VAL   7  13.987 -24.924 -28.129
   55   HG11  VAL   7          HG11      VAL   7  11.669 -24.299 -28.580
   56   HG12  VAL   7          HG12      VAL   7  11.445 -23.903 -26.877
   57   HG13  VAL   7          HG13      VAL   7  11.774 -25.568 -27.356
   58   HG21  VAL   7          HG21      VAL   7  13.360 -22.163 -27.094
   59   HG22  VAL   7          HG22      VAL   7  13.428 -22.620 -28.795
   60   HG23  VAL   7          HG23      VAL   7  14.883 -22.702 -27.802
   61    H    ASP   8           H        ASP   8  15.335 -23.100 -24.495
   62    HA   ASP   8           HA       ASP   8  13.308 -21.252 -23.749
   63    HB2  ASP   8           HB2      ASP   8  12.445 -22.976 -22.342
   64    HB3  ASP   8           HB3      ASP   8  14.053 -23.409 -21.772
   65    H    LYS   9           H        LYS   9  14.346 -19.421 -23.467
   66    HA   LYS   9           HA       LYS   9  16.765 -19.413 -21.807
   67    HB2  LYS   9           HB2      LYS   9  17.456 -19.240 -24.190
   68    HB3  LYS   9           HB3      LYS   9  16.437 -17.820 -24.365
   69    HG2  LYS   9           HG2      LYS   9  17.803 -16.656 -22.679
   70    HG3  LYS   9           HG3      LYS   9  18.854 -18.071 -22.583
   71    HD2  LYS   9           HD2      LYS   9  19.381 -17.831 -24.968
   72    HD3  LYS   9           HD3      LYS   9  18.347 -16.405 -25.048
   73    HE2  LYS   9           HE2      LYS   9  19.781 -15.282 -23.408
   74    HE3  LYS   9           HE3      LYS   9  20.822 -16.704 -23.350
   75    HZ1  LYS   9           HZ1      LYS   9  21.274 -16.393 -25.723
   76    HZ2  LYS   9           HZ2      LYS   9  21.761 -15.052 -24.805
   77    HZ3  LYS   9           HZ3      LYS   9  20.331 -14.981 -25.720
   78    H    CYS  10           H        CYS  10  15.301 -18.788 -20.149
   79    HA   CYS  10           HA       CYS  10  13.896 -16.254 -20.579
   80    HG   CYS  10           HG       CYS  10  13.501 -20.125 -19.191
   81    HB2  CYS  10           HB2      CYS  10  12.762 -16.928 -18.360
   82    HB3  CYS  10           HB3      CYS  10  12.345 -17.818 -19.817
   83    H    SER  11           H        SER  11  15.953 -15.125 -20.406
   84    HA   SER  11           HA       SER  11  16.915 -14.773 -17.675
   85    HG   SER  11           HG       SER  11  18.542 -15.829 -18.999
   86    HB2  SER  11           HB2      SER  11  17.821 -13.407 -20.226
   87    HB3  SER  11           HB3      SER  11  18.637 -13.354 -18.665
   88    H    THR  12           H        THR  12  15.009 -13.864 -16.778
   89    HA   THR  12           HA       THR  12  14.387 -11.160 -17.748
   90    HB   THR  12           HB       THR  12  12.365 -13.161 -16.721
   91    HG1  THR  12           HG1      THR  12  13.345 -12.551 -19.255
   92   HG21  THR  12          HG21      THR  12  10.709 -11.523 -17.491
   93   HG22  THR  12          HG22      THR  12  12.010 -10.423 -17.952
   94   HG23  THR  12          HG23      THR  12  11.758 -10.831 -16.254
   95    H    LYS  13           H        LYS  13  15.101  -9.828 -16.271
   96    HA   LYS  13           HA       LYS  13  13.805  -9.615 -13.774
   97    HB2  LYS  13           HB2      LYS  13  15.439 -11.337 -13.100
   98    HB3  LYS  13           HB3      LYS  13  16.751 -10.315 -13.668
   99    HG2  LYS  13           HG2      LYS  13  16.596 -10.178 -11.271
  100    HG3  LYS  13           HG3      LYS  13  16.134  -8.629 -11.976
  101    HD2  LYS  13           HD2      LYS  13  14.604  -9.148 -10.203
  102    HD3  LYS  13           HD3      LYS  13  13.752  -9.298 -11.740
  103    HE2  LYS  13           HE2      LYS  13  13.171 -11.130 -10.255
  104    HE3  LYS  13           HE3      LYS  13  14.046 -11.726 -11.664
  105    HZ1  LYS  13           HZ1      LYS  13  15.351 -11.178  -9.052
  106    HZ2  LYS  13           HZ2      LYS  13  16.002 -12.008 -10.380
  107    HZ3  LYS  13           HZ3      LYS  13  14.736 -12.698  -9.484
  108    H    GLY  14           H        GLY  14  13.323  -7.569 -14.371
  109    HA2  GLY  14           HA2      GLY  14  15.567  -5.683 -14.537
  110    HA3  GLY  14           HA3      GLY  14  14.424  -5.733 -15.871
  111    H    CYS  15           H        CYS  15  14.250  -5.689 -12.321
  112    HA   CYS  15           HA       CYS  15  12.490  -3.353 -12.551
  113    HG   CYS  15           HG       CYS  15  11.539  -7.347 -10.730
  114    HB2  CYS  15           HB2      CYS  15  11.363  -4.202 -10.449
  115    HB3  CYS  15           HB3      CYS  15  11.046  -5.136 -11.908
  116    H    ALA  16           H        ALA  16  13.159  -1.628 -11.453
  117    HA   ALA  16           HA       ALA  16  15.300  -2.023  -9.467
  118    HB1  ALA  16           HB1      ALA  16  16.080  -0.859 -11.465
  119    HB2  ALA  16           HB2      ALA  16  16.115   0.205 -10.059
  120    HB3  ALA  16           HB3      ALA  16  14.825   0.362 -11.251
  121    H    ILE  17           H        ILE  17  13.931  -2.193  -7.685
  122    HA   ILE  17           HA       ILE  17  13.103   0.276  -6.542
  123    HB   ILE  17           HB       ILE  17  11.171  -0.034  -7.990
  124   HG12  ILE  17          HG12      ILE  17   9.377  -0.053  -6.265
  125   HG13  ILE  17          HG13      ILE  17  10.562  -0.596  -5.080
  126   HG21  ILE  17          HG21      ILE  17  11.254  -2.419  -8.319
  127   HG22  ILE  17          HG22      ILE  17   9.662  -1.953  -7.718
  128   HG23  ILE  17          HG23      ILE  17  10.832  -2.699  -6.629
  129   HD11  ILE  17          HD11      ILE  17  10.160   1.798  -4.916
  130   HD12  ILE  17          HD12      ILE  17  10.658   2.002  -6.595
  131   HD13  ILE  17          HD13      ILE  17  11.824   1.459  -5.388
  132    H    ASP  18           H        ASP  18  13.337   0.120  -4.415
  133    HA   ASP  18           HA       ASP  18  12.628  -2.350  -3.040
  134    HB2  ASP  18           HB2      ASP  18  15.006  -2.681  -3.436
  135    HB3  ASP  18           HB3      ASP  18  15.362  -1.076  -2.805
  136    H    ILE  19           H        ILE  19  11.045  -1.474  -1.837
  137    HA   ILE  19           HA       ILE  19  11.804   0.776  -0.123
  138    HB   ILE  19           HB       ILE  19   9.292   0.904   0.351
  139   HG12  ILE  19          HG12      ILE  19   9.171  -0.614  -2.261
  140   HG13  ILE  19          HG13      ILE  19   8.691  -1.256  -0.695
  141   HG21  ILE  19          HG21      ILE  19  10.489   2.598  -0.892
  142   HG22  ILE  19          HG22      ILE  19   8.914   2.311  -1.630
  143   HG23  ILE  19          HG23      ILE  19  10.367   1.635  -2.365
  144   HD11  ILE  19          HD11      ILE  19   6.778  -0.556  -2.018
  145   HD12  ILE  19          HD12      ILE  19   7.428   1.080  -2.109
  146   HD13  ILE  19          HD13      ILE  19   6.926   0.416  -0.555
  147    H    GLY  20           H        GLY  20  12.912  -0.393   1.387
  148    HA2  GLY  20           HA2      GLY  20  11.962  -2.795   2.559
  149    HA3  GLY  20           HA3      GLY  20  13.259  -1.786   3.180
  150    H    THR  21           H        THR  21  11.338   0.525   3.188
  151    HA   THR  21           HA       THR  21  10.182   1.667   4.741
  152    HB   THR  21           HB       THR  21   8.398   0.347   3.546
  153    HG1  THR  21           HG1      THR  21   6.822   0.792   5.325
  154   HG21  THR  21          HG21      THR  21   8.856  -1.875   4.484
  155   HG22  THR  21          HG22      THR  21   7.193  -1.376   4.783
  156   HG23  THR  21          HG23      THR  21   8.383  -1.297   6.081
  157    H    VAL  22           H        VAL  22   8.694   0.977   6.949
  158    HA   VAL  22           HA       VAL  22  10.739  -0.052   8.794
  159    HB   VAL  22           HB       VAL  22   9.650   1.319  10.537
  160   HG11  VAL  22          HG11      VAL  22  11.574   2.200   9.314
  161   HG12  VAL  22          HG12      VAL  22  10.463   3.489   9.775
  162   HG13  VAL  22          HG13      VAL  22  10.489   2.900   8.112
  163   HG21  VAL  22          HG21      VAL  22   8.033   3.063   9.879
  164   HG22  VAL  22          HG22      VAL  22   7.404   1.434   9.628
  165   HG23  VAL  22          HG23      VAL  22   7.986   2.376   8.254
  166    H    ILE  23           H        ILE  23   9.943  -1.269  10.627
  167    HA   ILE  23           HA       ILE  23   7.815  -3.039   9.817
  168    HB   ILE  23           HB       ILE  23   9.448  -3.066  12.362
  169   HG12  ILE  23          HG12      ILE  23   9.789  -4.622   9.788
  170   HG13  ILE  23          HG13      ILE  23  10.819  -3.299  10.319
  171   HG21  ILE  23          HG21      ILE  23   8.716  -5.400  12.544
  172   HG22  ILE  23          HG22      ILE  23   7.710  -5.192  11.109
  173   HG23  ILE  23          HG23      ILE  23   7.346  -4.288  12.580
  174   HD11  ILE  23          HD11      ILE  23  11.883  -5.425  10.729
  175   HD12  ILE  23          HD12      ILE  23  10.497  -5.965  11.676
  176   HD13  ILE  23          HD13      ILE  23  11.500  -4.637  12.259
  177    H    ASP  24           H        ASP  24   6.051  -1.587   9.856
  178    HA   ASP  24           HA       ASP  24   5.199  -0.290  12.248
  179    HB2  ASP  24           HB2      ASP  24   4.503   0.336   9.911
  180    HB3  ASP  24           HB3      ASP  24   3.490  -1.102   9.887
  181    H    ASN  25           H        ASN  25   3.807  -3.048  10.509
  182    HA   ASN  25           HA       ASN  25   3.131  -5.091  11.141
  183    HB2  ASN  25           HB2      ASN  25   5.257  -5.132  12.402
  184    HB3  ASN  25           HB3      ASN  25   4.414  -4.484  13.807
  185   HD21  ASN  25          HD21      ASN  25   3.176  -6.846  11.519
  186   HD22  ASN  25          HD22      ASN  25   3.044  -8.144  12.649
  187    H    ASP  26           H        ASP  26   0.976  -5.156  11.176
  188    HA   ASP  26           HA       ASP  26  -0.211  -5.120  13.833
  189    HB2  ASP  26           HB2      ASP  26  -0.727  -2.876  12.875
  190    HB3  ASP  26           HB3      ASP  26  -1.540  -3.671  11.528
  191    H    ASN  27           H        ASN  27  -1.575  -5.281  10.562
  192    HA   ASN  27           HA       ASN  27  -2.374  -8.068  11.105
  193    HB2  ASN  27           HB2      ASN  27  -4.174  -6.187  10.963
  194    HB3  ASN  27           HB3      ASN  27  -3.846  -6.217   9.235
  195   HD21  ASN  27          HD21      ASN  27  -5.178  -7.911  11.932
  196   HD22  ASN  27          HD22      ASN  27  -6.003  -9.133  11.022
  197    H    CYS  28           H        CYS  28  -3.059  -8.991   8.720
  198    HA   CYS  28           HA       CYS  28  -0.802  -8.395   6.921
  199    HG   CYS  28           HG       CYS  28   0.319 -12.050   7.540
  200    HB2  CYS  28           HB2      CYS  28  -2.487 -10.902   7.132
  201    HB3  CYS  28           HB3      CYS  28  -1.194 -10.649   5.965
  202    H    THR  29           H        THR  29  -3.942  -7.706   7.387
  203    HA   THR  29           HA       THR  29  -4.560  -7.584   4.513
  204    HB   THR  29           HB       THR  29  -6.500  -7.619   6.837
  205    HG1  THR  29           HG1      THR  29  -5.481  -9.659   6.426
  206   HG21  THR  29          HG21      THR  29  -7.350  -6.355   4.927
  207   HG22  THR  29          HG22      THR  29  -8.220  -7.878   5.102
  208   HG23  THR  29          HG23      THR  29  -6.983  -7.708   3.856
  209    H    SER  30           H        SER  30  -4.443  -5.613   3.685
  210    HA   SER  30           HA       SER  30  -4.775  -3.294   5.453
  211    HG   SER  30           HG       SER  30  -2.877  -1.280   3.977
  212    HB2  SER  30           HB2      SER  30  -2.712  -3.374   4.063
  213    HB3  SER  30           HB3      SER  30  -3.715  -3.401   2.611
  214    H    LYS  31           H        LYS  31  -6.585  -2.118   5.359
  215    HA   LYS  31           HA       LYS  31  -8.345  -2.514   3.043
  216    HB2  LYS  31           HB2      LYS  31  -9.073  -1.473   5.783
  217    HB3  LYS  31           HB3      LYS  31 -10.184  -1.730   4.445
  218    HG2  LYS  31           HG2      LYS  31  -9.457  -4.167   4.528
  219    HG3  LYS  31           HG3      LYS  31  -8.745  -3.772   6.096
  220    HD2  LYS  31           HD2      LYS  31 -11.010  -2.811   6.702
  221    HD3  LYS  31           HD3      LYS  31 -11.624  -3.610   5.260
  222    HE2  LYS  31           HE2      LYS  31 -10.828  -5.767   6.121
  223    HE3  LYS  31           HE3      LYS  31 -10.262  -4.964   7.585
  224    HZ1  LYS  31           HZ1      LYS  31 -12.395  -5.942   7.994
  225    HZ2  LYS  31           HZ2      LYS  31 -13.073  -5.169   6.645
  226    HZ3  LYS  31           HZ3      LYS  31 -12.576  -4.255   7.984
  227    H    PHE  32           H        PHE  32  -8.929  -0.828   1.839
  228    HA   PHE  32           HA       PHE  32  -8.143   1.864   2.624
  229    HD1  PHE  32           HD2      PHE  32  -5.651   3.228   2.241
  230    HD2  PHE  32           HD1      PHE  32  -7.438   2.205  -1.483
  231    HE1  PHE  32           HE2      PHE  32  -5.077   5.453   1.356
  232    HE2  PHE  32           HE1      PHE  32  -6.865   4.424  -2.373
  233    HZ   PHE  32           HZ       PHE  32  -5.686   6.050  -0.952
  234    HB2  PHE  32           HB2      PHE  32  -6.108   0.885   1.607
  235    HB3  PHE  32           HB3      PHE  32  -7.021   0.529   0.146
  236    H    SER  33           H        SER  33  -9.592   3.293   1.918
  237    HA   SER  33           HA       SER  33 -11.002   2.723  -0.574
  238    HG   SER  33           HG       SER  33 -13.006   4.532   2.265
  239    HB2  SER  33           HB2      SER  33 -13.112   3.586   0.414
  240    HB3  SER  33           HB3      SER  33 -12.559   2.100   1.180
  241    H    ARG  34           H        ARG  34 -11.079   4.387  -1.929
  242    HA   ARG  34           HA       ARG  34 -10.517   7.076  -0.876
  243    HE   ARG  34           HE       ARG  34  -8.543  10.353  -3.641
  244    HB2  ARG  34           HB2      ARG  34  -8.436   6.276  -1.827
  245    HB3  ARG  34           HB3      ARG  34  -9.253   5.778  -3.299
  246    HG2  ARG  34           HG2      ARG  34  -8.002   7.825  -3.646
  247    HG3  ARG  34           HG3      ARG  34  -9.730   8.109  -3.835
  248    HD2  ARG  34           HD2      ARG  34  -9.744   8.910  -1.450
  249    HD3  ARG  34           HD3      ARG  34  -7.982   8.849  -1.495
  250   HH11  ARG  34          HH11      ARG  34  -9.584  10.571  -0.300
  251   HH12  ARG  34          HH12      ARG  34  -9.906  12.275  -0.385
  252   HH21  ARG  34          HH21      ARG  34  -8.924  12.601  -3.741
  253   HH22  ARG  34          HH22      ARG  34  -9.503  13.435  -2.323
  254    H    PHE  35           H        PHE  35 -11.580   8.749  -1.888
  255    HA   PHE  35           HA       PHE  35 -13.900   7.948  -3.431
  256    HD1  PHE  35           HD2      PHE  35 -16.092   8.582  -1.695
  257    HD2  PHE  35           HD1      PHE  35 -12.487  10.253  -0.179
  258    HE1  PHE  35           HE2      PHE  35 -16.746   7.912   0.581
  259    HE2  PHE  35           HE1      PHE  35 -13.131   9.586   2.100
  260    HZ   PHE  35           HZ       PHE  35 -15.261   8.411   2.481
  261    HB2  PHE  35           HB2      PHE  35 -13.154  10.692  -2.404
  262    HB3  PHE  35           HB3      PHE  35 -14.728  10.184  -3.007
  263    H    PHE  36           H        PHE  36 -14.157   8.271  -5.536
  264    HA   PHE  36           HA       PHE  36 -12.216   9.995  -6.929
  265    HD1  PHE  36           HD2      PHE  36  -9.994   8.972  -8.006
  266    HD2  PHE  36           HD1      PHE  36 -12.331   5.779  -6.449
  267    HE1  PHE  36           HE2      PHE  36  -7.963   7.950  -7.064
  268    HE2  PHE  36           HE1      PHE  36 -10.307   4.756  -5.501
  269    HZ   PHE  36           HZ       PHE  36  -8.119   5.844  -5.802
  270    HB2  PHE  36           HB2      PHE  36 -13.319   7.336  -7.873
  271    HB3  PHE  36           HB3      PHE  36 -12.325   8.418  -8.847
  272    H    ALA  37           H        ALA  37 -13.081  10.501  -9.224
  273    HA   ALA  37           HA       ALA  37 -15.431  12.014  -8.846
  274    HB1  ALA  37           HB1      ALA  37 -15.192  12.644 -11.182
  275    HB2  ALA  37           HB2      ALA  37 -14.017  11.350 -11.425
  276    HB3  ALA  37           HB3      ALA  37 -13.634  12.701 -10.357
  277    H    THR  38           H        THR  38 -14.840   9.284 -11.061
  278    HA   THR  38           HA       THR  38 -17.739   8.750 -10.983
  279    HB   THR  38           HB       THR  38 -17.517   7.924 -13.326
  280    HG1  THR  38           HG1      THR  38 -15.491   8.889 -14.363
  281   HG21  THR  38          HG21      THR  38 -18.325  10.211 -12.866
  282   HG22  THR  38          HG22      THR  38 -17.434  10.116 -14.385
  283   HG23  THR  38          HG23      THR  38 -16.665  10.804 -12.954
  284    H    ARG  39           H        ARG  39 -18.266   6.456 -11.604
  285    HA   ARG  39           HA       ARG  39 -16.732   4.615 -10.110
  286    HE   ARG  39           HE       ARG  39 -20.459   3.960 -14.708
  287    HB2  ARG  39           HB2      ARG  39 -18.216   2.891 -11.138
  288    HB3  ARG  39           HB3      ARG  39 -19.076   4.209 -10.375
  289    HG2  ARG  39           HG2      ARG  39 -20.275   3.898 -12.309
  290    HG3  ARG  39           HG3      ARG  39 -19.186   5.206 -12.754
  291    HD2  ARG  39           HD2      ARG  39 -17.737   3.661 -13.918
  292    HD3  ARG  39           HD3      ARG  39 -18.714   2.292 -13.383
  293   HH11  ARG  39          HH11      ARG  39 -17.507   2.220 -15.546
  294   HH12  ARG  39          HH12      ARG  39 -17.946   2.075 -17.228
  295   HH21  ARG  39          HH21      ARG  39 -21.018   3.725 -16.896
  296   HH22  ARG  39          HH22      ARG  39 -19.941   2.907 -17.984
  297    H    GLU  40           H        GLU  40 -16.573   5.747 -13.332
  298    HA   GLU  40           HA       GLU  40 -15.054   3.736 -14.568
  299    HB2  GLU  40           HB2      GLU  40 -14.947   6.727 -14.955
  300    HB3  GLU  40           HB3      GLU  40 -14.345   5.523 -16.080
  301    HG2  GLU  40           HG2      GLU  40 -16.570   4.721 -16.487
  302    HG3  GLU  40           HG3      GLU  40 -17.220   5.786 -15.245
  303    H    GLU  41           H        GLU  41 -14.137   6.633 -12.783
  304    HA   GLU  41           HA       GLU  41 -11.357   6.343 -12.871
  305    HB2  GLU  41           HB2      GLU  41 -13.138   7.607 -10.780
  306    HB3  GLU  41           HB3      GLU  41 -11.392   7.793 -10.823
  307    HG2  GLU  41           HG2      GLU  41 -13.206   8.590 -13.080
  308    HG3  GLU  41           HG3      GLU  41 -12.693   9.686 -11.798
  309    H    ALA  42           H        ALA  42 -13.780   4.786 -10.948
  310    HA   ALA  42           HA       ALA  42 -11.981   3.796  -8.940
  311    HB1  ALA  42           HB1      ALA  42 -14.786   2.895  -9.605
  312    HB2  ALA  42           HB2      ALA  42 -14.355   4.154  -8.447
  313    HB3  ALA  42           HB3      ALA  42 -13.878   2.483  -8.149
  314    H    GLU  43           H        GLU  43 -13.556   2.453 -11.806
  315    HA   GLU  43           HA       GLU  43 -12.485  -0.145 -11.656
  316    HB2  GLU  43           HB2      GLU  43 -13.157   1.431 -14.151
  317    HB3  GLU  43           HB3      GLU  43 -13.030  -0.319 -14.025
  318    HG2  GLU  43           HG2      GLU  43 -14.969  -0.391 -12.588
  319    HG3  GLU  43           HG3      GLU  43 -15.066   1.370 -12.592
  320    H    SER  44           H        SER  44 -11.331   2.841 -13.112
  321    HA   SER  44           HA       SER  44  -9.019   1.813 -14.346
  322    HG   SER  44           HG       SER  44 -11.121   4.086 -14.712
  323    HB2  SER  44           HB2      SER  44  -9.487   4.605 -13.263
  324    HB3  SER  44           HB3      SER  44  -8.290   4.142 -14.471
  325    H    PHE  45           H        PHE  45  -9.683   2.948 -11.082
  326    HA   PHE  45           HA       PHE  45  -6.980   3.009 -10.227
  327    HD1  PHE  45           HD2      PHE  45  -6.160   4.390  -8.621
  328    HD2  PHE  45           HD1      PHE  45  -9.040   2.265  -6.321
  329    HE1  PHE  45           HE2      PHE  45  -4.714   4.586  -6.638
  330    HE2  PHE  45           HE1      PHE  45  -7.604   2.458  -4.333
  331    HZ   PHE  45           HZ       PHE  45  -5.438   3.621  -4.490
  332    HB2  PHE  45           HB2      PHE  45  -8.877   4.200  -9.100
  333    HB3  PHE  45           HB3      PHE  45  -9.462   2.640  -8.532
  334    H    MET  46           H        MET  46  -9.594   0.624  -9.829
  335    HA   MET  46           HA       MET  46  -8.174  -1.270  -8.356
  336    HB2  MET  46           HB2      MET  46 -10.605  -1.345  -8.676
  337    HB3  MET  46           HB3      MET  46 -10.377  -1.747 -10.372
  338    HG2  MET  46           HG2      MET  46 -10.953  -3.698  -9.000
  339    HG3  MET  46           HG3      MET  46  -9.387  -3.861  -9.794
  340    HE1  MET  46           HE1      MET  46 -10.079  -1.608  -6.639
  341    HE2  MET  46           HE2      MET  46  -9.823  -2.760  -5.327
  342    HE3  MET  46           HE3      MET  46 -11.197  -2.951  -6.416
  343    H    THR  47           H        THR  47  -8.101  -0.582 -11.762
  344    HA   THR  47           HA       THR  47  -6.954  -2.910 -12.771
  345    HB   THR  47           HB       THR  47  -6.469  -0.050 -13.639
  346    HG1  THR  47           HG1      THR  47  -8.697  -0.806 -13.672
  347   HG21  THR  47          HG21      THR  47  -4.772  -1.523 -14.574
  348   HG22  THR  47          HG22      THR  47  -5.906  -1.041 -15.836
  349   HG23  THR  47          HG23      THR  47  -6.016  -2.649 -15.117
  350    H    LYS  48           H        LYS  48  -5.337  -0.017 -11.427
  351    HA   LYS  48           HA       LYS  48  -2.733  -1.101 -11.867
  352    HB2  LYS  48           HB2      LYS  48  -1.929   0.844 -10.544
  353    HB3  LYS  48           HB3      LYS  48  -2.929   1.265 -11.926
  354    HG2  LYS  48           HG2      LYS  48  -4.856   1.468 -10.358
  355    HG3  LYS  48           HG3      LYS  48  -3.714   1.261  -9.031
  356    HD2  LYS  48           HD2      LYS  48  -3.457   3.392 -11.135
  357    HD3  LYS  48           HD3      LYS  48  -4.284   3.625  -9.602
  358    HE2  LYS  48           HE2      LYS  48  -2.243   3.142  -8.390
  359    HE3  LYS  48           HE3      LYS  48  -1.405   2.803  -9.905
  360    HZ1  LYS  48           HZ1      LYS  48  -1.587   5.059 -10.558
  361    HZ2  LYS  48           HZ2      LYS  48  -1.014   5.068  -8.957
  362    HZ3  LYS  48           HZ3      LYS  48  -2.639   5.426  -9.282
  363    H    LEU  49           H        LEU  49  -5.003  -1.179  -9.226
  364    HA   LEU  49           HA       LEU  49  -3.257  -2.007  -7.175
  365    HG   LEU  49           HG       LEU  49  -6.505  -1.380  -5.504
  366    HB2  LEU  49           HB2      LEU  49  -6.179  -2.447  -7.697
  367    HB3  LEU  49           HB3      LEU  49  -5.394  -3.318  -6.397
  368   HD11  LEU  49          HD11      LEU  49  -3.529  -0.958  -5.574
  369   HD12  LEU  49          HD12      LEU  49  -4.409  -2.011  -4.466
  370   HD13  LEU  49          HD13      LEU  49  -4.648  -0.265  -4.399
  371   HD21  LEU  49          HD21      LEU  49  -6.549  -0.024  -7.532
  372   HD22  LEU  49          HD22      LEU  49  -4.815   0.262  -7.376
  373   HD23  LEU  49          HD23      LEU  49  -5.927   0.882  -6.153
  374    H    LYS  50           H        LYS  50  -4.960  -3.855  -9.681
  375    HA   LYS  50           HA       LYS  50  -4.108  -6.409  -8.848
  376    HB2  LYS  50           HB2      LYS  50  -5.351  -5.248 -11.233
  377    HB3  LYS  50           HB3      LYS  50  -4.325  -6.631 -11.581
  378    HG2  LYS  50           HG2      LYS  50  -6.614  -7.332 -11.243
  379    HG3  LYS  50           HG3      LYS  50  -5.580  -7.971  -9.967
  380    HD2  LYS  50           HD2      LYS  50  -6.317  -6.095  -8.510
  381    HD3  LYS  50           HD3      LYS  50  -7.447  -5.612  -9.778
  382    HE2  LYS  50           HE2      LYS  50  -7.408  -8.260  -8.341
  383    HE3  LYS  50           HE3      LYS  50  -8.562  -6.953  -8.080
  384    HZ1  LYS  50           HZ1      LYS  50  -9.356  -7.222 -10.332
  385    HZ2  LYS  50           HZ2      LYS  50  -9.449  -8.705  -9.511
  386    HZ3  LYS  50           HZ3      LYS  50  -8.206  -8.434 -10.634
  387    H    GLU  51           H        GLU  51  -2.677  -4.045 -11.027
  388    HA   GLU  51           HA       GLU  51  -0.490  -5.552 -11.914
  389    HB2  GLU  51           HB2      GLU  51  -0.616  -2.577 -11.445
  390    HB3  GLU  51           HB3      GLU  51   0.520  -3.420 -12.492
  391    HG2  GLU  51           HG2      GLU  51  -2.451  -3.517 -12.895
  392    HG3  GLU  51           HG3      GLU  51  -1.416  -2.293 -13.613
  393    H    LEU  52           H        LEU  52  -0.841  -3.327  -9.197
  394    HA   LEU  52           HA       LEU  52   1.815  -3.537  -8.263
  395    HG   LEU  52           HG       LEU  52   0.079  -1.120  -8.728
  396    HB2  LEU  52           HB2      LEU  52  -0.745  -2.620  -6.974
  397    HB3  LEU  52           HB3      LEU  52   0.800  -2.531  -6.163
  398   HD11  LEU  52          HD11      LEU  52   0.479  -0.075  -5.932
  399   HD12  LEU  52          HD12      LEU  52  -1.051  -0.169  -6.805
  400   HD13  LEU  52          HD13      LEU  52   0.224   0.912  -7.371
  401   HD21  LEU  52          HD21      LEU  52   2.593  -1.003  -7.068
  402   HD22  LEU  52          HD22      LEU  52   2.233   0.012  -8.464
  403   HD23  LEU  52          HD23      LEU  52   2.433  -1.729  -8.667
  404    H    ALA  53           H        ALA  53  -1.170  -5.225  -7.387
  405    HA   ALA  53           HA       ALA  53  -0.262  -6.453  -5.041
  406    HB1  ALA  53           HB1      ALA  53  -2.302  -7.516  -6.990
  407    HB2  ALA  53           HB2      ALA  53  -2.623  -6.355  -5.702
  408    HB3  ALA  53           HB3      ALA  53  -2.117  -7.996  -5.302
  409    H    ALA  54           H        ALA  54  -0.098  -7.541  -8.401
  410    HA   ALA  54           HA       ALA  54   0.821 -10.147  -7.871
  411    HB1  ALA  54           HB1      ALA  54   1.453 -10.216 -10.224
  412    HB2  ALA  54           HB2      ALA  54   1.251  -8.468 -10.339
  413    HB3  ALA  54           HB3      ALA  54  -0.145  -9.498 -10.017
  414    H    ALA  55           H        ALA  55   2.514  -7.095  -8.229
  415    HA   ALA  55           HA       ALA  55   5.108  -8.377  -8.309
  416    HB1  ALA  55           HB1      ALA  55   4.718  -6.356  -9.616
  417    HB2  ALA  55           HB2      ALA  55   5.997  -6.106  -8.428
  418    HB3  ALA  55           HB3      ALA  55   4.384  -5.457  -8.136
  419    H    ALA  56           H        ALA  56   3.078  -6.753  -5.963
  420    HA   ALA  56           HA       ALA  56   5.200  -6.374  -4.062
  421    HB1  ALA  56           HB1      ALA  56   3.473  -5.533  -2.577
  422    HB2  ALA  56           HB2      ALA  56   2.225  -6.101  -3.686
  423    HB3  ALA  56           HB3      ALA  56   3.327  -4.817  -4.182
  424    H    SER  57           H        SER  57   2.375  -8.545  -4.217
  425    HA   SER  57           HA       SER  57   3.296  -9.824  -1.768
  426    HG   SER  57           HG       SER  57   0.899  -9.697  -4.290
  427    HB2  SER  57           HB2      SER  57   1.103 -10.958  -1.781
  428    HB3  SER  57           HB3      SER  57   0.940  -9.205  -1.860
  429    H    SER  58           H        SER  58   3.046 -12.222  -1.655
  430    HA   SER  58           HA       SER  58   4.395 -13.456  -3.917
  431    HG   SER  58           HG       SER  58   5.216 -12.941  -1.009
  432    HB2  SER  58           HB2      SER  58   3.683 -14.576  -1.193
  433    HB3  SER  58           HB3      SER  58   4.697 -15.369  -2.397
  434    H    ALA  59           H        ALA  59   1.369 -12.726  -3.459
  435    HA   ALA  59           HA       ALA  59   0.111 -15.269  -4.010
  436    HB1  ALA  59           HB1      ALA  59  -1.964 -14.023  -4.070
  437    HB2  ALA  59           HB2      ALA  59  -1.081 -12.498  -4.048
  438    HB3  ALA  59           HB3      ALA  59  -1.033 -13.561  -2.642
  439    H    ASP  60           H        ASP  60   0.670 -16.053  -5.915
  440    HA   ASP  60           HA       ASP  60   1.560 -14.472  -8.082
  441    HB2  ASP  60           HB2      ASP  60   2.431 -16.681  -7.745
  442    HB3  ASP  60           HB3      ASP  60   0.831 -17.395  -7.901
  443    H    GLU  61           H        GLU  61  -1.572 -15.840  -7.309
  444    HA   GLU  61           HA       GLU  61  -2.565 -15.059  -9.958
  445    HB2  GLU  61           HB2      GLU  61  -3.056 -17.351  -9.021
  446    HB3  GLU  61           HB3      GLU  61  -4.048 -16.569  -7.800
  447    HG2  GLU  61           HG2      GLU  61  -5.601 -15.811  -9.407
  448    HG3  GLU  61           HG3      GLU  61  -4.520 -16.213 -10.741
  449    H    GLY  62           H        GLY  62  -1.941 -13.481  -7.308
  450    HA2  GLY  62           HA2      GLY  62  -2.742 -11.189  -7.192
  451    HA3  GLY  62           HA3      GLY  62  -4.356 -11.799  -7.524
  452    H    ALA  63           H        ALA  63  -3.112 -10.216  -5.267
  453    HA   ALA  63           HA       ALA  63  -3.203 -11.779  -2.921
  454    HB1  ALA  63           HB1      ALA  63  -3.714  -8.822  -3.255
  455    HB2  ALA  63           HB2      ALA  63  -2.142  -9.577  -2.985
  456    HB3  ALA  63           HB3      ALA  63  -3.382  -9.649  -1.733
  457    H    SER  64           H        SER  64  -4.836 -11.893  -1.321
  458    HA   SER  64           HA       SER  64  -7.451 -12.277  -2.361
  459    HG   SER  64           HG       SER  64  -5.654 -14.074  -0.057
  460    HB2  SER  64           HB2      SER  64  -6.462 -12.220   0.499
  461    HB3  SER  64           HB3      SER  64  -8.052 -12.778  -0.014
  462    H    VAL  65           H        VAL  65  -8.316 -10.403  -3.125
  463    HA   VAL  65           HA       VAL  65  -8.512  -8.168  -1.236
  464    HB   VAL  65           HB       VAL  65  -7.281  -7.488  -3.178
  465   HG11  VAL  65          HG11      VAL  65  -8.043  -9.198  -4.745
  466   HG12  VAL  65          HG12      VAL  65  -8.181  -7.585  -5.440
  467   HG13  VAL  65          HG13      VAL  65  -9.619  -8.412  -4.843
  468   HG21  VAL  65          HG21      VAL  65  -8.820  -5.859  -2.229
  469   HG22  VAL  65          HG22      VAL  65 -10.098  -6.419  -3.308
  470   HG23  VAL  65          HG23      VAL  65  -8.665  -5.634  -3.972
  471    H    ALA  66           H        ALA  66 -10.393  -7.969  -0.312
  472    HA   ALA  66           HA       ALA  66 -12.834  -8.606  -1.814
  473    HB1  ALA  66           HB1      ALA  66 -12.480  -7.923   1.109
  474    HB2  ALA  66           HB2      ALA  66 -12.682  -9.545   0.448
  475    HB3  ALA  66           HB3      ALA  66 -13.996  -8.376   0.329
  476    H    TYR  67           H        TYR  67 -13.317  -6.914  -3.102
  477    HA   TYR  67           HA       TYR  67 -13.060  -4.222  -1.924
  478    HD1  TYR  67           HD1      TYR  67 -11.244  -6.776  -4.737
  479    HD2  TYR  67           HD2      TYR  67 -13.806  -3.641  -6.041
  480    HE1  TYR  67           HE1      TYR  67 -11.549  -7.927  -6.888
  481    HE2  TYR  67           HE2      TYR  67 -14.122  -4.785  -8.193
  482    HH   TYR  67           HH       TYR  67 -12.965  -6.418  -9.596
  483    HB2  TYR  67           HB2      TYR  67 -12.400  -3.353  -4.100
  484    HB3  TYR  67           HB3      TYR  67 -11.290  -4.611  -3.581
  485    H    LYS  68           H        LYS  68 -14.436  -2.589  -2.815
  486    HA   LYS  68           HA       LYS  68 -16.715  -3.511  -4.383
  487    HB2  LYS  68           HB2      LYS  68 -18.370  -2.716  -2.918
  488    HB3  LYS  68           HB3      LYS  68 -17.257  -3.588  -1.873
  489    HG2  LYS  68           HG2      LYS  68 -16.273  -1.530  -1.120
  490    HG3  LYS  68           HG3      LYS  68 -17.230  -0.603  -2.275
  491    HD2  LYS  68           HD2      LYS  68 -18.331  -0.358  -0.204
  492    HD3  LYS  68           HD3      LYS  68 -19.281  -1.537  -1.108
  493    HE2  LYS  68           HE2      LYS  68 -19.110  -2.403   1.075
  494    HE3  LYS  68           HE3      LYS  68 -17.959  -3.326   0.108
  495    HZ1  LYS  68           HZ1      LYS  68 -16.159  -2.033   0.988
  496    HZ2  LYS  68           HZ2      LYS  68 -17.086  -2.597   2.292
  497    HZ3  LYS  68           HZ3      LYS  68 -17.230  -0.985   1.784
  498    H    ILE  69           H        ILE  69 -17.693  -1.900  -5.547
  499    HA   ILE  69           HA       ILE  69 -16.377   0.733  -5.522
  500    HB   ILE  69           HB       ILE  69 -17.914  -0.570  -7.784
  501   HG12  ILE  69          HG12      ILE  69 -14.942  -0.061  -7.499
  502   HG13  ILE  69          HG13      ILE  69 -15.719  -1.635  -7.350
  503   HG21  ILE  69          HG21      ILE  69 -16.354   2.012  -7.708
  504   HG22  ILE  69          HG22      ILE  69 -18.110   1.867  -7.766
  505   HG23  ILE  69          HG23      ILE  69 -17.134   1.318  -9.129
  506   HD11  ILE  69          HD11      ILE  69 -14.680  -1.350  -9.531
  507   HD12  ILE  69          HD12      ILE  69 -15.668   0.081  -9.824
  508   HD13  ILE  69          HD13      ILE  69 -16.431  -1.503  -9.678
  509    H    LYS  70           H        LYS  70 -17.611   2.072  -4.303
  510    HA   LYS  70           HA       LYS  70 -20.514   1.619  -4.364
  511    HB2  LYS  70           HB2      LYS  70 -19.447   1.540  -2.164
  512    HB3  LYS  70           HB3      LYS  70 -18.848   3.171  -2.391
  513    HG2  LYS  70           HG2      LYS  70 -20.702   3.402  -0.992
  514    HG3  LYS  70           HG3      LYS  70 -21.282   3.878  -2.585
  515    HD2  LYS  70           HD2      LYS  70 -21.633   1.094  -1.488
  516    HD3  LYS  70           HD3      LYS  70 -22.806   2.380  -1.206
  517    HE2  LYS  70           HE2      LYS  70 -23.030   2.640  -3.661
  518    HE3  LYS  70           HE3      LYS  70 -21.948   1.265  -3.872
  519    HZ1  LYS  70           HZ1      LYS  70 -23.543  -0.104  -2.644
  520    HZ2  LYS  70           HZ2      LYS  70 -24.235   0.565  -4.042
  521    HZ3  LYS  70           HZ3      LYS  70 -24.594   1.224  -2.518
  522    H    ASP  71           H        ASP  71 -21.563   2.810  -5.681
  523    HA   ASP  71           HA       ASP  71 -20.659   5.288  -6.731
  524    HB2  ASP  71           HB2      ASP  71 -22.957   5.416  -7.695
  525    HB3  ASP  71           HB3      ASP  71 -22.136   3.905  -8.055
  526    H    LEU  72           H        LEU  72 -20.871   7.271  -5.879
  527    HA   LEU  72           HA       LEU  72 -22.744   7.600  -3.628
  528    HG   LEU  72           HG       LEU  72 -19.608   6.833  -3.427
  529    HB2  LEU  72           HB2      LEU  72 -20.174   9.122  -4.095
  530    HB3  LEU  72           HB3      LEU  72 -21.238   9.269  -2.708
  531   HD11  LEU  72          HD11      LEU  72 -18.231   8.679  -2.659
  532   HD12  LEU  72          HD12      LEU  72 -18.305   7.407  -1.439
  533   HD13  LEU  72          HD13      LEU  72 -19.260   8.877  -1.241
  534   HD21  LEU  72          HD21      LEU  72 -21.295   7.385  -0.990
  535   HD22  LEU  72          HD22      LEU  72 -20.307   5.951  -1.279
  536   HD23  LEU  72          HD23      LEU  72 -21.711   6.275  -2.295
  537    H    GLU  73           H        GLU  73 -22.746  10.311  -3.401
  538    HA   GLU  73           HA       GLU  73 -24.150  11.062  -5.833
  539    HB2  GLU  73           HB2      GLU  73 -25.196  11.417  -3.590
  540    HB3  GLU  73           HB3      GLU  73 -23.933  12.587  -3.233
  541    HG2  GLU  73           HG2      GLU  73 -25.987  13.679  -3.936
  542    HG3  GLU  73           HG3      GLU  73 -24.673  13.982  -5.072
  543    H    GLY  74           H        GLY  74 -22.716  11.660  -7.362
  544    HA2  GLY  74           HA2      GLY  74 -21.456  13.282  -8.458
  545    HA3  GLY  74           HA3      GLY  74 -21.287  14.148  -6.938
  546    H    GLN  75           H        GLN  75 -20.540  10.840  -6.736
  547    HA   GLN  75           HA       GLN  75 -17.872  10.801  -7.603
  548    HB2  GLN  75           HB2      GLN  75 -16.683  10.900  -5.465
  549    HB3  GLN  75           HB3      GLN  75 -17.499  12.420  -5.791
  550    HG2  GLN  75           HG2      GLN  75 -19.347  11.650  -4.295
  551    HG3  GLN  75           HG3      GLN  75 -18.338  10.271  -3.865
  552   HE21  GLN  75          HE21      GLN  75 -17.085  13.455  -4.521
  553   HE22  GLN  75          HE22      GLN  75 -16.585  13.812  -2.904
  554    H    VAL  76           H        VAL  76 -16.684   8.914  -6.266
  555    HA   VAL  76           HA       VAL  76 -18.618   6.909  -5.335
  556    HB   VAL  76           HB       VAL  76 -17.530   5.128  -6.635
  557   HG11  VAL  76          HG11      VAL  76 -19.557   6.083  -7.526
  558   HG12  VAL  76          HG12      VAL  76 -18.459   5.676  -8.844
  559   HG13  VAL  76          HG13      VAL  76 -18.640   7.356  -8.333
  560   HG21  VAL  76          HG21      VAL  76 -15.350   6.138  -6.950
  561   HG22  VAL  76          HG22      VAL  76 -16.050   7.367  -8.002
  562   HG23  VAL  76          HG23      VAL  76 -16.043   5.677  -8.506
  563    H    GLU  77           H        GLU  77 -17.647   5.262  -4.024
  564    HA   GLU  77           HA       GLU  77 -14.926   5.928  -3.133
  565    HB2  GLU  77           HB2      GLU  77 -16.514   6.133  -1.300
  566    HB3  GLU  77           HB3      GLU  77 -17.122   4.510  -1.608
  567    HG2  GLU  77           HG2      GLU  77 -14.981   3.554  -1.000
  568    HG3  GLU  77           HG3      GLU  77 -14.301   5.162  -0.777
  569    H    LEU  78           H        LEU  78 -13.434   4.640  -3.879
  570    HA   LEU  78           HA       LEU  78 -14.077   1.879  -4.570
  571    HG   LEU  78           HG       LEU  78 -11.103   1.751  -6.768
  572    HB2  LEU  78           HB2      LEU  78 -12.628   3.372  -6.027
  573    HB3  LEU  78           HB3      LEU  78 -11.407   3.284  -4.777
  574   HD11  LEU  78          HD11      LEU  78 -11.226   0.470  -4.048
  575   HD12  LEU  78          HD12      LEU  78  -9.882   1.411  -4.692
  576   HD13  LEU  78          HD13      LEU  78 -10.317  -0.129  -5.434
  577   HD21  LEU  78          HD21      LEU  78 -12.363  -0.345  -6.754
  578   HD22  LEU  78          HD22      LEU  78 -13.406   1.048  -7.034
  579   HD23  LEU  78          HD23      LEU  78 -13.372   0.276  -5.447
  580    H    ASP  79           H        ASP  79 -14.078   0.486  -2.979
  581    HA   ASP  79           HA       ASP  79 -12.218   0.892  -0.721
  582    HB2  ASP  79           HB2      ASP  79 -14.458   1.238   0.064
  583    HB3  ASP  79           HB3      ASP  79 -15.034  -0.203  -0.763
  584    H    ALA  80           H        ALA  80 -10.942  -0.800  -0.137
  585    HA   ALA  80           HA       ALA  80 -11.492  -3.441  -1.227
  586    HB1  ALA  80           HB1      ALA  80 -10.248  -2.308  -3.006
  587    HB2  ALA  80           HB2      ALA  80  -9.329  -3.643  -2.311
  588    HB3  ALA  80           HB3      ALA  80  -8.938  -1.979  -1.874
  589    H    ALA  81           H        ALA  81 -10.746  -5.057   0.008
  590    HA   ALA  81           HA       ALA  81  -8.850  -4.398   2.170
  591    HB1  ALA  81           HB1      ALA  81 -10.914  -6.605   2.120
  592    HB2  ALA  81           HB2      ALA  81 -11.079  -5.073   2.975
  593    HB3  ALA  81           HB3      ALA  81  -9.828  -6.218   3.456
  594    H    PHE  82           H        PHE  82  -6.882  -5.057   1.621
  595    HA   PHE  82           HA       PHE  82  -6.576  -7.390  -0.144
  596    HD1  PHE  82           HD1      PHE  82  -6.253  -3.517  -0.540
  597    HD2  PHE  82           HD2      PHE  82  -4.733  -6.940  -2.565
  598    HE1  PHE  82           HE1      PHE  82  -6.902  -2.526  -2.696
  599    HE2  PHE  82           HE2      PHE  82  -5.383  -5.954  -4.725
  600    HZ   PHE  82           HZ       PHE  82  -6.466  -3.741  -4.790
  601    HB2  PHE  82           HB2      PHE  82  -4.765  -5.082   0.564
  602    HB3  PHE  82           HB3      PHE  82  -4.164  -6.510  -0.267
  603    H    THR  83           H        THR  83  -6.299  -9.254   0.913
  604    HA   THR  83           HA       THR  83  -4.675  -9.300   3.342
  605    HB   THR  83           HB       THR  83  -6.132 -11.575   1.969
  606    HG1  THR  83           HG1      THR  83  -6.845  -9.998   4.249
  607   HG21  THR  83          HG21      THR  83  -4.250 -12.301   3.373
  608   HG22  THR  83          HG22      THR  83  -5.800 -12.766   4.077
  609   HG23  THR  83          HG23      THR  83  -4.914 -11.386   4.728
  610    H    PHE  84           H        PHE  84  -2.551  -9.514   3.125
  611    HA   PHE  84           HA       PHE  84  -1.475 -10.683   0.667
  612    HD1  PHE  84           HD1      PHE  84   0.102  -8.688  -0.790
  613    HD2  PHE  84           HD2      PHE  84  -1.588  -7.191   2.813
  614    HE1  PHE  84           HE1      PHE  84  -0.589  -6.644  -1.968
  615    HE2  PHE  84           HE2      PHE  84  -2.284  -5.142   1.643
  616    HZ   PHE  84           HZ       PHE  84  -1.785  -4.867  -0.750
  617    HB2  PHE  84           HB2      PHE  84  -0.120  -9.080   2.846
  618    HB3  PHE  84           HB3      PHE  84   0.660  -9.659   1.378
  619    H    SER  85           H        SER  85   0.886 -11.675   1.274
  620    HA   SER  85           HA       SER  85   0.222 -13.875   3.099
  621    HG   SER  85           HG       SER  85   2.394 -12.679   0.704
  622    HB2  SER  85           HB2      SER  85   2.219 -14.970   1.818
  623    HB3  SER  85           HB3      SER  85   0.650 -14.837   1.025
  624    H    CYS  86           H        CYS  86   2.194 -11.140   2.820
  625    HA   CYS  86           HA       CYS  86   3.730 -12.000   5.168
  626    HG   CYS  86           HG       CYS  86   5.049 -12.588   1.390
  627    HB2  CYS  86           HB2      CYS  86   4.962 -10.467   2.872
  628    HB3  CYS  86           HB3      CYS  86   5.783 -11.109   4.288
  629    H    GLN  87           H        GLN  87   4.536 -10.202   6.447
  630    HA   GLN  87           HA       GLN  87   2.716  -8.090   6.771
  631    HB2  GLN  87           HB2      GLN  87   4.164  -8.813   8.590
  632    HB3  GLN  87           HB3      GLN  87   5.587  -8.307   7.691
  633    HG2  GLN  87           HG2      GLN  87   5.160  -6.631   9.303
  634    HG3  GLN  87           HG3      GLN  87   4.687  -5.978   7.744
  635   HE21  GLN  87          HE21      GLN  87   2.779  -8.323   9.480
  636   HE22  GLN  87          HE22      GLN  87   1.453  -7.259   9.823
  637    H    ALA  88           H        ALA  88   5.947  -8.152   5.308
  638    HA   ALA  88           HA       ALA  88   6.193  -5.421   4.814
  639    HB1  ALA  88           HB1      ALA  88   7.919  -6.003   3.215
  640    HB2  ALA  88           HB2      ALA  88   7.343  -7.670   3.167
  641    HB3  ALA  88           HB3      ALA  88   8.053  -7.022   4.647
  642    H    GLU  89           H        GLU  89   4.764  -7.971   2.855
  643    HA   GLU  89           HA       GLU  89   4.458  -6.594   0.458
  644    HB2  GLU  89           HB2      GLU  89   2.601  -8.686   1.593
  645    HB3  GLU  89           HB3      GLU  89   2.788  -8.260  -0.104
  646    HG2  GLU  89           HG2      GLU  89   5.051  -9.099  -0.099
  647    HG3  GLU  89           HG3      GLU  89   4.948  -9.437   1.629
  648    H    MET  90           H        MET  90   2.559  -6.466   3.390
  649    HA   MET  90           HA       MET  90   0.321  -5.120   2.223
  650    HB2  MET  90           HB2      MET  90   0.139  -6.398   4.324
  651    HB3  MET  90           HB3      MET  90   1.213  -5.248   5.110
  652    HG2  MET  90           HG2      MET  90  -0.453  -3.464   4.610
  653    HG3  MET  90           HG3      MET  90  -1.540  -4.721   4.025
  654    HE1  MET  90           HE1      MET  90   0.977  -4.834   7.032
  655    HE2  MET  90           HE2      MET  90  -0.067  -4.389   8.382
  656    HE3  MET  90           HE3      MET  90   0.310  -3.205   7.131
  657    H    ILE  91           H        ILE  91   2.933  -4.036   4.376
  658    HA   ILE  91           HA       ILE  91   2.168  -1.323   4.231
  659    HB   ILE  91           HB       ILE  91   4.599  -1.029   5.217
  660   HG12  ILE  91          HG12      ILE  91   4.012  -3.963   5.691
  661   HG13  ILE  91          HG13      ILE  91   5.350  -3.323   4.751
  662   HG21  ILE  91          HG21      ILE  91   2.495  -0.603   6.374
  663   HG22  ILE  91          HG22      ILE  91   3.657  -1.405   7.430
  664   HG23  ILE  91          HG23      ILE  91   2.331  -2.325   6.720
  665   HD11  ILE  91          HD11      ILE  91   6.097  -4.037   6.935
  666   HD12  ILE  91          HD12      ILE  91   4.929  -2.964   7.706
  667   HD13  ILE  91          HD13      ILE  91   6.263  -2.288   6.772
  668    H    ILE  92           H        ILE  92   4.545  -3.198   2.375
  669    HA   ILE  92           HA       ILE  92   5.695  -0.906   1.130
  670    HB   ILE  92           HB       ILE  92   6.636  -2.407  -0.521
  671   HG12  ILE  92          HG12      ILE  92   4.961  -4.591   0.722
  672   HG13  ILE  92          HG13      ILE  92   4.669  -3.858  -0.852
  673   HG21  ILE  92          HG21      ILE  92   7.899  -3.897   0.960
  674   HG22  ILE  92          HG22      ILE  92   6.741  -3.565   2.250
  675   HG23  ILE  92          HG23      ILE  92   7.751  -2.265   1.616
  676   HD11  ILE  92          HD11      ILE  92   7.081  -5.469  -0.053
  677   HD12  ILE  92          HD12      ILE  92   6.848  -4.689  -1.617
  678   HD13  ILE  92          HD13      ILE  92   5.768  -5.987  -1.110
  679    H    PHE  93           H        PHE  93   2.892  -2.866   0.557
  680    HA   PHE  93           HA       PHE  93   2.282  -2.030  -2.062
  681    HD1  PHE  93           HD2      PHE  93   0.990  -4.189  -3.245
  682    HD2  PHE  93           HD1      PHE  93  -1.674  -1.945  -0.804
  683    HE1  PHE  93           HE2      PHE  93  -0.720  -4.317  -5.005
  684    HE2  PHE  93           HE1      PHE  93  -3.390  -2.072  -2.559
  685    HZ   PHE  93           HZ       PHE  93  -2.913  -3.258  -4.664
  686    HB2  PHE  93           HB2      PHE  93   1.278  -3.970  -0.778
  687    HB3  PHE  93           HB3      PHE  93   0.313  -2.793   0.100
  688    H    GLU  94           H        GLU  94   1.236  -0.856   1.114
  689    HA   GLU  94           HA       GLU  94  -0.392   1.246   0.273
  690    HB2  GLU  94           HB2      GLU  94   1.316   1.525   2.723
  691    HB3  GLU  94           HB3      GLU  94  -0.352   2.019   2.473
  692    HG2  GLU  94           HG2      GLU  94  -0.889  -0.474   2.362
  693    HG3  GLU  94           HG3      GLU  94   0.725  -0.721   3.015
  694    H    LEU  95           H        LEU  95   3.089   1.130   0.900
  695    HA   LEU  95           HA       LEU  95   3.599   3.865   0.433
  696    HG   LEU  95           HG       LEU  95   4.757   1.785   2.462
  697    HB2  LEU  95           HB2      LEU  95   5.402   1.467   0.137
  698    HB3  LEU  95           HB3      LEU  95   5.950   3.129   0.038
  699   HD11  LEU  95          HD11      LEU  95   7.542   2.779   1.884
  700   HD12  LEU  95          HD12      LEU  95   7.035   1.092   1.959
  701   HD13  LEU  95          HD13      LEU  95   6.980   2.093   3.410
  702   HD21  LEU  95          HD21      LEU  95   4.094   4.129   2.359
  703   HD22  LEU  95          HD22      LEU  95   5.773   4.605   2.108
  704   HD23  LEU  95          HD23      LEU  95   5.284   3.871   3.636
  705    H    SER  96           H        SER  96   3.853   1.029  -1.707
  706    HA   SER  96           HA       SER  96   4.652   2.266  -4.039
  707    HG   SER  96           HG       SER  96   4.610  -0.555  -2.785
  708    HB2  SER  96           HB2      SER  96   2.670  -0.008  -3.743
  709    HB3  SER  96           HB3      SER  96   3.528   0.407  -5.228
  710    H    LEU  97           H        LEU  97   1.363   2.006  -2.730
  711    HA   LEU  97           HA       LEU  97  -0.052   3.146  -4.851
  712    HG   LEU  97           HG       LEU  97  -0.505   1.084  -2.438
  713    HB2  LEU  97           HB2      LEU  97  -0.610   3.486  -1.899
  714    HB3  LEU  97           HB3      LEU  97  -1.761   3.730  -3.200
  715   HD11  LEU  97          HD11      LEU  97  -3.300   2.149  -2.034
  716   HD12  LEU  97          HD12      LEU  97  -2.095   1.875  -0.774
  717   HD13  LEU  97          HD13      LEU  97  -2.757   0.510  -1.674
  718   HD21  LEU  97          HD21      LEU  97  -2.107   0.131  -4.021
  719   HD22  LEU  97          HD22      LEU  97  -0.997   1.241  -4.828
  720   HD23  LEU  97          HD23      LEU  97  -2.645   1.751  -4.461
  721    H    ARG  98           H        ARG  98   1.503   4.673  -2.082
  722    HA   ARG  98           HA       ARG  98   0.633   7.313  -2.783
  723    HE   ARG  98           HE       ARG  98  -0.931   6.318   2.019
  724    HB2  ARG  98           HB2      ARG  98   2.658   6.386  -0.741
  725    HB3  ARG  98           HB3      ARG  98   1.988   8.010  -0.853
  726    HG2  ARG  98           HG2      ARG  98  -0.156   7.278  -0.217
  727    HG3  ARG  98           HG3      ARG  98   0.272   5.582  -0.453
  728    HD2  ARG  98           HD2      ARG  98   1.900   5.788   1.394
  729    HD3  ARG  98           HD3      ARG  98   1.341   7.438   1.667
  730   HH11  ARG  98          HH11      ARG  98   2.114   4.798   2.828
  731   HH12  ARG  98          HH12      ARG  98   1.441   3.807   4.088
  732   HH21  ARG  98          HH21      ARG  98  -1.826   5.054   3.651
  733   HH22  ARG  98          HH22      ARG  98  -0.830   3.946   4.556
  734    H    SER  99           H        SER  99   3.531   5.409  -3.255
  735    HA   SER  99           HA       SER  99   5.164   7.662  -3.973
  736    HG   SER  99           HG       SER  99   5.440   5.100  -2.182
  737    HB2  SER  99           HB2      SER  99   5.701   4.707  -4.355
  738    HB3  SER  99           HB3      SER  99   6.892   6.006  -4.442
  739    H    LEU 100           H        LEU 100   3.318   5.211  -5.697
  740    HA   LEU 100           HA       LEU 100   4.383   5.787  -8.270
  741    HG   LEU 100           HG       LEU 100   1.900   5.094  -9.958
  742    HB2  LEU 100           HB2      LEU 100   3.236   3.687  -7.646
  743    HB3  LEU 100           HB3      LEU 100   1.724   4.561  -7.548
  744   HD11  LEU 100          HD11      LEU 100   4.313   5.009 -10.203
  745   HD12  LEU 100          HD12      LEU 100   3.542   3.885 -11.322
  746   HD13  LEU 100          HD13      LEU 100   4.308   3.280  -9.855
  747   HD21  LEU 100          HD21      LEU 100   2.060   2.159  -9.282
  748   HD22  LEU 100          HD22      LEU 100   1.401   2.836 -10.771
  749   HD23  LEU 100          HD23      LEU 100   0.611   3.163  -9.227
  750    H    ALA 101           H        ALA 101   2.092   7.343  -6.265
  751    HA   ALA 101           HA       ALA 101   0.646   8.754  -8.266
  752    HB1  ALA 101           HB1      ALA 101   1.153   9.500  -5.382
  753    HB2  ALA 101           HB2      ALA 101  -0.204   8.543  -5.979
  754    HB3  ALA 101           HB3      ALA 101  -0.048  10.237  -6.443
  755    H    LEU 102           H        LEU 102   3.753   9.034  -6.872
  756    HA   LEU 102           HA       LEU 102   5.554  10.327  -7.237
  757    HG   LEU 102           HG       LEU 102   4.431   8.892  -9.770
  758    HB2  LEU 102           HB2      LEU 102   3.976  11.306  -9.616
  759    HB3  LEU 102           HB3      LEU 102   5.680  11.605  -9.339
  760   HD11  LEU 102          HD11      LEU 102   5.614   8.928 -11.901
  761   HD12  LEU 102          HD12      LEU 102   6.176  10.566 -11.569
  762   HD13  LEU 102          HD13      LEU 102   4.456  10.256 -11.795
  763   HD21  LEU 102          HD21      LEU 102   7.322   9.700  -9.471
  764   HD22  LEU 102          HD22      LEU 102   6.734   8.082  -9.857
  765   HD23  LEU 102          HD23      LEU 102   6.372   8.802  -8.289
  766    H    GLU 103           H        GLU 103   2.860  12.434  -8.163
  767    HA   GLU 103           HA       GLU 103   4.042  14.829  -7.367
  768    HB2  GLU 103           HB2      GLU 103   2.210  14.840  -8.896
  769    HB3  GLU 103           HB3      GLU 103   1.158  14.037  -7.740
  770    HG2  GLU 103           HG2      GLU 103   1.166  16.020  -6.332
  771    HG3  GLU 103           HG3      GLU 103   2.259  16.824  -7.459
  772    H    HIS 104           H        HIS 104   1.970  12.616  -5.586
  773    HA   HIS 104           HA       HIS 104   1.503  12.356  -3.381
  774    HD1  HIS 104           HD1      HIS 104   5.818  13.621  -3.545
  775    HD2  HIS 104           HD2      HIS 104   3.328  10.593  -2.152
  776    HE1  HIS 104           HE1      HIS 104   7.228  11.540  -3.521
  777    HE2  HIS 104           HE2      HIS 104   5.757   9.764  -2.499
  778    HB2  HIS 104           HB2      HIS 104   3.611  14.478  -2.928
  779    HB3  HIS 104           HB3      HIS 104   2.824  13.555  -1.656
  780    H    HIS 105           H        HIS 105  -0.155  13.074  -2.172
  781    HA   HIS 105           HA       HIS 105  -0.726  15.938  -2.110
  782    HD1  HIS 105           HD1      HIS 105  -2.357  17.447  -3.974
  783    HD2  HIS 105           HD2      HIS 105  -4.929  15.339  -1.477
  784    HE1  HIS 105           HE1      HIS 105  -4.242  19.028  -3.446
  785    HE2  HIS 105           HE2      HIS 105  -5.892  17.654  -2.127
  786    HB2  HIS 105           HB2      HIS 105  -2.054  14.816  -3.975
  787    HB3  HIS 105           HB3      HIS 105  -2.909  13.935  -2.712
  788    H    HIS 106           H        HIS 106  -2.319  12.904  -1.100
  789    HA   HIS 106           HA       HIS 106  -2.652  13.956   1.579
  790    HD1  HIS 106           HD1      HIS 106  -3.978  10.012   2.858
  791    HD2  HIS 106           HD2      HIS 106  -5.117  14.016   2.728
  792    HE1  HIS 106           HE1      HIS 106  -5.299  10.418   4.963
  793    HE2  HIS 106           HE2      HIS 106  -5.824  12.883   4.950
  794    HB2  HIS 106           HB2      HIS 106  -4.292  12.406   0.270
  795    HB3  HIS 106           HB3      HIS 106  -3.219  11.111   0.787
  796    H    HIS 107           H        HIS 107  -1.058  13.857   3.016
  797    HA   HIS 107           HA       HIS 107   1.344  12.484   2.224
  798    HD1  HIS 107           HD1      HIS 107   1.111  16.757   3.774
  799    HD2  HIS 107           HD2      HIS 107   2.860  14.031   1.161
  800    HE1  HIS 107           HE1      HIS 107   2.010  18.123   1.861
  801    HE2  HIS 107           HE2      HIS 107   2.924  16.440   0.221
  802    HB2  HIS 107           HB2      HIS 107   0.717  14.388   4.465
  803    HB3  HIS 107           HB3      HIS 107   2.292  13.621   4.297
  804    H    HIS 108           H        HIS 108   1.635  10.465   2.622
  805    HA   HIS 108           HA       HIS 108   2.397   8.697   3.797
  806    HD1  HIS 108           HD1      HIS 108   2.700   7.754   7.585
  807    HD2  HIS 108           HD2      HIS 108   5.340   9.211   4.710
  808    HE1  HIS 108           HE1      HIS 108   4.809   6.403   7.846
  809    HE2  HIS 108           HE2      HIS 108   6.435   7.398   6.193
  810    HB2  HIS 108           HB2      HIS 108   3.014  10.735   5.415
  811    HB3  HIS 108           HB3      HIS 108   1.885   9.885   6.465
  812    H    HIS 109           H        HIS 109  -0.659   9.481   3.604
  813    HA   HIS 109           HA       HIS 109  -1.485   7.015   4.934
  814    HD1  HIS 109           HD1      HIS 109  -3.217   9.919   8.019
  815    HD2  HIS 109           HD2      HIS 109  -1.427   6.315   6.958
  816    HE1  HIS 109           HE1      HIS 109  -2.546   8.829  10.186
  817    HE2  HIS 109           HE2      HIS 109  -1.659   6.564   9.529
  818    HB2  HIS 109           HB2      HIS 109  -2.569   9.725   5.495
  819    HB3  HIS 109           HB3      HIS 109  -3.729   8.407   5.371